Browse entries in the PDBbind-CN Database
HEADER HYDROLASE/HYDROLASE INHIBITOR 15-OCT-10 3P92 TITLE HUMAN MESOTRYPSIN COMPLEXED WITH BOVINE PANCREATIC TRYPSIN INHIBITOR TITLE 2 VARIANT (BPTI-K15R/R17G) COMPND MOL_ID: 1; COMPND 2 MOLECULE: PRSS3 PROTEIN; COMPND 3 CHAIN: A; COMPND 4 EC: 3.4.21.4; COMPND 5 ENGINEERED: YES; COMPND 6 MUTATION: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: PANCREATIC TRYPSIN INHIBITOR; COMPND 9 CHAIN: E; COMPND 10 FRAGMENT: UNP RESIDUES 36-93; COMPND 11 SYNONYM: APROTININ, BASIC PROTEASE INHIBITOR, BPI, BPTI; COMPND 12 ENGINEERED: YES; COMPND 13 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: PRSS3; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 MOL_ID: 2; SOURCE 9 ORGANISM_SCIENTIFIC: BOS TAURUS; SOURCE 10 ORGANISM_COMMON: BOVINE,COW,DOMESTIC CATTLE,DOMESTIC COW; SOURCE 11 ORGANISM_TAXID: 9913; SOURCE 12 EXPRESSION_SYSTEM: PICHIA PASTORIS; SOURCE 13 EXPRESSION_SYSTEM_TAXID: 4922 KEYWDS MESOTRYPSIN, TRYPSIN IV, CANONICAL INHIBITOR, BOVINE PANCREATIC KEYWDS 2 TRYPSIN INIBITOR, BPTI, HYDROLASE-HYDROLASE INHIBITOR COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR M.A.SALAMEH,A.S.SOARES,E.S.RADISKY REVDAT 3 08-OCT-14 3P92 1 AUTHOR REVDAT 2 09-NOV-11 3P92 1 JRNL REVDAT 1 31-AUG-11 3P92 0 JRNL AUTH M.A.SALAMEH,A.S.SOARES,A.HOCKLA,D.C.RADISKY,E.S.RADISKY JRNL TITL THE P2' RESIDUE IS A KEY DETERMINANT OF MESOTRYPSIN JRNL TITL 2 SPECIFICITY: ENGINEERING A HIGH-AFFINITY INHIBITOR WITH JRNL TITL 3 ANTICANCER ACTIVITY. JRNL REF BIOCHEM.J. V. 440 95 2011 JRNL REFN ISSN 0264-6021 JRNL PMID 21806544 JRNL DOI 10.1042/BJ20110788 REMARK 2 REMARK 2 RESOLUTION. 1.60 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (PHENIX.REFINE) REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE- REMARK 3 : KUNSTLEVE,LI-WEI HUNG,ROBERT IMMORMINO, REMARK 3 : TOM IOERGER,AIRLIE MCCOY,ERIK MCKEE,NIGEL REMARK 3 : MORIARTY,REETAL PAI,RANDY READ,JANE REMARK 3 : RICHARDSON,DAVID RICHARDSON,TOD ROMO,JIM REMARK 3 : SACCHETTINI,NICHOLAS SAUTER,JACOB SMITH, REMARK 3 : LAURENT STORONI,TOM TERWILLIGER,PETER REMARK 3 : ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : MLHL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.60 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 33.85 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 0.180 REMARK 3 COMPLETENESS FOR RANGE (%) : 88.3 REMARK 3 NUMBER OF REFLECTIONS : 27380 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.115 REMARK 3 R VALUE (WORKING SET) : 0.111 REMARK 3 FREE R VALUE : 0.159 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 7.300 REMARK 3 FREE R VALUE TEST SET COUNT : 2000 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 33.8586 - 3.8525 0.94 2000 158 0.1506 0.1655 REMARK 3 2 3.8525 - 3.0585 0.95 1985 156 0.1139 0.1506 REMARK 3 3 3.0585 - 2.6721 1.00 2048 162 0.1213 0.1758 REMARK 3 4 2.6721 - 2.4278 1.00 2052 162 0.1049 0.1453 REMARK 3 5 2.4278 - 2.2539 1.00 2053 161 0.1010 0.1649 REMARK 3 6 2.2539 - 2.1210 1.00 2052 162 0.0944 0.1462 REMARK 3 7 2.1210 - 2.0148 1.00 2026 159 0.0920 0.1548 REMARK 3 8 2.0148 - 1.9271 0.99 2018 159 0.0943 0.1485 REMARK 3 9 1.9271 - 1.8529 0.99 2028 161 0.0993 0.1628 REMARK 3 10 1.8529 - 1.7890 0.93 1896 148 0.0940 0.1564 REMARK 3 11 1.7890 - 1.7330 0.81 1664 131 0.0870 0.1459 REMARK 3 12 1.7330 - 1.6835 0.69 1423 113 0.0836 0.1643 REMARK 3 13 1.6835 - 1.6392 0.57 1147 90 0.0811 0.1883 REMARK 3 14 1.6392 - 1.5992 0.48 988 78 0.0822 0.1432 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : FLAT BULK SOLVENT MODEL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : 0.48 REMARK 3 B_SOL : 64.39 REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.130 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 14.170 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 7.48 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 15.89 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.85860 REMARK 3 B22 (A**2) : -0.76990 REMARK 3 B33 (A**2) : -1.69040 REMARK 3 B12 (A**2) : -0.00000 REMARK 3 B13 (A**2) : 0.19390 REMARK 3 B23 (A**2) : -0.00000 REMARK 3 REMARK 3 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.007 4328 REMARK 3 ANGLE : 0.907 7781 REMARK 3 CHIRALITY : 0.078 327 REMARK 3 PLANARITY : 0.004 695 REMARK 3 DIHEDRAL : 16.461 1072 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 NCS DETAILS REMARK 3 NUMBER OF NCS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 3P92 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 20-OCT-10. REMARK 100 THE RCSB ID CODE IS RCSB062109. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : NULL REMARK 200 TEMPERATURE (KELVIN) : NULL REMARK 200 PH : 8.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : NSLS REMARK 200 BEAMLINE : X12B REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : NULL REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 4 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 27380 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.599 REMARK 200 RESOLUTION RANGE LOW (A) : 33.851 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 88.9 REMARK 200 DATA REDUNDANCY : 6.500 REMARK 200 R MERGE (I) : 0.03200 REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 39.8000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: PDB ENTRY 2R9P REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 35.75 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 1.91 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 25% PEG4000, 0.2M NA ACETATE AND 100MM REMARK 280 TRIS PH 8.0, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 21 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 19.61100 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2, 3 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, E REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 3 REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 APPLY THE FOLLOWING TO CHAINS: E REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 475 REMARK 475 ZERO OCCUPANCY RESIDUES REMARK 475 THE FOLLOWING RESIDUES WERE MODELED WITH ZERO OCCUPANCY. REMARK 475 THE LOCATION AND PROPERTIES OF THESE RESIDUES MAY NOT REMARK 475 BE RELIABLE. (M=MODEL NUMBER; RES=RESIDUE NAME; REMARK 475 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE) REMARK 475 M RES C SSEQI REMARK 475 ALA E 58 REMARK 480 REMARK 480 ZERO OCCUPANCY ATOM REMARK 480 THE FOLLOWING RESIDUES HAVE ATOMS MODELED WITH ZERO REMARK 480 OCCUPANCY. THE LOCATION AND PROPERTIES OF THESE ATOMS REMARK 480 MAY NOT BE RELIABLE. (M=MODEL NUMBER; RES=RESIDUE NAME; REMARK 480 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 480 M RES C SSEQI ATOMS REMARK 480 ARG A 62 CD NE CZ NH1 NH2 REMARK 480 LYS A 74 CE NZ REMARK 480 LYS A 87 CG CD CE NZ REMARK 480 LYS A 93 NZ REMARK 480 LYS A 169 NZ REMARK 480 LYS A 222 CD CE NZ REMARK 480 SER A 246 OXT REMARK 480 LYS E 26 CD CE NZ REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 LEU A 27 73.31 -119.33 REMARK 500 HIS A 71 -64.83 -124.30 REMARK 500 SER A 214 -76.58 -123.34 REMARK 500 ASN E 44 110.77 -162.31 REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A 1 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 VAL A 75 O REMARK 620 2 GLU A 80 OE2 90.2 REMARK 620 3 ASN A 72 O 84.9 169.6 REMARK 620 4 GLU A 70 OE1 162.1 100.7 86.4 REMARK 620 5 HOH A 269 O 86.3 90.0 98.8 79.6 REMARK 620 6 GLU A 77 OE2 102.8 85.6 86.5 92.2 169.8 REMARK 620 N 1 2 3 4 5 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 1 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2R9P RELATED DB: PDB REMARK 900 HUMAN MESOTRYPSIN COMPLEXED WITH BPTI DBREF 3P92 A 16 246 UNP Q8N2U3 Q8N2U3_HUMAN 28 251 DBREF 3P92 E 1 58 UNP P00974 BPT1_BOVIN 36 93 SEQADV 3P92 ALA A 195 UNP Q8N2U3 SER 204 ENGINEERED MUTATION SEQADV 3P92 ARG E 15 UNP P00974 LYS 50 ENGINEERED MUTATION SEQADV 3P92 GLY E 17 UNP P00974 ARG 52 ENGINEERED MUTATION SEQRES 1 A 224 ILE VAL GLY GLY TYR THR CYS GLU GLU ASN SER LEU PRO SEQRES 2 A 224 TYR GLN VAL SER LEU ASN SER GLY SER HIS PHE CYS GLY SEQRES 3 A 224 GLY SER LEU ILE SER GLU GLN TRP VAL VAL SER ALA ALA SEQRES 4 A 224 HIS CYS TYR LYS THR ARG ILE GLN VAL ARG LEU GLY GLU SEQRES 5 A 224 HIS ASN ILE LYS VAL LEU GLU GLY ASN GLU GLN PHE ILE SEQRES 6 A 224 ASN ALA ALA LYS ILE ILE ARG HIS PRO LYS TYR ASN ARG SEQRES 7 A 224 ASP THR LEU ASP ASN ASP ILE MET LEU ILE LYS LEU SER SEQRES 8 A 224 SER PRO ALA VAL ILE ASN ALA ARG VAL SER THR ILE SER SEQRES 9 A 224 LEU PRO THR ALA PRO PRO ALA ALA GLY THR GLU CYS LEU SEQRES 10 A 224 ILE SER GLY TRP GLY ASN THR LEU SER PHE GLY ALA ASP SEQRES 11 A 224 TYR PRO ASP GLU LEU LYS CYS LEU ASP ALA PRO VAL LEU SEQRES 12 A 224 THR GLN ALA GLU CYS LYS ALA SER TYR PRO GLY LYS ILE SEQRES 13 A 224 THR ASN SER MET PHE CYS VAL GLY PHE LEU GLU GLY GLY SEQRES 14 A 224 LYS ASP SER CYS GLN ARG ASP ALA GLY GLY PRO VAL VAL SEQRES 15 A 224 CYS ASN GLY GLN LEU GLN GLY VAL VAL SER TRP GLY HIS SEQRES 16 A 224 GLY CYS ALA TRP LYS ASN ARG PRO GLY VAL TYR THR LYS SEQRES 17 A 224 VAL TYR ASN TYR VAL ASP TRP ILE LYS ASP THR ILE ALA SEQRES 18 A 224 ALA ASN SER SEQRES 1 E 58 ARG PRO ASP PHE CYS LEU GLU PRO PRO TYR THR GLY PRO SEQRES 2 E 58 CYS ARG ALA GLY ILE ILE ARG TYR PHE TYR ASN ALA LYS SEQRES 3 E 58 ALA GLY LEU CYS GLN THR PHE VAL TYR GLY GLY CYS ARG SEQRES 4 E 58 ALA LYS ARG ASN ASN PHE LYS SER ALA GLU ASP CYS MET SEQRES 5 E 58 ARG THR CYS GLY GLY ALA HET CA A 1 1 HETNAM CA CALCIUM ION FORMUL 3 CA CA 2+ FORMUL 4 HOH *299(H2 O) HELIX 1 1 ALA A 55 TYR A 59 5 5 HELIX 2 2 THR A 164 TYR A 172 1 9 HELIX 3 3 TYR A 234 ASN A 245 1 12 HELIX 4 4 PRO E 2 GLU E 7 5 6 HELIX 5 5 SER E 47 GLY E 56 1 10 SHEET 1 A 7 TYR A 20 THR A 21 0 SHEET 2 A 7 LYS A 156 PRO A 161 -1 O CYS A 157 N TYR A 20 SHEET 3 A 7 GLU A 135 GLY A 140 -1 N ILE A 138 O LEU A 158 SHEET 4 A 7 PRO A 198 CYS A 201 -1 O VAL A 200 N LEU A 137 SHEET 5 A 7 GLN A 204 TRP A 215 -1 O GLN A 204 N CYS A 201 SHEET 6 A 7 GLY A 226 LYS A 230 -1 O VAL A 227 N TRP A 215 SHEET 7 A 7 MET A 180 VAL A 183 -1 N PHE A 181 O TYR A 228 SHEET 1 B 7 GLN A 30 ASN A 34 0 SHEET 2 B 7 HIS A 40 SER A 48 -1 O CYS A 42 N LEU A 33 SHEET 3 B 7 TRP A 51 SER A 54 -1 O VAL A 53 N SER A 45 SHEET 4 B 7 MET A 104 LEU A 108 -1 O ILE A 106 N VAL A 52 SHEET 5 B 7 GLN A 81 ARG A 90 -1 N ALA A 86 O LYS A 107 SHEET 6 B 7 GLN A 64 LEU A 67 -1 N LEU A 67 O GLN A 81 SHEET 7 B 7 GLN A 30 ASN A 34 -1 N SER A 32 O ARG A 66 SHEET 1 C 2 ILE E 18 ASN E 24 0 SHEET 2 C 2 LEU E 29 TYR E 35 -1 O TYR E 35 N ILE E 18 SSBOND 1 CYS A 22 CYS A 157 1555 1555 2.04 SSBOND 2 CYS A 42 CYS A 58 1555 1555 2.06 SSBOND 3 CYS A 136 CYS A 201 1555 1555 2.05 SSBOND 4 CYS A 168 CYS A 182 1555 1555 2.06 SSBOND 5 CYS A 191 CYS A 220 1555 1555 2.07 SSBOND 6 CYS E 5 CYS E 55 1555 1555 2.02 SSBOND 7 CYS E 14 CYS E 38 1555 1555 2.04 SSBOND 8 CYS E 30 CYS E 51 1555 1555 2.05 LINK O VAL A 75 CA CA A 1 1555 1555 2.31 LINK OE2 GLU A 80 CA CA A 1 1555 1555 2.32 LINK O ASN A 72 CA CA A 1 1555 1555 2.34 LINK OE1 GLU A 70 CA CA A 1 1555 1555 2.36 LINK CA CA A 1 O HOH A 269 1555 1555 2.43 LINK OE2 GLU A 77 CA CA A 1 1555 1555 2.54 SITE 1 AC1 6 GLU A 70 ASN A 72 VAL A 75 GLU A 77 SITE 2 AC1 6 GLU A 80 HOH A 269 CRYST1 44.282 39.222 68.807 90.00 100.28 90.00 P 1 21 1 2 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.022583 0.000000 0.004097 0.00000 SCALE2 0.000000 0.025496 0.000000 0.00000 SCALE3 0.000000 0.000000 0.014771 0.00000 ATOM 1 N ILE A 16 9.956 -12.232 12.137 1.00 4.75 N ANISOU 1 N ILE A 16 590 430 783 144 -125 124 N ATOM 2 CA ILE A 16 10.310 -13.407 12.944 1.00 5.21 C ANISOU 2 CA ILE A 16 682 543 756 215 10 -13 C ATOM 3 C ILE A 16 11.551 -14.089 12.350 1.00 6.15 C ANISOU 3 C ILE A 16 872 649 817 298 100 -82 C ATOM 4 O ILE A 16 11.540 -14.494 11.176 1.00 6.55 O ANISOU 4 O ILE A 16 980 760 749 87 262 46 O ATOM 5 CB ILE A 16 9.159 -14.458 12.975 1.00 6.02 C ANISOU 5 CB ILE A 16 727 711 849 165 74 -86 C ATOM 6 CG1 ILE A 16 7.842 -13.866 13.501 1.00 6.06 C ANISOU 6 CG1 ILE A 16 783 741 780 151 233 -171 C ATOM 7 CG2 ILE A 16 9.574 -15.688 13.794 1.00 7.13 C ANISOU 7 CG2 ILE A 16 860 885 965 53 -13 -38 C ATOM 8 CD1 ILE A 16 7.837 -13.579 15.000 1.00 8.08 C ANISOU 8 CD1 ILE A 16 1038 1013 1018 278 364 -58 C ATOM 9 HA ILE A 16 10.510 -13.131 13.863 1.00 6.25 H ATOM 10 HB ILE A 16 9.005 -14.752 12.063 1.00 7.22 H ATOM 11 HG12 ILE A 16 7.671 -13.030 13.040 1.00 7.28 H ATOM 12 HG13 ILE A 16 7.124 -14.493 13.318 1.00 7.28 H ATOM 13 HG21 ILE A 16 8.851 -16.319 13.798 1.00 8.56 H ATOM 14 HG22 ILE A 16 10.351 -16.083 13.392 1.00 8.56 H ATOM 15 HG23 ILE A 16 9.773 -15.411 14.692 1.00 8.56 H ATOM 16 HD11 ILE A 16 6.984 -13.213 15.245 1.00 9.69 H ATOM 17 HD12 ILE A 16 7.991 -14.398 15.476 1.00 9.69 H ATOM 18 HD13 ILE A 16 8.533 -12.948 15.200 1.00 9.69 H ATOM 19 N VAL A 17 12.609 -14.186 13.159 1.00 6.34 N ANISOU 19 N VAL A 17 841 672 896 338 139 -226 N ATOM 20 CA VAL A 17 13.857 -14.839 12.778 1.00 7.23 C ANISOU 20 CA VAL A 17 901 854 993 325 -31 -110 C ATOM 21 C VAL A 17 13.886 -16.264 13.364 1.00 7.52 C ANISOU 21 C VAL A 17 882 961 1014 118 -41 -161 C ATOM 22 O VAL A 17 13.617 -16.476 14.548 1.00 7.99 O ANISOU 22 O VAL A 17 995 1020 1023 94 -23 -68 O ATOM 23 CB VAL A 17 15.066 -14.035 13.307 1.00 7.60 C ANISOU 23 CB VAL A 17 982 867 1040 214 51 -288 C ATOM 24 CG1 VAL A 17 16.396 -14.714 12.944 1.00 8.28 C ANISOU 24 CG1 VAL A 17 1002 1013 1132 -57 8 -464 C ATOM 25 CG2 VAL A 17 15.027 -12.610 12.777 1.00 8.65 C ANISOU 25 CG2 VAL A 17 1097 1023 1166 204 181 -298 C ATOM 26 H VAL A 17 12.624 -13.870 13.959 1.00 7.61 H ATOM 27 HA VAL A 17 13.918 -14.896 11.802 1.00 8.68 H ATOM 28 HB VAL A 17 15.010 -13.991 14.284 1.00 9.12 H ATOM 29 HG11 VAL A 17 17.120 -14.185 13.289 1.00 9.94 H ATOM 30 HG12 VAL A 17 16.416 -15.591 13.334 1.00 9.94 H ATOM 31 HG13 VAL A 17 16.463 -14.778 11.988 1.00 9.94 H ATOM 32 HG21 VAL A 17 15.785 -12.130 13.117 1.00 10.37 H ATOM 33 HG22 VAL A 17 15.057 -12.632 11.818 1.00 10.37 H ATOM 34 HG23 VAL A 17 14.215 -12.190 13.070 1.00 10.37 H ATOM 35 N GLY A 18 14.181 -17.242 12.522 1.00 7.56 N ANISOU 35 N GLY A 18 876 934 1064 294 3 -212 N ATOM 36 CA GLY A 18 14.382 -18.600 12.984 1.00 6.66 C ANISOU 36 CA GLY A 18 825 817 890 116 59 -143 C ATOM 37 C GLY A 18 13.106 -19.368 13.254 1.00 7.74 C ANISOU 37 C GLY A 18 996 942 1004 33 88 -201 C ATOM 38 O GLY A 18 13.127 -20.363 13.984 1.00 8.36 O ANISOU 38 O GLY A 18 1037 1048 1093 63 93 -112 O ATOM 39 H GLY A 18 14.270 -17.142 11.673 1.00 9.08 H ATOM 40 HA2 GLY A 18 14.890 -19.088 12.318 1.00 7.99 H ATOM 41 HA3 GLY A 18 14.899 -18.581 13.804 1.00 7.99 H ATOM 42 N GLY A 19 12.002 -18.885 12.694 1.00 7.83 N ANISOU 42 N GLY A 19 959 988 1029 -3 88 -160 N ATOM 43 CA GLY A 19 10.708 -19.531 12.822 1.00 8.96 C ANISOU 43 CA GLY A 19 1101 1152 1152 -148 -11 -207 C ATOM 44 C GLY A 19 10.331 -20.329 11.587 1.00 8.10 C ANISOU 44 C GLY A 19 959 1063 1056 -147 54 -96 C ATOM 45 O GLY A 19 11.196 -20.835 10.868 1.00 8.30 O ANISOU 45 O GLY A 19 826 1229 1097 -139 -23 -62 O ATOM 46 H GLY A 19 11.980 -18.165 12.224 1.00 9.40 H ATOM 47 HA2 GLY A 19 10.722 -20.131 13.584 1.00 10.75 H ATOM 48 HA3 GLY A 19 10.026 -18.858 12.973 1.00 10.75 H ATOM 49 N TYR A 20 9.027 -20.439 11.360 1.00 7.38 N ANISOU 49 N TYR A 20 934 886 983 118 54 -24 N ATOM 50 CA TYR A 20 8.459 -21.249 10.289 1.00 7.37 C ANISOU 50 CA TYR A 20 953 866 980 -114 17 -89 C ATOM 51 C TYR A 20 7.177 -20.591 9.800 1.00 7.47 C ANISOU 51 C TYR A 20 1023 895 919 -77 -140 -163 C ATOM 52 O TYR A 20 6.582 -19.792 10.496 1.00 7.71 O ANISOU 52 O TYR A 20 1083 1042 803 34 -371 -129 O ATOM 53 CB TYR A 20 8.186 -22.687 10.770 1.00 7.37 C ANISOU 53 CB TYR A 20 1025 791 986 -51 153 -86 C ATOM 54 CG TYR A 20 7.259 -22.792 11.978 1.00 7.83 C ANISOU 54 CG TYR A 20 1026 804 1146 9 99 -107 C ATOM 55 CD1 TYR A 20 7.753 -22.666 13.268 1.00 8.06 C ANISOU 55 CD1 TYR A 20 1055 876 1132 20 56 55 C ATOM 56 CD2 TYR A 20 5.889 -22.994 11.815 1.00 9.02 C ANISOU 56 CD2 TYR A 20 1229 971 1227 -96 6 -88 C ATOM 57 CE1 TYR A 20 6.903 -22.742 14.381 1.00 8.69 C ANISOU 57 CE1 TYR A 20 1156 982 1166 -28 21 18 C ATOM 58 CE2 TYR A 20 5.039 -23.067 12.900 1.00 8.30 C ANISOU 58 CE2 TYR A 20 1081 879 1195 -24 -71 -25 C ATOM 59 CZ TYR A 20 5.545 -22.936 14.184 1.00 8.35 C ANISOU 59 CZ TYR A 20 1090 886 1197 -81 78 -106 C ATOM 60 OH TYR A 20 4.668 -23.040 15.247 1.00 9.19 O ANISOU 60 OH TYR A 20 1187 1030 1275 -153 153 -162 O ATOM 61 H TYR A 20 8.429 -20.038 11.831 1.00 8.85 H ATOM 62 HA TYR A 20 9.091 -21.289 9.541 1.00 8.84 H ATOM 63 HB2 TYR A 20 7.778 -23.184 10.044 1.00 8.85 H ATOM 64 HB3 TYR A 20 9.031 -23.098 11.012 1.00 8.85 H ATOM 65 HD1 TYR A 20 8.663 -22.525 13.397 1.00 9.68 H ATOM 66 HD2 TYR A 20 5.539 -23.072 10.957 1.00 10.82 H ATOM 67 HE1 TYR A 20 7.246 -22.661 15.241 1.00 10.43 H ATOM 68 HE2 TYR A 20 4.128 -23.207 12.770 1.00 9.96 H ATOM 69 HH TYR A 20 4.691 -22.355 15.697 1.00 11.03 H ATOM 70 N THR A 21 6.754 -20.902 8.585 1.00 7.75 N ANISOU 70 N THR A 21 1022 939 985 149 -101 -248 N ATOM 71 CA THR A 21 5.496 -20.363 8.074 1.00 8.71 C ANISOU 71 CA THR A 21 1090 1160 1058 141 -8 -262 C ATOM 72 C THR A 21 4.320 -20.988 8.819 1.00 7.52 C ANISOU 72 C THR A 21 854 996 1008 286 -56 -137 C ATOM 73 O THR A 21 4.196 -22.224 8.918 1.00 7.99 O ANISOU 73 O THR A 21 939 1050 1048 461 -13 -109 O ATOM 74 CB THR A 21 5.378 -20.602 6.550 1.00 9.11 C ANISOU 74 CB THR A 21 1136 1246 1082 30 4 -197 C ATOM 75 OG1 THR A 21 6.495 -19.982 5.892 1.00 9.88 O ANISOU 75 OG1 THR A 21 1265 1409 1080 134 95 -59 O ATOM 76 CG2 THR A 21 4.080 -20.032 5.996 1.00 10.03 C ANISOU 76 CG2 THR A 21 1329 1224 1259 177 29 -48 C ATOM 77 H THR A 21 7.170 -21.418 8.037 1.00 9.30 H ATOM 78 HA THR A 21 5.476 -19.396 8.232 1.00 10.45 H ATOM 79 HB THR A 21 5.392 -21.556 6.373 1.00 10.94 H ATOM 80 HG1 THR A 21 6.445 -20.102 5.083 1.00 11.86 H ATOM 81 HG21 THR A 21 4.029 -20.192 5.051 1.00 12.04 H ATOM 82 HG22 THR A 21 3.329 -20.451 6.424 1.00 12.04 H ATOM 83 HG23 THR A 21 4.042 -19.086 6.155 1.00 12.04 H ATOM 84 N CYS A 22 3.473 -20.130 9.383 1.00 7.46 N ANISOU 84 N CYS A 22 944 900 990 196 22 -67 N ATOM 85 CA CYS A 22 2.264 -20.594 10.072 1.00 8.10 C ANISOU 85 CA CYS A 22 977 979 1120 103 -25 -104 C ATOM 86 C CYS A 22 1.346 -21.307 9.102 1.00 9.50 C ANISOU 86 C CYS A 22 1013 1242 1354 -40 14 -249 C ATOM 87 O CYS A 22 1.302 -20.984 7.910 1.00 9.66 O ANISOU 87 O CYS A 22 950 1278 1443 -118 22 -273 O ATOM 88 CB CYS A 22 1.477 -19.432 10.709 1.00 8.12 C ANISOU 88 CB CYS A 22 966 1080 1040 223 -41 -117 C ATOM 89 SG CYS A 22 2.398 -18.253 11.747 1.00 8.10 S ANISOU 89 SG CYS A 22 1076 965 1035 64 68 -47 S ATOM 90 H CYS A 22 3.572 -19.276 9.381 1.00 8.95 H ATOM 91 HA CYS A 22 2.515 -21.223 10.781 1.00 9.71 H ATOM 92 HB2 CYS A 22 1.069 -18.919 9.994 1.00 9.74 H ATOM 93 HB3 CYS A 22 0.779 -19.812 11.265 1.00 9.74 H ATOM 94 N GLU A 23 0.595 -22.275 9.609 1.00 11.83 N ANISOU 94 N GLU A 23 1429 1472 1594 -213 107 -296 N ATOM 95 CA GLU A 23 -0.482 -22.855 8.816 1.00 14.82 C ANISOU 95 CA GLU A 23 1795 1852 1984 -249 156 -190 C ATOM 96 C GLU A 23 -1.482 -21.753 8.444 1.00 12.43 C ANISOU 96 C GLU A 23 1386 1596 1740 -215 32 -218 C ATOM 97 O GLU A 23 -1.810 -20.895 9.262 1.00 10.94 O ANISOU 97 O GLU A 23 1037 1557 1562 -80 36 -127 O ATOM 98 CB GLU A 23 -1.137 -23.997 9.597 1.00 20.76 C ANISOU 98 CB GLU A 23 2594 2544 2748 -183 216 9 C ATOM 99 CG GLU A 23 -0.178 -25.165 9.778 1.00 33.86 C ANISOU 99 CG GLU A 23 4306 4239 4320 -321 427 228 C ATOM 100 CD GLU A 23 -0.720 -26.262 10.670 1.00 34.69 C ANISOU 100 CD GLU A 23 4441 4324 4418 -314 560 417 C ATOM 101 OE1 GLU A 23 -1.958 -26.337 10.851 1.00 34.77 O ANISOU 101 OE1 GLU A 23 4425 4272 4516 -520 737 374 O ATOM 102 OE2 GLU A 23 0.105 -27.054 11.183 1.00 35.04 O ANISOU 102 OE2 GLU A 23 4528 4315 4470 -207 521 638 O ATOM 103 H GLU A 23 0.685 -22.610 10.396 1.00 14.20 H ATOM 104 HA GLU A 23 -0.110 -23.224 7.988 1.00 17.78 H ATOM 105 HB2 GLU A 23 -1.397 -23.678 10.476 1.00 24.91 H ATOM 106 HB3 GLU A 23 -1.915 -24.314 9.111 1.00 24.91 H ATOM 107 HG2 GLU A 23 0.009 -25.554 8.909 1.00 40.63 H ATOM 108 HG3 GLU A 23 0.644 -24.837 10.176 1.00 40.63 H ATOM 109 N GLU A 24 -1.937 -21.748 7.197 1.00 13.28 N ANISOU 109 N GLU A 24 1567 1681 1798 -133 38 -406 N ATOM 110 CA GLU A 24 -2.810 -20.667 6.713 1.00 16.40 C ANISOU 110 CA GLU A 24 2037 2048 2147 -189 -53 -465 C ATOM 111 C GLU A 24 -4.054 -20.453 7.591 1.00 14.64 C ANISOU 111 C GLU A 24 1755 1885 1922 -151 -248 -384 C ATOM 112 O GLU A 24 -4.830 -21.386 7.865 1.00 13.84 O ANISOU 112 O GLU A 24 1673 1789 1797 -220 -379 -394 O ATOM 113 CB GLU A 24 -3.239 -20.906 5.253 1.00 25.34 C ANISOU 113 CB GLU A 24 3205 3212 3211 -230 184 -483 C ATOM 114 CG GLU A 24 -2.081 -21.018 4.290 1.00 36.11 C ANISOU 114 CG GLU A 24 4558 4675 4488 -235 363 -539 C ATOM 115 CD GLU A 24 -2.533 -21.028 2.838 1.00 37.86 C ANISOU 115 CD GLU A 24 4778 5198 4408 -207 483 -565 C ATOM 116 OE1 GLU A 24 -1.661 -21.192 1.941 1.00 39.54 O ANISOU 116 OE1 GLU A 24 5135 5484 4405 -303 723 -624 O ATOM 117 OE2 GLU A 24 -3.757 -20.878 2.602 1.00 37.63 O ANISOU 117 OE2 GLU A 24 4609 5246 4443 -91 306 -532 O ATOM 118 H GLU A 24 -1.761 -22.351 6.610 1.00 15.93 H ATOM 119 HA GLU A 24 -2.298 -19.831 6.731 1.00 19.68 H ATOM 120 HB2 GLU A 24 -3.744 -21.732 5.206 1.00 30.41 H ATOM 121 HB3 GLU A 24 -3.794 -20.164 4.964 1.00 30.41 H ATOM 122 HG2 GLU A 24 -1.489 -20.259 4.416 1.00 43.33 H ATOM 123 HG3 GLU A 24 -1.604 -21.844 4.463 1.00 43.33 H ATOM 124 N ASN A 25 -4.200 -19.209 8.038 1.00 14.38 N ANISOU 124 N ASN A 25 1760 1817 1888 27 -268 -321 N ATOM 125 CA ASN A 25 -5.336 -18.756 8.843 1.00 15.23 C ANISOU 125 CA ASN A 25 1865 1969 1953 -133 -373 -288 C ATOM 126 C ASN A 25 -5.515 -19.559 10.148 1.00 13.82 C ANISOU 126 C ASN A 25 1712 1742 1795 -18 -373 -154 C ATOM 127 O ASN A 25 -6.603 -19.575 10.723 1.00 14.31 O ANISOU 127 O ASN A 25 1750 1854 1834 48 -294 -52 O ATOM 128 CB ASN A 25 -6.638 -18.768 8.025 1.00 16.66 C ANISOU 128 CB ASN A 25 2100 2128 2103 -324 -516 -255 C ATOM 129 CG ASN A 25 -6.526 -17.980 6.720 1.00 20.61 C ANISOU 129 CG ASN A 25 2690 2728 2413 -384 -703 -111 C ATOM 130 OD1 ASN A 25 -6.602 -18.556 5.638 1.00 22.77 O ANISOU 130 OD1 ASN A 25 3009 3147 2497 -419 -587 -223 O ATOM 131 ND2 ASN A 25 -6.318 -16.676 6.818 1.00 22.65 N ANISOU 131 ND2 ASN A 25 2899 2888 2819 -369 -909 239 N ATOM 132 H ASN A 25 -3.631 -18.583 7.881 1.00 17.26 H ATOM 133 HA ASN A 25 -5.170 -17.826 9.102 1.00 18.28 H ATOM 134 HB2 ASN A 25 -6.863 -19.685 7.803 1.00 19.99 H ATOM 135 HB3 ASN A 25 -7.347 -18.371 8.555 1.00 19.99 H ATOM 136 HD21 ASN A 25 -6.240 -16.130 6.008 1.00 27.18 H ATOM 137 HD22 ASN A 25 -6.244 -16.257 7.701 1.00 27.18 H ATOM 138 N SER A 26 -4.453 -20.205 10.628 1.00 12.14 N ANISOU 138 N SER A 26 1467 1453 1693 20 -468 -271 N ATOM 139 CA SER A 26 -4.511 -20.914 11.915 1.00 12.56 C ANISOU 139 CA SER A 26 1533 1541 1698 84 -414 -319 C ATOM 140 C SER A 26 -4.371 -20.005 13.146 1.00 10.44 C ANISOU 140 C SER A 26 1256 1277 1434 219 -334 -171 C ATOM 141 O SER A 26 -4.532 -20.464 14.288 1.00 9.68 O ANISOU 141 O SER A 26 1165 1123 1390 120 -189 12 O ATOM 142 CB SER A 26 -3.448 -22.007 11.987 1.00 14.71 C ANISOU 142 CB SER A 26 1850 1771 1967 238 -486 -405 C ATOM 143 OG SER A 26 -2.129 -21.483 11.914 1.00 15.90 O ANISOU 143 OG SER A 26 2072 1783 2186 348 -519 -733 O ATOM 144 H SER A 26 -3.690 -20.251 10.233 1.00 14.57 H ATOM 145 HA SER A 26 -5.384 -21.355 11.980 1.00 15.07 H ATOM 146 HB2 SER A 26 -3.548 -22.483 12.826 1.00 17.65 H ATOM 147 HB3 SER A 26 -3.581 -22.619 11.246 1.00 17.65 H ATOM 148 HG SER A 26 -2.156 -20.666 11.845 1.00 19.08 H ATOM 149 N LEU A 27 -4.042 -18.738 12.905 1.00 9.08 N ANISOU 149 N LEU A 27 1087 1077 1284 71 -361 -227 N ATOM 150 CA LEU A 27 -3.977 -17.698 13.946 1.00 9.01 C ANISOU 150 CA LEU A 27 1109 1025 1291 -145 -375 -255 C ATOM 151 C LEU A 27 -4.986 -16.608 13.585 1.00 7.55 C ANISOU 151 C LEU A 27 917 660 1290 -125 -74 -295 C ATOM 152 O LEU A 27 -4.619 -15.523 13.136 1.00 7.84 O ANISOU 152 O LEU A 27 1006 637 1337 -112 83 -195 O ATOM 153 CB LEU A 27 -2.569 -17.097 14.036 1.00 10.98 C ANISOU 153 CB LEU A 27 1333 1386 1453 -165 -565 -230 C ATOM 154 CG LEU A 27 -1.443 -17.947 14.649 1.00 13.84 C ANISOU 154 CG LEU A 27 1723 1758 1780 -126 -711 -305 C ATOM 155 CD1 LEU A 27 -1.082 -19.123 13.801 1.00 15.68 C ANISOU 155 CD1 LEU A 27 1952 1983 2022 -83 -708 -374 C ATOM 156 CD2 LEU A 27 -0.207 -17.083 14.896 1.00 15.57 C ANISOU 156 CD2 LEU A 27 1929 1942 2047 -15 -807 -311 C ATOM 157 H LEU A 27 -3.844 -18.443 12.122 1.00 10.89 H ATOM 158 HA LEU A 27 -4.217 -18.080 14.816 1.00 10.82 H ATOM 159 HB2 LEU A 27 -2.288 -16.866 13.136 1.00 13.18 H ATOM 160 HB3 LEU A 27 -2.627 -16.286 14.565 1.00 13.18 H ATOM 161 HG LEU A 27 -1.743 -18.285 15.507 1.00 16.61 H ATOM 162 HD11 LEU A 27 -0.378 -19.614 14.232 1.00 18.81 H ATOM 163 HD12 LEU A 27 -1.855 -19.682 13.697 1.00 18.81 H ATOM 164 HD13 LEU A 27 -0.786 -18.810 12.943 1.00 18.81 H ATOM 165 HD21 LEU A 27 0.484 -17.629 15.278 1.00 18.69 H ATOM 166 HD22 LEU A 27 0.090 -16.716 14.060 1.00 18.69 H ATOM 167 HD23 LEU A 27 -0.437 -16.374 15.502 1.00 18.69 H ATOM 168 N PRO A 28 -6.278 -16.900 13.759 1.00 8.38 N ANISOU 168 N PRO A 28 985 871 1327 -62 -94 -182 N ATOM 169 CA PRO A 28 -7.321 -16.009 13.226 1.00 8.48 C ANISOU 169 CA PRO A 28 975 1060 1187 -166 -81 -111 C ATOM 170 C PRO A 28 -7.395 -14.660 13.947 1.00 6.45 C ANISOU 170 C PRO A 28 644 899 909 -131 -46 -66 C ATOM 171 O PRO A 28 -8.069 -13.755 13.458 1.00 5.97 O ANISOU 171 O PRO A 28 512 1041 715 -81 -87 59 O ATOM 172 CB PRO A 28 -8.612 -16.821 13.441 1.00 10.19 C ANISOU 172 CB PRO A 28 1199 1303 1371 -182 -140 -200 C ATOM 173 CG PRO A 28 -8.280 -17.770 14.542 1.00 12.20 C ANISOU 173 CG PRO A 28 1501 1513 1620 -248 -153 -214 C ATOM 174 CD PRO A 28 -6.845 -18.145 14.311 1.00 10.38 C ANISOU 174 CD PRO A 28 1266 1243 1433 -180 -221 -189 C ATOM 175 HA PRO A 28 -7.186 -15.860 12.267 1.00 10.18 H ATOM 176 HB2 PRO A 28 -9.333 -16.227 13.704 1.00 12.23 H ATOM 177 HB3 PRO A 28 -8.838 -17.300 12.629 1.00 12.23 H ATOM 178 HG2 PRO A 28 -8.386 -17.327 15.399 1.00 14.64 H ATOM 179 HG3 PRO A 28 -8.853 -18.550 14.485 1.00 14.64 H ATOM 180 HD2 PRO A 28 -6.413 -18.374 15.149 1.00 12.45 H ATOM 181 HD3 PRO A 28 -6.780 -18.865 13.664 1.00 12.45 H ATOM 182 N TYR A 29 -6.701 -14.542 15.082 1.00 6.22 N ANISOU 182 N TYR A 29 765 778 819 42 -98 10 N ATOM 183 CA TYR A 29 -6.628 -13.305 15.880 1.00 5.68 C ANISOU 183 CA TYR A 29 750 683 725 -65 -146 -5 C ATOM 184 C TYR A 29 -5.495 -12.382 15.404 1.00 5.02 C ANISOU 184 C TYR A 29 723 562 622 41 -11 -19 C ATOM 185 O TYR A 29 -5.437 -11.219 15.799 1.00 5.17 O ANISOU 185 O TYR A 29 845 437 681 -119 95 -50 O ATOM 186 CB TYR A 29 -6.420 -13.649 17.383 1.00 4.70 C ANISOU 186 CB TYR A 29 577 590 618 -203 -4 81 C ATOM 187 CG TYR A 29 -5.221 -14.572 17.592 1.00 4.73 C ANISOU 187 CG TYR A 29 666 607 526 -60 -4 170 C ATOM 188 CD1 TYR A 29 -3.930 -14.052 17.713 1.00 4.31 C ANISOU 188 CD1 TYR A 29 567 577 493 0 -22 142 C ATOM 189 CD2 TYR A 29 -5.380 -15.957 17.621 1.00 5.46 C ANISOU 189 CD2 TYR A 29 705 737 631 -129 60 155 C ATOM 190 CE1 TYR A 29 -2.818 -14.902 17.881 1.00 5.22 C ANISOU 190 CE1 TYR A 29 620 696 669 -65 -101 45 C ATOM 191 CE2 TYR A 29 -4.288 -16.810 17.791 1.00 5.43 C ANISOU 191 CE2 TYR A 29 701 686 677 -176 65 102 C ATOM 192 CZ TYR A 29 -3.013 -16.280 17.919 1.00 5.11 C ANISOU 192 CZ TYR A 29 603 684 653 39 -137 45 C ATOM 193 OH TYR A 29 -1.945 -17.135 18.067 1.00 5.76 O ANISOU 193 OH TYR A 29 702 780 708 33 -173 -37 O ATOM 194 H TYR A 29 -6.247 -15.187 15.425 1.00 7.46 H ATOM 195 HA TYR A 29 -7.474 -12.818 15.794 1.00 6.81 H ATOM 196 HB2 TYR A 29 -6.262 -12.831 17.879 1.00 5.64 H ATOM 197 HB3 TYR A 29 -7.210 -14.099 17.720 1.00 5.64 H ATOM 198 HD1 TYR A 29 -3.803 -13.131 17.686 1.00 5.17 H ATOM 199 HD2 TYR A 29 -6.232 -16.320 17.534 1.00 6.55 H ATOM 200 HE1 TYR A 29 -1.963 -14.546 17.965 1.00 6.27 H ATOM 201 HE2 TYR A 29 -4.414 -17.731 17.811 1.00 6.52 H ATOM 202 HH TYR A 29 -1.558 -16.980 18.773 1.00 6.91 H ATOM 203 N GLN A 30 -4.577 -12.881 14.578 1.00 4.73 N ANISOU 203 N GLN A 30 481 664 653 -51 -146 -62 N ATOM 204 CA GLN A 30 -3.454 -12.056 14.117 1.00 4.89 C ANISOU 204 CA GLN A 30 593 598 668 -67 -120 -135 C ATOM 205 C GLN A 30 -3.899 -11.044 13.067 1.00 4.89 C ANISOU 205 C GLN A 30 676 569 615 -117 -63 -88 C ATOM 206 O GLN A 30 -4.514 -11.411 12.061 1.00 5.88 O ANISOU 206 O GLN A 30 888 732 614 121 24 -85 O ATOM 207 CB GLN A 30 -2.337 -12.945 13.535 1.00 6.47 C ANISOU 207 CB GLN A 30 774 851 832 56 -188 -122 C ATOM 208 CG GLN A 30 -1.265 -12.137 12.767 1.00 6.67 C ANISOU 208 CG GLN A 30 772 894 866 -36 36 -106 C ATOM 209 CD GLN A 30 -0.146 -11.591 13.653 1.00 7.10 C ANISOU 209 CD GLN A 30 1025 919 755 -33 95 -157 C ATOM 210 OE1 GLN A 30 0.175 -10.378 13.652 1.00 8.17 O ANISOU 210 OE1 GLN A 30 1236 1033 834 -38 183 -222 O ATOM 211 NE2 GLN A 30 0.466 -12.467 14.386 1.00 4.74 N ANISOU 211 NE2 GLN A 30 594 539 668 3 -55 -94 N ATOM 212 H GLN A 30 -4.578 -13.684 14.272 1.00 5.68 H ATOM 213 HA GLN A 30 -3.085 -11.562 14.879 1.00 5.87 H ATOM 214 HB2 GLN A 30 -1.896 -13.413 14.261 1.00 7.76 H ATOM 215 HB3 GLN A 30 -2.730 -13.583 12.919 1.00 7.76 H ATOM 216 HG2 GLN A 30 -0.860 -12.712 12.099 1.00 8.00 H ATOM 217 HG3 GLN A 30 -1.694 -11.382 12.334 1.00 8.00 H ATOM 218 HE21 GLN A 30 1.105 -12.221 14.906 1.00 5.69 H ATOM 219 HE22 GLN A 30 0.232 -13.294 14.353 1.00 5.69 H ATOM 220 N VAL A 31 -3.573 -9.775 13.283 1.00 5.36 N ANISOU 220 N VAL A 31 792 613 630 -126 -59 -51 N ATOM 221 CA VAL A 31 -3.828 -8.746 12.259 1.00 6.54 C ANISOU 221 CA VAL A 31 874 732 879 -81 15 20 C ATOM 222 C VAL A 31 -2.549 -8.061 11.802 1.00 5.27 C ANISOU 222 C VAL A 31 689 649 666 56 60 178 C ATOM 223 O VAL A 31 -1.498 -8.137 12.468 1.00 4.81 O ANISOU 223 O VAL A 31 705 684 440 92 261 223 O ATOM 224 CB VAL A 31 -4.876 -7.703 12.710 1.00 10.31 C ANISOU 224 CB VAL A 31 1293 1289 1335 -166 243 -151 C ATOM 225 CG1 VAL A 31 -6.097 -8.416 13.293 1.00 10.91 C ANISOU 225 CG1 VAL A 31 1328 1394 1424 -115 377 -98 C ATOM 226 CG2 VAL A 31 -4.310 -6.710 13.708 1.00 11.11 C ANISOU 226 CG2 VAL A 31 1313 1432 1475 -226 46 -246 C ATOM 227 H VAL A 31 -3.207 -9.478 14.003 1.00 6.43 H ATOM 228 HA VAL A 31 -4.201 -9.197 11.473 1.00 7.85 H ATOM 229 HB VAL A 31 -5.173 -7.199 11.924 1.00 12.37 H ATOM 230 HG11 VAL A 31 -6.740 -7.759 13.569 1.00 13.10 H ATOM 231 HG12 VAL A 31 -6.478 -8.985 12.620 1.00 13.10 H ATOM 232 HG13 VAL A 31 -5.821 -8.942 14.048 1.00 13.10 H ATOM 233 HG21 VAL A 31 -4.998 -6.088 13.953 1.00 13.33 H ATOM 234 HG22 VAL A 31 -4.006 -7.186 14.484 1.00 13.33 H ATOM 235 HG23 VAL A 31 -3.576 -6.243 13.301 1.00 13.33 H ATOM 236 N SER A 32 -2.646 -7.443 10.631 1.00 5.83 N ANISOU 236 N SER A 32 680 754 781 -35 -153 238 N ATOM 237 CA SER A 32 -1.603 -6.603 10.054 1.00 6.23 C ANISOU 237 CA SER A 32 791 797 780 8 -140 175 C ATOM 238 C SER A 32 -2.083 -5.163 10.142 1.00 7.01 C ANISOU 238 C SER A 32 847 982 836 -40 -149 333 C ATOM 239 O SER A 32 -3.243 -4.867 9.810 1.00 8.27 O ANISOU 239 O SER A 32 946 1160 1035 -194 -196 277 O ATOM 240 CB SER A 32 -1.360 -6.995 8.589 1.00 8.72 C ANISOU 240 CB SER A 32 1122 1115 1078 30 1 114 C ATOM 241 OG SER A 32 -0.604 -5.991 7.924 1.00 9.76 O ANISOU 241 OG SER A 32 1391 1161 1155 139 153 -49 O ATOM 242 H SER A 32 -3.343 -7.498 10.129 1.00 6.99 H ATOM 243 HA SER A 32 -0.769 -6.700 10.559 1.00 7.48 H ATOM 244 HB2 SER A 32 -0.870 -7.831 8.562 1.00 10.47 H ATOM 245 HB3 SER A 32 -2.215 -7.096 8.142 1.00 10.47 H ATOM 246 HG SER A 32 -0.478 -6.207 7.142 1.00 11.71 H ATOM 247 N LEU A 33 -1.214 -4.279 10.627 1.00 6.02 N ANISOU 247 N LEU A 33 813 717 759 186 -22 368 N ATOM 248 CA LEU A 33 -1.467 -2.840 10.605 1.00 6.33 C ANISOU 248 CA LEU A 33 889 709 806 23 -9 416 C ATOM 249 C LEU A 33 -0.768 -2.243 9.392 1.00 6.92 C ANISOU 249 C LEU A 33 929 844 858 6 15 353 C ATOM 250 O LEU A 33 0.448 -2.426 9.192 1.00 6.96 O ANISOU 250 O LEU A 33 1042 767 835 -97 -68 214 O ATOM 251 CB LEU A 33 -0.955 -2.160 11.887 1.00 7.25 C ANISOU 251 CB LEU A 33 955 870 930 137 114 391 C ATOM 252 CG LEU A 33 -1.503 -2.703 13.205 1.00 8.57 C ANISOU 252 CG LEU A 33 1083 1058 1114 108 148 267 C ATOM 253 CD1 LEU A 33 -1.086 -1.799 14.347 1.00 10.16 C ANISOU 253 CD1 LEU A 33 1225 1315 1320 71 221 148 C ATOM 254 CD2 LEU A 33 -3.021 -2.860 13.132 1.00 8.79 C ANISOU 254 CD2 LEU A 33 1088 1125 1129 187 19 346 C ATOM 255 H LEU A 33 -0.459 -4.491 10.980 1.00 7.23 H ATOM 256 HA LEU A 33 -2.430 -2.676 10.525 1.00 7.59 H ATOM 257 HB2 LEU A 33 0.010 -2.252 11.917 1.00 8.70 H ATOM 258 HB3 LEU A 33 -1.187 -1.219 11.845 1.00 8.70 H ATOM 259 HG LEU A 33 -1.121 -3.580 13.365 1.00 10.28 H ATOM 260 HD11 LEU A 33 -1.437 -2.152 15.168 1.00 12.19 H ATOM 261 HD12 LEU A 33 -0.127 -1.768 14.387 1.00 12.19 H ATOM 262 HD13 LEU A 33 -1.436 -0.918 14.192 1.00 12.19 H ATOM 263 HD21 LEU A 33 -3.339 -3.202 13.970 1.00 10.55 H ATOM 264 HD22 LEU A 33 -3.415 -2.002 12.956 1.00 10.55 H ATOM 265 HD23 LEU A 33 -3.237 -3.471 12.425 1.00 10.55 H ATOM 266 N ASN A 34 -1.538 -1.515 8.593 1.00 7.83 N ANISOU 266 N ASN A 34 1020 966 987 125 92 533 N ATOM 267 CA ASN A 34 -1.095 -1.084 7.273 1.00 9.57 C ANISOU 267 CA ASN A 34 1223 1208 1204 -83 32 480 C ATOM 268 C ASN A 34 -1.252 0.426 7.101 1.00 9.87 C ANISOU 268 C ASN A 34 1171 1358 1219 59 7 602 C ATOM 269 O ASN A 34 -2.311 0.989 7.363 1.00 10.66 O ANISOU 269 O ASN A 34 1196 1588 1265 -70 -14 689 O ATOM 270 CB ASN A 34 -1.862 -1.881 6.202 1.00 10.20 C ANISOU 270 CB ASN A 34 1342 1293 1241 -117 20 466 C ATOM 271 CG ASN A 34 -1.370 -1.601 4.794 1.00 12.72 C ANISOU 271 CG ASN A 34 1754 1607 1471 -136 124 319 C ATOM 272 OD1 ASN A 34 -1.506 -0.493 4.303 1.00 13.89 O ANISOU 272 OD1 ASN A 34 2151 1699 1428 37 214 303 O ATOM 273 ND2 ASN A 34 -0.821 -2.618 4.132 1.00 15.35 N ANISOU 273 ND2 ASN A 34 1957 1957 1920 -142 70 345 N ATOM 274 H ASN A 34 -2.332 -1.255 8.794 1.00 9.39 H ATOM 275 HA ASN A 34 -0.143 -1.296 7.176 1.00 11.48 H ATOM 276 HB2 ASN A 34 -1.752 -2.829 6.375 1.00 12.24 H ATOM 277 HB3 ASN A 34 -2.802 -1.644 6.245 1.00 12.24 H ATOM 278 HD21 ASN A 34 -0.489 -2.487 3.220 1.00 18.42 H ATOM 279 HD22 ASN A 34 -0.750 -3.499 4.557 1.00 18.42 H ATOM 280 N SER A 37 -0.165 1.086 6.708 1.00 9.21 N ANISOU 280 N SER A 37 1078 1154 1266 -14 -1 414 N ATOM 281 CA SER A 37 -0.184 2.503 6.338 1.00 10.66 C ANISOU 281 CA SER A 37 1336 1302 1413 125 185 495 C ATOM 282 C SER A 37 0.806 2.643 5.196 1.00 12.82 C ANISOU 282 C SER A 37 1787 1489 1593 174 256 519 C ATOM 283 O SER A 37 2.019 2.713 5.414 1.00 13.51 O ANISOU 283 O SER A 37 1918 1626 1591 286 233 471 O ATOM 284 CB SER A 37 0.225 3.379 7.515 1.00 13.89 C ANISOU 284 CB SER A 37 1845 1653 1780 189 204 426 C ATOM 285 OG SER A 37 0.254 4.759 7.150 1.00 15.39 O ANISOU 285 OG SER A 37 2129 1788 1931 205 267 312 O ATOM 286 H SER A 37 0.615 0.728 6.646 1.00 11.05 H ATOM 287 HA SER A 37 -1.077 2.764 6.030 1.00 12.80 H ATOM 288 HB2 SER A 37 -0.415 3.257 8.234 1.00 16.67 H ATOM 289 HB3 SER A 37 1.109 3.114 7.812 1.00 16.67 H ATOM 290 HG SER A 37 0.475 5.215 7.794 1.00 18.47 H ATOM 291 N GLY A 38 0.292 2.623 3.976 1.00 14.35 N ANISOU 291 N GLY A 38 2000 1652 1799 549 256 768 N ATOM 292 CA GLY A 38 1.162 2.433 2.814 1.00 17.94 C ANISOU 292 CA GLY A 38 2445 2165 2208 662 264 788 C ATOM 293 C GLY A 38 1.480 0.953 2.648 1.00 18.78 C ANISOU 293 C GLY A 38 2743 2365 2028 768 155 686 C ATOM 294 O GLY A 38 1.076 0.308 1.665 1.00 20.73 O ANISOU 294 O GLY A 38 3310 2633 1933 866 84 685 O ATOM 295 H GLY A 38 -0.542 2.716 3.789 1.00 17.22 H ATOM 296 HA2 GLY A 38 0.720 2.753 2.012 1.00 21.53 H ATOM 297 HA3 GLY A 38 1.991 2.922 2.935 1.00 21.53 H ATOM 298 N SER A 39 2.196 0.403 3.620 1.00 16.16 N ANISOU 298 N SER A 39 2199 2013 1926 569 86 762 N ATOM 299 CA SER A 39 2.471 -1.021 3.653 1.00 17.45 C ANISOU 299 CA SER A 39 2231 2184 2214 454 8 823 C ATOM 300 C SER A 39 2.355 -1.528 5.086 1.00 10.93 C ANISOU 300 C SER A 39 1454 1335 1364 269 -25 634 C ATOM 301 O SER A 39 2.115 -0.759 6.018 1.00 9.19 O ANISOU 301 O SER A 39 1157 1074 1259 -52 23 523 O ATOM 302 CB SER A 39 3.865 -1.312 3.104 1.00 30.71 C ANISOU 302 CB SER A 39 3885 3894 3890 355 -65 922 C ATOM 303 OG SER A 39 4.845 -0.623 3.849 1.00 34.32 O ANISOU 303 OG SER A 39 4310 4348 4381 211 -41 969 O ATOM 304 H SER A 39 2.537 0.839 4.278 1.00 19.39 H ATOM 305 HA SER A 39 1.814 -1.494 3.101 1.00 20.94 H ATOM 306 HB2 SER A 39 4.036 -2.266 3.161 1.00 36.86 H ATOM 307 HB3 SER A 39 3.909 -1.022 2.179 1.00 36.86 H ATOM 308 HG SER A 39 5.591 -0.784 3.549 1.00 41.18 H ATOM 309 N HIS A 40 2.505 -2.831 5.240 1.00 8.77 N ANISOU 309 N HIS A 40 1224 1125 982 371 -4 501 N ATOM 310 CA HIS A 40 2.534 -3.459 6.559 1.00 7.17 C ANISOU 310 CA HIS A 40 1007 864 853 301 125 571 C ATOM 311 C HIS A 40 3.672 -2.852 7.406 1.00 7.14 C ANISOU 311 C HIS A 40 1067 872 775 187 180 329 C ATOM 312 O HIS A 40 4.819 -2.776 6.947 1.00 8.27 O ANISOU 312 O HIS A 40 1291 1013 837 150 149 133 O ATOM 313 CB HIS A 40 2.726 -4.974 6.426 1.00 8.11 C ANISOU 313 CB HIS A 40 1101 976 1004 205 250 372 C ATOM 314 CG HIS A 40 3.051 -5.642 7.728 1.00 7.73 C ANISOU 314 CG HIS A 40 1101 876 959 162 458 424 C ATOM 315 ND1 HIS A 40 2.080 -6.043 8.620 1.00 7.30 N ANISOU 315 ND1 HIS A 40 1045 864 864 310 554 221 N ATOM 316 CD2 HIS A 40 4.241 -5.916 8.314 1.00 8.18 C ANISOU 316 CD2 HIS A 40 1169 889 1051 205 549 545 C ATOM 317 CE1 HIS A 40 2.656 -6.549 9.698 1.00 7.88 C ANISOU 317 CE1 HIS A 40 1179 779 1038 363 656 278 C ATOM 318 NE2 HIS A 40 3.964 -6.473 9.545 1.00 8.00 N ANISOU 318 NE2 HIS A 40 1195 824 1021 314 631 388 N ATOM 319 H HIS A 40 2.593 -3.387 4.589 1.00 10.52 H ATOM 320 HA HIS A 40 1.684 -3.293 7.018 1.00 8.60 H ATOM 321 HB2 HIS A 40 1.907 -5.367 6.085 1.00 9.73 H ATOM 322 HB3 HIS A 40 3.457 -5.146 5.812 1.00 9.73 H ATOM 323 HD2 HIS A 40 5.084 -5.742 7.962 1.00 9.82 H ATOM 324 HE1 HIS A 40 2.214 -6.903 10.436 1.00 9.46 H ATOM 325 N PHE A 41 3.368 -2.425 8.637 1.00 6.68 N ANISOU 325 N PHE A 41 981 821 735 143 172 272 N ATOM 326 CA PHE A 41 4.402 -1.832 9.513 1.00 6.70 C ANISOU 326 CA PHE A 41 947 851 747 45 161 391 C ATOM 327 C PHE A 41 4.424 -2.354 10.959 1.00 6.22 C ANISOU 327 C PHE A 41 804 904 656 -78 181 235 C ATOM 328 O PHE A 41 5.418 -2.145 11.650 1.00 5.35 O ANISOU 328 O PHE A 41 705 802 527 -40 189 194 O ATOM 329 CB PHE A 41 4.322 -0.284 9.513 1.00 6.54 C ANISOU 329 CB PHE A 41 913 814 759 277 83 444 C ATOM 330 CG PHE A 41 3.151 0.266 10.289 1.00 6.71 C ANISOU 330 CG PHE A 41 922 829 800 274 143 422 C ATOM 331 CD1 PHE A 41 3.289 0.599 11.633 1.00 7.58 C ANISOU 331 CD1 PHE A 41 1036 890 955 252 101 405 C ATOM 332 CD2 PHE A 41 1.903 0.429 9.685 1.00 7.29 C ANISOU 332 CD2 PHE A 41 984 947 838 130 97 272 C ATOM 333 CE1 PHE A 41 2.202 1.093 12.359 1.00 8.32 C ANISOU 333 CE1 PHE A 41 1138 968 1057 240 129 429 C ATOM 334 CE2 PHE A 41 0.810 0.922 10.395 1.00 7.61 C ANISOU 334 CE2 PHE A 41 1092 867 934 100 -53 350 C ATOM 335 CZ PHE A 41 0.951 1.241 11.742 1.00 7.08 C ANISOU 335 CZ PHE A 41 1028 768 894 155 -29 391 C ATOM 336 H PHE A 41 2.584 -2.464 8.989 1.00 8.01 H ATOM 337 HA PHE A 41 5.273 -2.062 9.127 1.00 8.04 H ATOM 338 HB2 PHE A 41 5.133 0.072 9.909 1.00 7.85 H ATOM 339 HB3 PHE A 41 4.241 0.025 8.597 1.00 7.85 H ATOM 340 HD1 PHE A 41 4.112 0.490 12.053 1.00 9.10 H ATOM 341 HD2 PHE A 41 1.799 0.204 8.789 1.00 8.75 H ATOM 342 HE1 PHE A 41 2.305 1.311 13.257 1.00 9.99 H ATOM 343 HE2 PHE A 41 -0.014 1.022 9.974 1.00 9.14 H ATOM 344 HZ PHE A 41 0.230 1.582 12.221 1.00 8.50 H ATOM 345 N CYS A 42 3.350 -3.022 11.402 1.00 6.11 N ANISOU 345 N CYS A 42 786 804 730 -37 108 251 N ATOM 346 CA CYS A 42 3.246 -3.569 12.757 1.00 5.20 C ANISOU 346 CA CYS A 42 655 657 663 36 154 90 C ATOM 347 C CYS A 42 2.173 -4.635 12.735 1.00 4.78 C ANISOU 347 C CYS A 42 550 670 597 101 65 216 C ATOM 348 O CYS A 42 1.386 -4.708 11.781 1.00 5.82 O ANISOU 348 O CYS A 42 742 869 602 104 84 336 O ATOM 349 CB CYS A 42 2.852 -2.496 13.804 1.00 5.47 C ANISOU 349 CB CYS A 42 767 643 669 -229 215 -5 C ATOM 350 SG CYS A 42 4.200 -1.485 14.503 1.00 7.16 S ANISOU 350 SG CYS A 42 1051 780 890 43 93 163 S ATOM 351 H CYS A 42 2.653 -3.173 10.921 1.00 7.33 H ATOM 352 HA CYS A 42 4.098 -3.977 13.021 1.00 6.24 H ATOM 353 HB2 CYS A 42 2.224 -1.885 13.387 1.00 6.57 H ATOM 354 HB3 CYS A 42 2.417 -2.944 14.546 1.00 6.57 H ATOM 355 N GLY A 43 2.142 -5.469 13.767 1.00 5.50 N ANISOU 355 N GLY A 43 612 817 661 68 19 51 N ATOM 356 CA GLY A 43 1.040 -6.389 13.971 1.00 4.50 C ANISOU 356 CA GLY A 43 498 672 541 -6 -1 132 C ATOM 357 C GLY A 43 0.090 -5.935 15.080 1.00 5.11 C ANISOU 357 C GLY A 43 651 763 528 72 83 77 C ATOM 358 O GLY A 43 0.249 -4.853 15.660 1.00 5.20 O ANISOU 358 O GLY A 43 649 762 564 -62 173 -13 O ATOM 359 H GLY A 43 2.755 -5.519 14.368 1.00 6.60 H ATOM 360 HA2 GLY A 43 0.533 -6.473 13.149 1.00 5.40 H ATOM 361 HA3 GLY A 43 1.389 -7.263 14.206 1.00 5.40 H ATOM 362 N GLY A 44 -0.907 -6.773 15.359 1.00 4.16 N ANISOU 362 N GLY A 44 447 598 534 6 167 80 N ATOM 363 CA GLY A 44 -1.876 -6.541 16.417 1.00 4.16 C ANISOU 363 CA GLY A 44 473 530 580 104 60 152 C ATOM 364 C GLY A 44 -2.629 -7.835 16.667 1.00 4.30 C ANISOU 364 C GLY A 44 564 420 650 80 -6 29 C ATOM 365 O GLY A 44 -2.435 -8.821 15.932 1.00 5.12 O ANISOU 365 O GLY A 44 736 491 719 -17 -47 74 O ATOM 366 H GLY A 44 -1.043 -7.507 14.931 1.00 4.99 H ATOM 367 HA2 GLY A 44 -1.426 -6.269 17.232 1.00 5.00 H ATOM 368 HA3 GLY A 44 -2.505 -5.851 16.152 1.00 5.00 H ATOM 369 N SER A 45 -3.473 -7.834 17.695 1.00 4.26 N ANISOU 369 N SER A 45 623 382 613 36 -15 47 N ATOM 370 CA SER A 45 -4.292 -8.990 18.063 1.00 4.85 C ANISOU 370 CA SER A 45 680 529 633 67 -38 -30 C ATOM 371 C SER A 45 -5.753 -8.583 18.223 1.00 4.98 C ANISOU 371 C SER A 45 742 571 578 118 9 -157 C ATOM 372 O SER A 45 -6.064 -7.624 18.935 1.00 5.52 O ANISOU 372 O SER A 45 891 615 590 33 231 -233 O ATOM 373 CB SER A 45 -3.794 -9.556 19.385 1.00 5.59 C ANISOU 373 CB SER A 45 703 680 740 167 -324 198 C ATOM 374 OG SER A 45 -2.444 -9.965 19.283 1.00 6.17 O ANISOU 374 OG SER A 45 783 785 775 185 -197 308 O ATOM 375 H SER A 45 -3.593 -7.156 18.210 1.00 5.11 H ATOM 376 HA SER A 45 -4.226 -9.683 17.373 1.00 5.82 H ATOM 377 HB2 SER A 45 -3.865 -8.871 20.068 1.00 6.70 H ATOM 378 HB3 SER A 45 -4.338 -10.322 19.625 1.00 6.70 H ATOM 379 HG SER A 45 -2.188 -10.267 20.001 1.00 7.40 H ATOM 380 N LEU A 46 -6.658 -9.323 17.596 1.00 5.27 N ANISOU 380 N LEU A 46 741 639 624 166 5 -161 N ATOM 381 CA LEU A 46 -8.080 -9.039 17.706 1.00 5.22 C ANISOU 381 CA LEU A 46 652 644 689 74 -117 19 C ATOM 382 C LEU A 46 -8.605 -9.597 19.035 1.00 5.94 C ANISOU 382 C LEU A 46 743 761 752 52 -69 58 C ATOM 383 O LEU A 46 -8.526 -10.793 19.282 1.00 6.52 O ANISOU 383 O LEU A 46 757 872 850 -42 9 44 O ATOM 384 CB LEU A 46 -8.836 -9.661 16.535 1.00 6.78 C ANISOU 384 CB LEU A 46 848 827 902 120 -259 38 C ATOM 385 CG LEU A 46 -10.320 -9.298 16.434 1.00 8.27 C ANISOU 385 CG LEU A 46 972 1073 1097 57 -258 -44 C ATOM 386 CD1 LEU A 46 -10.479 -7.840 16.045 1.00 8.57 C ANISOU 386 CD1 LEU A 46 1010 1101 1144 120 -391 18 C ATOM 387 CD2 LEU A 46 -11.030 -10.196 15.432 1.00 9.05 C ANISOU 387 CD2 LEU A 46 1112 1152 1175 39 -262 64 C ATOM 388 H LEU A 46 -6.473 -10.000 17.098 1.00 6.33 H ATOM 389 HA LEU A 46 -8.224 -8.070 17.694 1.00 6.27 H ATOM 390 HB2 LEU A 46 -8.411 -9.378 15.711 1.00 8.14 H ATOM 391 HB3 LEU A 46 -8.779 -10.627 16.612 1.00 8.14 H ATOM 392 HG LEU A 46 -10.738 -9.425 17.300 1.00 9.92 H ATOM 393 HD11 LEU A 46 -11.414 -7.632 15.987 1.00 10.28 H ATOM 394 HD12 LEU A 46 -10.062 -7.292 16.714 1.00 10.28 H ATOM 395 HD13 LEU A 46 -10.058 -7.697 15.194 1.00 10.28 H ATOM 396 HD21 LEU A 46 -11.955 -9.946 15.390 1.00 10.86 H ATOM 397 HD22 LEU A 46 -10.621 -10.086 14.571 1.00 10.86 H ATOM 398 HD23 LEU A 46 -10.949 -11.108 15.720 1.00 10.86 H ATOM 399 N ILE A 47 -9.143 -8.736 19.890 1.00 7.03 N ANISOU 399 N ILE A 47 905 852 914 187 209 61 N ATOM 400 CA ILE A 47 -9.640 -9.190 21.194 1.00 7.85 C ANISOU 400 CA ILE A 47 1016 934 1034 78 232 63 C ATOM 401 C ILE A 47 -11.149 -9.026 21.392 1.00 9.43 C ANISOU 401 C ILE A 47 1085 1318 1180 225 170 265 C ATOM 402 O ILE A 47 -11.711 -9.519 22.388 1.00 10.13 O ANISOU 402 O ILE A 47 1124 1547 1177 361 393 324 O ATOM 403 CB ILE A 47 -8.912 -8.495 22.356 1.00 9.35 C ANISOU 403 CB ILE A 47 1209 1157 1186 -108 271 -20 C ATOM 404 CG1 ILE A 47 -9.103 -6.981 22.246 1.00 10.84 C ANISOU 404 CG1 ILE A 47 1427 1274 1418 -334 352 -21 C ATOM 405 CG2 ILE A 47 -7.441 -8.903 22.389 1.00 8.72 C ANISOU 405 CG2 ILE A 47 1107 1068 1139 -186 240 -92 C ATOM 406 CD1 ILE A 47 -8.824 -6.234 23.555 1.00 16.38 C ANISOU 406 CD1 ILE A 47 2109 2036 2078 -373 285 75 C ATOM 407 H ILE A 47 -9.234 -7.893 19.746 1.00 8.43 H ATOM 408 HA ILE A 47 -9.447 -10.147 21.269 1.00 9.42 H ATOM 409 HB ILE A 47 -9.322 -8.789 23.184 1.00 11.22 H ATOM 410 HG12 ILE A 47 -8.496 -6.636 21.572 1.00 13.01 H ATOM 411 HG13 ILE A 47 -10.020 -6.798 21.989 1.00 13.01 H ATOM 412 HG21 ILE A 47 -7.010 -8.456 23.122 1.00 10.47 H ATOM 413 HG22 ILE A 47 -7.383 -9.854 22.506 1.00 10.47 H ATOM 414 HG23 ILE A 47 -7.027 -8.648 21.561 1.00 10.47 H ATOM 415 HD11 ILE A 47 -8.962 -5.295 23.414 1.00 19.65 H ATOM 416 HD12 ILE A 47 -9.424 -6.556 24.232 1.00 19.65 H ATOM 417 HD13 ILE A 47 -7.915 -6.396 23.819 1.00 19.65 H ATOM 418 N SER A 48 -11.794 -8.310 20.475 1.00 9.79 N ANISOU 418 N SER A 48 1114 1341 1264 359 38 345 N ATOM 419 CA ASER A 48 -13.254 -8.300 20.418 0.68 11.03 C ANISOU 419 CA ASER A 48 1329 1419 1443 374 -4 320 C ATOM 420 CA BSER A 48 -13.245 -8.158 20.454 0.32 9.82 C ANISOU 420 CA BSER A 48 1100 1352 1278 410 -41 256 C ATOM 421 C SER A 48 -13.643 -7.950 18.996 1.00 10.96 C ANISOU 421 C SER A 48 1202 1574 1387 425 -38 290 C ATOM 422 O SER A 48 -12.767 -7.724 18.142 1.00 11.55 O ANISOU 422 O SER A 48 1073 1848 1468 506 22 451 O ATOM 423 CB ASER A 48 -13.844 -7.292 21.396 0.68 18.08 C ANISOU 423 CB ASER A 48 2261 2302 2308 491 -67 317 C ATOM 424 CB BSER A 48 -13.656 -6.943 21.293 0.32 9.64 C ANISOU 424 CB BSER A 48 997 1316 1350 496 -57 142 C ATOM 425 OG ASER A 48 -13.785 -5.995 20.851 0.68 15.99 O ANISOU 425 OG ASER A 48 2041 1941 2094 484 -2 245 O ATOM 426 OG BSER A 48 -14.998 -7.043 21.738 0.32 9.42 O ANISOU 426 OG BSER A 48 983 1244 1352 478 -98 23 O ATOM 427 H ASER A 48 -11.413 -7.823 19.878 1.00 11.75 H ATOM 428 HA ASER A 48 -13.602 -9.190 20.632 0.69 13.24 H ATOM 429 HB2ASER A 48 -14.770 -7.522 21.570 0.69 21.70 H ATOM 430 HB3ASER A 48 -13.334 -7.313 22.221 0.69 21.70 H ATOM 431 HG ASER A 48 -14.103 -5.454 21.379 0.69 19.19 H ATOM 432 N GLU A 49 -14.944 -7.965 18.717 1.00 11.12 N ANISOU 432 N GLU A 49 1288 1465 1473 320 0 71 N ATOM 433 CA GLU A 49 -15.413 -7.712 17.363 1.00 12.23 C ANISOU 433 CA GLU A 49 1407 1610 1631 189 -99 -64 C ATOM 434 C GLU A 49 -14.894 -6.380 16.821 1.00 10.38 C ANISOU 434 C GLU A 49 1114 1432 1398 223 -48 -153 C ATOM 435 O GLU A 49 -14.653 -6.243 15.628 1.00 10.54 O ANISOU 435 O GLU A 49 1267 1426 1313 63 134 -173 O ATOM 436 CB GLU A 49 -16.951 -7.728 17.290 1.00 15.80 C ANISOU 436 CB GLU A 49 1893 2012 2100 -35 51 2 C ATOM 437 CG GLU A 49 -17.590 -9.083 17.570 1.00 20.24 C ANISOU 437 CG GLU A 49 2424 2655 2612 -261 59 27 C ATOM 438 CD GLU A 49 -17.769 -9.375 19.050 1.00 18.88 C ANISOU 438 CD GLU A 49 2009 2610 2555 -581 125 66 C ATOM 439 OE1 GLU A 49 -17.364 -8.541 19.898 1.00 17.15 O ANISOU 439 OE1 GLU A 49 1500 2553 2463 -775 226 1 O ATOM 440 OE2 GLU A 49 -18.342 -10.441 19.365 1.00 19.58 O ANISOU 440 OE2 GLU A 49 2210 2660 2570 -642 63 187 O ATOM 441 H GLU A 49 -15.568 -8.118 19.288 1.00 13.35 H ATOM 442 HA GLU A 49 -15.079 -8.423 16.777 1.00 14.68 H ATOM 443 HB2 GLU A 49 -17.298 -7.099 17.943 1.00 18.96 H ATOM 444 HB3 GLU A 49 -17.221 -7.454 16.400 1.00 18.96 H ATOM 445 HG2 GLU A 49 -18.466 -9.109 17.154 1.00 24.29 H ATOM 446 HG3 GLU A 49 -17.027 -9.779 17.196 1.00 24.29 H ATOM 447 N GLN A 50 -14.721 -5.387 17.687 1.00 10.13 N ANISOU 447 N GLN A 50 1095 1450 1303 306 -199 -145 N ATOM 448 CA GLN A 50 -14.376 -4.063 17.215 1.00 11.27 C ANISOU 448 CA GLN A 50 1306 1526 1450 506 -330 -107 C ATOM 449 C GLN A 50 -13.064 -3.523 17.791 1.00 8.22 C ANISOU 449 C GLN A 50 834 1252 1038 384 -35 -141 C ATOM 450 O GLN A 50 -12.769 -2.356 17.606 1.00 7.24 O ANISOU 450 O GLN A 50 737 1247 765 185 15 -100 O ATOM 451 CB GLN A 50 -15.543 -3.093 17.501 1.00 19.49 C ANISOU 451 CB GLN A 50 2382 2503 2522 624 -433 120 C ATOM 452 CG GLN A 50 -15.565 -1.860 16.589 1.00 28.60 C ANISOU 452 CG GLN A 50 3520 3697 3650 706 -366 402 C ATOM 453 CD GLN A 50 -16.969 -1.288 16.318 1.00 24.62 C ANISOU 453 CD GLN A 50 2898 3281 3176 719 -375 707 C ATOM 454 OE1 GLN A 50 -17.137 -0.454 15.412 1.00 24.38 O ANISOU 454 OE1 GLN A 50 2685 3323 3257 694 -202 822 O ATOM 455 NE2 GLN A 50 -17.979 -1.727 17.102 1.00 20.50 N ANISOU 455 NE2 GLN A 50 2425 2654 2709 554 -435 773 N ATOM 456 H GLN A 50 -14.798 -5.457 18.540 1.00 12.15 H ATOM 457 HA GLN A 50 -14.267 -4.106 16.242 1.00 13.52 H ATOM 458 HB2 GLN A 50 -16.381 -3.568 17.378 1.00 23.39 H ATOM 459 HB3 GLN A 50 -15.474 -2.783 18.417 1.00 23.39 H ATOM 460 HG2 GLN A 50 -15.037 -1.159 17.003 1.00 34.32 H ATOM 461 HG3 GLN A 50 -15.176 -2.100 15.734 1.00 34.32 H ATOM 462 HE21 GLN A 50 -18.777 -1.430 16.980 1.00 24.60 H ATOM 463 HE22 GLN A 50 -17.824 -2.302 17.721 1.00 24.60 H ATOM 464 N TRP A 51 -12.294 -4.357 18.493 1.00 7.51 N ANISOU 464 N TRP A 51 834 1012 1008 412 -42 -216 N ATOM 465 CA TRP A 51 -11.066 -3.887 19.158 1.00 6.31 C ANISOU 465 CA TRP A 51 742 787 869 343 61 -83 C ATOM 466 C TRP A 51 -9.827 -4.761 18.969 1.00 6.00 C ANISOU 466 C TRP A 51 723 763 796 372 42 -67 C ATOM 467 O TRP A 51 -9.902 -5.988 19.051 1.00 6.03 O ANISOU 467 O TRP A 51 640 846 804 379 37 -95 O ATOM 468 CB TRP A 51 -11.322 -3.714 20.669 1.00 5.99 C ANISOU 468 CB TRP A 51 796 710 770 200 75 -2 C ATOM 469 CG TRP A 51 -12.275 -2.596 20.997 1.00 5.78 C ANISOU 469 CG TRP A 51 704 700 792 185 -36 -73 C ATOM 470 CD1 TRP A 51 -13.648 -2.657 21.050 1.00 6.55 C ANISOU 470 CD1 TRP A 51 847 769 871 342 8 -157 C ATOM 471 CD2 TRP A 51 -11.927 -1.239 21.287 1.00 7.03 C ANISOU 471 CD2 TRP A 51 908 827 938 342 -54 -46 C ATOM 472 NE1 TRP A 51 -14.165 -1.416 21.371 1.00 8.68 N ANISOU 472 NE1 TRP A 51 1107 1063 1127 226 -17 -57 N ATOM 473 CE2 TRP A 51 -13.127 -0.533 21.522 1.00 8.03 C ANISOU 473 CE2 TRP A 51 984 979 1088 229 -44 -10 C ATOM 474 CE3 TRP A 51 -10.715 -0.551 21.377 1.00 8.34 C ANISOU 474 CE3 TRP A 51 1073 1007 1089 286 6 9 C ATOM 475 CZ2 TRP A 51 -13.142 0.828 21.856 1.00 9.31 C ANISOU 475 CZ2 TRP A 51 1132 1158 1248 352 -18 176 C ATOM 476 CZ3 TRP A 51 -10.737 0.797 21.702 1.00 9.38 C ANISOU 476 CZ3 TRP A 51 1211 1110 1245 300 -41 163 C ATOM 477 CH2 TRP A 51 -11.937 1.471 21.938 1.00 9.27 C ANISOU 477 CH2 TRP A 51 1158 1111 1255 249 5 116 C ATOM 478 H TRP A 51 -12.455 -5.195 18.601 1.00 9.02 H ATOM 479 HA TRP A 51 -10.849 -3.001 18.799 1.00 7.57 H ATOM 480 HB2 TRP A 51 -11.697 -4.537 21.019 1.00 7.19 H ATOM 481 HB3 TRP A 51 -10.478 -3.524 21.109 1.00 7.19 H ATOM 482 HD1 TRP A 51 -14.154 -3.422 20.899 1.00 7.85 H ATOM 483 HE1 TRP A 51 -14.999 -1.231 21.468 1.00 10.41 H ATOM 484 HE3 TRP A 51 -9.909 -0.991 21.232 1.00 10.01 H ATOM 485 HZ2 TRP A 51 -13.939 1.272 22.036 1.00 11.17 H ATOM 486 HZ3 TRP A 51 -9.934 1.261 21.768 1.00 11.26 H ATOM 487 HH2 TRP A 51 -11.918 2.377 22.147 1.00 11.13 H ATOM 488 N VAL A 52 -8.699 -4.084 18.742 1.00 5.37 N ANISOU 488 N VAL A 52 570 760 711 320 -123 -118 N ATOM 489 CA VAL A 52 -7.392 -4.691 18.520 1.00 5.86 C ANISOU 489 CA VAL A 52 690 785 750 229 -140 22 C ATOM 490 C VAL A 52 -6.388 -4.146 19.526 1.00 5.12 C ANISOU 490 C VAL A 52 621 671 652 115 -15 -51 C ATOM 491 O VAL A 52 -6.400 -2.947 19.822 1.00 4.87 O ANISOU 491 O VAL A 52 553 633 667 18 2 97 O ATOM 492 CB VAL A 52 -6.904 -4.341 17.083 1.00 5.89 C ANISOU 492 CB VAL A 52 665 750 821 284 -211 205 C ATOM 493 CG1 VAL A 52 -5.405 -4.660 16.881 1.00 7.49 C ANISOU 493 CG1 VAL A 52 944 921 983 289 -218 229 C ATOM 494 CG2 VAL A 52 -7.776 -5.051 16.045 1.00 7.84 C ANISOU 494 CG2 VAL A 52 1002 946 1032 150 -196 264 C ATOM 495 H VAL A 52 -8.670 -3.225 18.713 1.00 6.45 H ATOM 496 HA VAL A 52 -7.449 -5.664 18.614 1.00 7.03 H ATOM 497 HB VAL A 52 -7.016 -3.377 16.947 1.00 7.06 H ATOM 498 HG11 VAL A 52 -5.154 -4.428 15.984 1.00 8.99 H ATOM 499 HG12 VAL A 52 -4.889 -4.149 17.509 1.00 8.99 H ATOM 500 HG13 VAL A 52 -5.263 -5.598 17.029 1.00 8.99 H ATOM 501 HG21 VAL A 52 -7.462 -4.825 15.166 1.00 9.41 H ATOM 502 HG22 VAL A 52 -7.714 -5.999 16.181 1.00 9.41 H ATOM 503 HG23 VAL A 52 -8.686 -4.764 16.152 1.00 9.41 H ATOM 504 N VAL A 53 -5.542 -5.031 20.062 1.00 4.36 N ANISOU 504 N VAL A 53 468 626 564 -26 -92 -52 N ATOM 505 CA VAL A 53 -4.428 -4.663 20.935 1.00 5.08 C ANISOU 505 CA VAL A 53 639 565 728 -37 -7 -60 C ATOM 506 C VAL A 53 -3.140 -4.595 20.109 1.00 5.47 C ANISOU 506 C VAL A 53 797 626 655 8 15 -119 C ATOM 507 O VAL A 53 -2.875 -5.478 19.291 1.00 5.77 O ANISOU 507 O VAL A 53 841 752 598 72 -29 -144 O ATOM 508 CB VAL A 53 -4.229 -5.703 22.095 1.00 8.01 C ANISOU 508 CB VAL A 53 876 1151 1016 -292 -153 -18 C ATOM 509 CG1 VAL A 53 -2.913 -5.420 22.850 1.00 9.64 C ANISOU 509 CG1 VAL A 53 1170 1284 1209 -524 -129 -24 C ATOM 510 CG2 VAL A 53 -5.428 -5.717 23.046 1.00 10.69 C ANISOU 510 CG2 VAL A 53 1295 1399 1366 -24 -258 -44 C ATOM 511 H VAL A 53 -5.598 -5.878 19.927 1.00 5.24 H ATOM 512 HA VAL A 53 -4.594 -3.782 21.330 1.00 6.10 H ATOM 513 HB VAL A 53 -4.156 -6.597 21.701 1.00 9.61 H ATOM 514 HG11 VAL A 53 -2.812 -6.066 23.553 1.00 11.57 H ATOM 515 HG12 VAL A 53 -2.179 -5.488 22.235 1.00 11.57 H ATOM 516 HG13 VAL A 53 -2.950 -4.535 23.221 1.00 11.57 H ATOM 517 HG21 VAL A 53 -5.269 -6.363 23.739 1.00 12.82 H ATOM 518 HG22 VAL A 53 -5.532 -4.844 23.430 1.00 12.82 H ATOM 519 HG23 VAL A 53 -6.216 -5.954 22.552 1.00 12.82 H ATOM 520 N SER A 54 -2.340 -3.548 20.323 1.00 4.90 N ANISOU 520 N SER A 54 648 543 672 -104 7 -122 N ATOM 521 CA SER A 54 -1.032 -3.430 19.674 1.00 5.28 C ANISOU 521 CA SER A 54 731 572 704 -98 61 -50 C ATOM 522 C SER A 54 -0.045 -2.725 20.618 1.00 4.75 C ANISOU 522 C SER A 54 611 613 581 184 -1 -4 C ATOM 523 O SER A 54 -0.324 -2.608 21.820 1.00 3.62 O ANISOU 523 O SER A 54 487 466 425 238 47 -177 O ATOM 524 CB SER A 54 -1.198 -2.717 18.317 1.00 5.44 C ANISOU 524 CB SER A 54 674 695 697 -59 44 -39 C ATOM 525 OG SER A 54 0.003 -2.696 17.550 1.00 5.97 O ANISOU 525 OG SER A 54 793 779 694 150 225 -3 O ATOM 526 H SER A 54 -2.533 -2.890 20.842 1.00 5.88 H ATOM 527 HA SER A 54 -0.686 -4.330 19.498 1.00 6.34 H ATOM 528 HB2 SER A 54 -1.882 -3.179 17.807 1.00 6.52 H ATOM 529 HB3 SER A 54 -1.476 -1.803 18.480 1.00 6.52 H ATOM 530 HG SER A 54 -0.126 -2.310 16.838 1.00 7.16 H ATOM 531 N ALA A 55 1.090 -2.261 20.089 1.00 4.41 N ANISOU 531 N ALA A 55 536 469 670 0 -27 29 N ATOM 532 CA ALA A 55 2.090 -1.537 20.881 1.00 5.35 C ANISOU 532 CA ALA A 55 713 570 750 111 -29 78 C ATOM 533 C ALA A 55 1.933 -0.018 20.696 1.00 5.32 C ANISOU 533 C ALA A 55 789 526 707 121 71 110 C ATOM 534 O ALA A 55 1.626 0.452 19.599 1.00 5.58 O ANISOU 534 O ALA A 55 756 640 724 237 121 52 O ATOM 535 CB ALA A 55 3.499 -1.977 20.488 1.00 5.20 C ANISOU 535 CB ALA A 55 695 591 692 47 -140 54 C ATOM 536 H ALA A 55 1.307 -2.353 19.262 1.00 5.29 H ATOM 537 HA ALA A 55 1.959 -1.744 21.830 1.00 6.42 H ATOM 538 HB1 ALA A 55 4.137 -1.493 21.017 1.00 6.25 H ATOM 539 HB2 ALA A 55 3.588 -2.919 20.649 1.00 6.25 H ATOM 540 HB3 ALA A 55 3.636 -1.790 19.556 1.00 6.25 H ATOM 541 N ALA A 56 2.133 0.741 21.775 1.00 5.09 N ANISOU 541 N ALA A 56 815 481 638 29 198 159 N ATOM 542 CA ALA A 56 2.084 2.199 21.704 1.00 5.72 C ANISOU 542 CA ALA A 56 868 581 726 174 138 73 C ATOM 543 C ALA A 56 3.081 2.796 20.702 1.00 6.00 C ANISOU 543 C ALA A 56 1000 551 728 80 183 76 C ATOM 544 O ALA A 56 2.796 3.837 20.101 1.00 7.01 O ANISOU 544 O ALA A 56 1180 684 801 216 247 63 O ATOM 545 CB ALA A 56 2.293 2.822 23.089 1.00 6.99 C ANISOU 545 CB ALA A 56 1013 739 903 7 91 -113 C ATOM 546 H ALA A 56 2.300 0.433 22.561 1.00 6.11 H ATOM 547 HA ALA A 56 1.187 2.458 21.405 1.00 6.87 H ATOM 548 HB1 ALA A 56 2.255 3.778 23.010 1.00 8.39 H ATOM 549 HB2 ALA A 56 1.599 2.514 23.677 1.00 8.39 H ATOM 550 HB3 ALA A 56 3.151 2.554 23.425 1.00 8.39 H ATOM 551 N HIS A 57 4.235 2.165 20.497 1.00 5.45 N ANISOU 551 N HIS A 57 809 563 698 -7 200 176 N ATOM 552 CA HIS A 57 5.203 2.743 19.560 1.00 6.21 C ANISOU 552 CA HIS A 57 830 697 833 -6 102 173 C ATOM 553 C HIS A 57 4.810 2.503 18.104 1.00 6.87 C ANISOU 553 C HIS A 57 943 843 825 130 211 223 C ATOM 554 O HIS A 57 5.435 3.059 17.206 1.00 8.52 O ANISOU 554 O HIS A 57 1143 1191 902 -36 297 134 O ATOM 555 CB HIS A 57 6.656 2.301 19.841 1.00 7.28 C ANISOU 555 CB HIS A 57 922 856 988 -55 134 116 C ATOM 556 CG HIS A 57 6.983 0.909 19.397 1.00 6.33 C ANISOU 556 CG HIS A 57 714 750 943 159 97 118 C ATOM 557 ND1 HIS A 57 6.916 -0.173 20.244 1.00 6.17 N ANISOU 557 ND1 HIS A 57 696 723 923 122 191 -111 N ATOM 558 CD2 HIS A 57 7.401 0.431 18.195 1.00 6.57 C ANISOU 558 CD2 HIS A 57 854 723 920 256 109 134 C ATOM 559 CE1 HIS A 57 7.282 -1.264 19.579 1.00 6.80 C ANISOU 559 CE1 HIS A 57 894 765 926 200 312 -117 C ATOM 560 NE2 HIS A 57 7.582 -0.923 18.336 1.00 7.05 N ANISOU 560 NE2 HIS A 57 857 885 938 227 225 -91 N ATOM 561 H HIS A 57 4.477 1.429 20.870 1.00 6.54 H ATOM 562 HA HIS A 57 5.184 3.714 19.691 1.00 7.45 H ATOM 563 HB2 HIS A 57 7.258 2.905 19.379 1.00 8.73 H ATOM 564 HB3 HIS A 57 6.815 2.349 20.796 1.00 8.73 H ATOM 565 HD2 HIS A 57 7.546 0.929 17.424 1.00 7.89 H ATOM 566 HE1 HIS A 57 7.314 -2.125 19.928 1.00 8.16 H ATOM 567 N CYS A 58 3.742 1.734 17.884 1.00 7.59 N ANISOU 567 N CYS A 58 1069 906 909 274 122 256 N ATOM 568 CA CYS A 58 3.145 1.560 16.551 1.00 8.08 C ANISOU 568 CA CYS A 58 1143 936 990 318 154 222 C ATOM 569 C CYS A 58 2.119 2.648 16.220 1.00 8.19 C ANISOU 569 C CYS A 58 1319 837 955 227 42 168 C ATOM 570 O CYS A 58 1.486 2.602 15.159 1.00 9.20 O ANISOU 570 O CYS A 58 1526 942 1029 257 -51 -71 O ATOM 571 CB CYS A 58 2.469 0.180 16.414 1.00 8.35 C ANISOU 571 CB CYS A 58 1199 960 1014 211 207 297 C ATOM 572 SG CYS A 58 3.612 -1.242 16.466 1.00 8.02 S ANISOU 572 SG CYS A 58 1138 861 1047 74 143 226 S ATOM 573 H CYS A 58 3.337 1.292 18.500 1.00 9.11 H ATOM 574 HA CYS A 58 3.858 1.610 15.880 1.00 9.69 H ATOM 575 HB2 CYS A 58 1.834 0.073 17.140 1.00 10.02 H ATOM 576 HB3 CYS A 58 2.001 0.148 15.565 1.00 10.02 H ATOM 577 N TYR A 59 1.960 3.625 17.112 1.00 6.48 N ANISOU 577 N TYR A 59 1020 601 839 93 57 201 N ATOM 578 CA TYR A 59 0.979 4.694 16.893 1.00 7.97 C ANISOU 578 CA TYR A 59 1209 761 1058 0 -30 202 C ATOM 579 C TYR A 59 1.232 5.447 15.585 1.00 9.10 C ANISOU 579 C TYR A 59 1447 809 1203 -38 -116 315 C ATOM 580 O TYR A 59 2.365 5.852 15.323 1.00 9.33 O ANISOU 580 O TYR A 59 1544 860 1141 -8 -183 510 O ATOM 581 CB TYR A 59 0.985 5.710 18.047 1.00 9.12 C ANISOU 581 CB TYR A 59 1226 990 1249 246 -43 65 C ATOM 582 CG TYR A 59 -0.041 6.812 17.861 1.00 12.15 C ANISOU 582 CG TYR A 59 1602 1350 1665 472 -100 34 C ATOM 583 CD1 TYR A 59 -1.348 6.654 18.310 1.00 13.40 C ANISOU 583 CD1 TYR A 59 1741 1532 1821 656 -196 -65 C ATOM 584 CD2 TYR A 59 0.290 7.999 17.213 1.00 15.21 C ANISOU 584 CD2 TYR A 59 1905 1824 2050 577 -73 9 C ATOM 585 CE1 TYR A 59 -2.290 7.651 18.138 1.00 17.39 C ANISOU 585 CE1 TYR A 59 2208 2116 2283 815 -170 26 C ATOM 586 CE2 TYR A 59 -0.645 8.999 17.034 1.00 17.61 C ANISOU 586 CE2 TYR A 59 2259 2093 2338 651 -93 78 C ATOM 587 CZ TYR A 59 -1.936 8.822 17.498 1.00 18.36 C ANISOU 587 CZ TYR A 59 2327 2161 2488 876 -102 63 C ATOM 588 OH TYR A 59 -2.883 9.818 17.315 1.00 20.70 O ANISOU 588 OH TYR A 59 2652 2421 2792 951 -69 37 O ATOM 589 H TYR A 59 2.402 3.693 17.847 1.00 7.77 H ATOM 590 HA TYR A 59 0.084 4.297 16.844 1.00 9.56 H ATOM 591 HB2 TYR A 59 0.783 5.249 18.876 1.00 10.94 H ATOM 592 HB3 TYR A 59 1.861 6.122 18.101 1.00 10.94 H ATOM 593 HD1 TYR A 59 -1.589 5.867 18.743 1.00 16.08 H ATOM 594 HD2 TYR A 59 1.157 8.122 16.900 1.00 18.25 H ATOM 595 HE1 TYR A 59 -3.159 7.531 18.447 1.00 20.87 H ATOM 596 HE2 TYR A 59 -0.409 9.788 16.602 1.00 21.13 H ATOM 597 HH TYR A 59 -2.981 9.969 16.515 1.00 24.84 H ATOM 598 N LYS A 60 0.164 5.593 14.791 1.00 10.83 N ANISOU 598 N LYS A 60 1541 1071 1503 17 -320 322 N ATOM 599 CA LYS A 60 0.034 6.591 13.724 1.00 16.35 C ANISOU 599 CA LYS A 60 2178 1873 2162 -105 -274 374 C ATOM 600 C LYS A 60 -1.384 7.169 13.817 1.00 16.26 C ANISOU 600 C LYS A 60 2240 1686 2252 220 -155 583 C ATOM 601 O LYS A 60 -2.263 6.567 14.430 1.00 15.96 O ANISOU 601 O LYS A 60 2389 1396 2277 166 -50 407 O ATOM 602 CB LYS A 60 0.200 5.978 12.335 1.00 19.62 C ANISOU 602 CB LYS A 60 2534 2426 2497 -287 -423 434 C ATOM 603 CG LYS A 60 1.565 5.369 12.045 1.00 18.10 C ANISOU 603 CG LYS A 60 2308 2252 2319 -377 -556 546 C ATOM 604 CD LYS A 60 1.632 4.894 10.600 1.00 20.09 C ANISOU 604 CD LYS A 60 2566 2513 2554 -585 -637 681 C ATOM 605 CE LYS A 60 2.906 4.130 10.296 1.00 22.78 C ANISOU 605 CE LYS A 60 2896 2860 2901 -677 -647 751 C ATOM 606 NZ LYS A 60 4.041 5.023 9.946 1.00 27.35 N ANISOU 606 NZ LYS A 60 3441 3426 3523 -797 -665 707 N ATOM 607 H LYS A 60 -0.535 5.095 14.859 1.00 12.99 H ATOM 608 HA LYS A 60 0.689 7.310 13.845 1.00 19.62 H ATOM 609 HB2 LYS A 60 -0.460 5.275 12.228 1.00 23.55 H ATOM 610 HB3 LYS A 60 0.045 6.670 11.673 1.00 23.55 H ATOM 611 HG2 LYS A 60 2.254 6.037 12.183 1.00 21.72 H ATOM 612 HG3 LYS A 60 1.709 4.606 12.627 1.00 21.72 H ATOM 613 HD2 LYS A 60 0.880 4.307 10.425 1.00 24.11 H ATOM 614 HD3 LYS A 60 1.596 5.665 10.012 1.00 24.11 H ATOM 615 HE2 LYS A 60 3.160 3.614 11.077 1.00 27.34 H ATOM 616 HE3 LYS A 60 2.747 3.538 9.544 1.00 27.34 H ATOM 617 HZ1 LYS A 60 4.824 4.501 9.761 1.00 32.82 H ATOM 618 HZ2 LYS A 60 3.822 5.543 9.169 1.00 32.82 H ATOM 619 HZ3 LYS A 60 4.227 5.618 10.676 1.00 32.82 H ATOM 620 N THR A 61 -1.628 8.324 13.202 1.00 17.44 N ANISOU 620 N THR A 61 2293 1988 2345 293 -212 657 N ATOM 621 CA THR A 61 -2.935 8.962 13.315 1.00 20.02 C ANISOU 621 CA THR A 61 2623 2368 2617 595 -95 744 C ATOM 622 C THR A 61 -4.012 8.260 12.484 1.00 18.20 C ANISOU 622 C THR A 61 2363 2168 2386 795 -38 586 C ATOM 623 O THR A 61 -5.211 8.352 12.800 1.00 17.98 O ANISOU 623 O THR A 61 2368 2113 2349 1030 73 406 O ATOM 624 CB THR A 61 -2.861 10.430 12.897 1.00 24.74 C ANISOU 624 CB THR A 61 3209 2966 3224 914 -131 1049 C ATOM 625 OG1 THR A 61 -2.328 10.516 11.572 1.00 25.91 O ANISOU 625 OG1 THR A 61 3425 3049 3372 883 -45 1238 O ATOM 626 CG2 THR A 61 -1.964 11.204 13.849 1.00 31.61 C ANISOU 626 CG2 THR A 61 4012 3933 4067 1051 -155 1046 C ATOM 627 H THR A 61 -1.060 8.754 12.719 1.00 20.93 H ATOM 628 HA THR A 61 -3.217 8.933 14.253 1.00 24.03 H ATOM 629 HB THR A 61 -3.748 10.821 12.918 1.00 29.68 H ATOM 630 HG1 THR A 61 -1.576 10.190 11.550 1.00 31.10 H ATOM 631 HG21 THR A 61 -1.920 12.125 13.582 1.00 37.93 H ATOM 632 HG22 THR A 61 -2.313 11.154 14.742 1.00 37.93 H ATOM 633 HG23 THR A 61 -1.078 10.834 13.838 1.00 37.93 H ATOM 634 N ARG A 62 -3.583 7.583 11.416 1.00 17.40 N ANISOU 634 N ARG A 62 2293 2023 2294 741 -5 583 N ATOM 635 CA ARG A 62 -4.464 6.754 10.591 1.00 19.74 C ANISOU 635 CA ARG A 62 2573 2346 2581 655 -41 564 C ATOM 636 C ARG A 62 -3.832 5.375 10.344 1.00 17.27 C ANISOU 636 C ARG A 62 2365 1876 2322 563 -51 445 C ATOM 637 O ARG A 62 -2.662 5.259 9.993 1.00 17.45 O ANISOU 637 O ARG A 62 2586 1717 2329 395 131 351 O ATOM 638 CB ARG A 62 -4.780 7.433 9.257 1.00 26.89 C ANISOU 638 CB ARG A 62 3444 3340 3431 537 -132 573 C ATOM 639 CG ARG A 62 -5.646 8.693 9.384 1.00 29.41 C ANISOU 639 CG ARG A 62 3719 3688 3767 511 -184 542 C ATOM 640 CD ARG A 62 -4.881 9.877 9.966 0.00 33.15 C ANISOU 640 CD ARG A 62 4194 4164 4237 402 -186 467 C ATOM 641 NE ARG A 62 -4.007 10.521 8.988 0.00 34.48 N ANISOU 641 NE ARG A 62 4359 4330 4412 315 -162 402 N ATOM 642 CZ ARG A 62 -4.304 11.642 8.335 0.00 35.75 C ANISOU 642 CZ ARG A 62 4520 4496 4566 260 -132 350 C ATOM 643 NH1 ARG A 62 -5.459 12.261 8.544 0.00 37.09 N ANISOU 643 NH1 ARG A 62 4679 4659 4753 245 -145 333 N ATOM 644 NH2 ARG A 62 -3.439 12.147 7.467 0.00 37.00 N ANISOU 644 NH2 ARG A 62 4669 4648 4742 243 -145 333 N ATOM 645 H ARG A 62 -2.767 7.590 11.144 1.00 20.88 H ATOM 646 HA ARG A 62 -5.309 6.617 11.068 1.00 23.69 H ATOM 647 HB2 ARG A 62 -3.947 7.688 8.832 1.00 32.26 H ATOM 648 HB3 ARG A 62 -5.256 6.803 8.693 1.00 32.26 H ATOM 649 HG2 ARG A 62 -5.967 8.946 8.505 1.00 35.29 H ATOM 650 HG3 ARG A 62 -6.396 8.504 9.970 1.00 35.29 H ATOM 651 HD2 ARG A 62 -5.516 10.538 10.283 0.00 39.77 H ATOM 652 HD3 ARG A 62 -4.330 9.566 10.701 0.00 39.77 H ATOM 653 HE ARG A 62 -3.152 10.103 8.802 0.00 41.38 H ATOM 654 HH11 ARG A 62 -6.024 11.939 9.106 0.00 44.50 H ATOM 655 HH12 ARG A 62 -5.642 12.985 8.117 0.00 44.50 H ATOM 656 HH21 ARG A 62 -2.689 11.750 7.327 0.00 44.40 H ATOM 657 HH22 ARG A 62 -3.628 12.871 7.043 0.00 44.40 H ATOM 658 N ILE A 63 -4.626 4.333 10.536 1.00 15.96 N ANISOU 658 N ILE A 63 2061 1885 2118 534 -216 362 N ATOM 659 CA ILE A 63 -4.157 2.960 10.377 1.00 12.96 C ANISOU 659 CA ILE A 63 1620 1565 1741 329 -242 235 C ATOM 660 C ILE A 63 -5.281 2.164 9.743 1.00 11.46 C ANISOU 660 C ILE A 63 1347 1449 1560 239 -81 229 C ATOM 661 O ILE A 63 -6.429 2.321 10.139 1.00 11.58 O ANISOU 661 O ILE A 63 1243 1591 1567 180 -144 101 O ATOM 662 CB ILE A 63 -3.819 2.347 11.742 1.00 10.98 C ANISOU 662 CB ILE A 63 1385 1306 1480 260 -405 212 C ATOM 663 CG1 ILE A 63 -2.636 3.093 12.388 1.00 13.07 C ANISOU 663 CG1 ILE A 63 1683 1599 1683 208 -567 173 C ATOM 664 CG2 ILE A 63 -3.521 0.851 11.610 1.00 10.18 C ANISOU 664 CG2 ILE A 63 1294 1238 1335 162 -310 127 C ATOM 665 CD1 ILE A 63 -2.214 2.560 13.760 1.00 13.36 C ANISOU 665 CD1 ILE A 63 1673 1651 1752 247 -773 79 C ATOM 666 H ILE A 63 -5.454 4.392 10.762 1.00 19.15 H ATOM 667 HA ILE A 63 -3.366 2.930 9.799 1.00 15.56 H ATOM 668 HB ILE A 63 -4.592 2.451 12.318 1.00 13.17 H ATOM 669 HG12 ILE A 63 -1.868 3.026 11.799 1.00 15.68 H ATOM 670 HG13 ILE A 63 -2.881 4.025 12.498 1.00 15.68 H ATOM 671 HG21 ILE A 63 -3.314 0.497 12.478 1.00 12.21 H ATOM 672 HG22 ILE A 63 -4.295 0.410 11.252 1.00 12.21 H ATOM 673 HG23 ILE A 63 -2.773 0.732 11.020 1.00 12.21 H ATOM 674 HD11 ILE A 63 -1.476 3.081 14.084 1.00 16.03 H ATOM 675 HD12 ILE A 63 -2.956 2.631 14.365 1.00 16.03 H ATOM 676 HD13 ILE A 63 -1.952 1.640 13.670 1.00 16.03 H ATOM 677 N GLN A 64 -4.964 1.343 8.747 1.00 11.04 N ANISOU 677 N GLN A 64 1305 1434 1457 250 35 324 N ATOM 678 CA GLN A 64 -5.900 0.340 8.261 1.00 9.73 C ANISOU 678 CA GLN A 64 1209 1258 1231 181 182 258 C ATOM 679 C GLN A 64 -5.543 -1.019 8.837 1.00 8.97 C ANISOU 679 C GLN A 64 1090 1236 1081 100 149 128 C ATOM 680 O GLN A 64 -4.402 -1.472 8.745 1.00 8.55 O ANISOU 680 O GLN A 64 907 1242 1102 188 167 276 O ATOM 681 CB GLN A 64 -5.894 0.264 6.733 1.00 10.82 C ANISOU 681 CB GLN A 64 1377 1397 1337 179 394 466 C ATOM 682 CG GLN A 64 -6.944 -0.695 6.169 1.00 11.63 C ANISOU 682 CG GLN A 64 1542 1432 1446 287 566 569 C ATOM 683 CD GLN A 64 -6.946 -0.726 4.656 1.00 16.75 C ANISOU 683 CD GLN A 64 2332 2077 1954 539 563 699 C ATOM 684 OE1 GLN A 64 -6.122 -1.382 4.042 1.00 17.17 O ANISOU 684 OE1 GLN A 64 2673 2088 1764 744 678 819 O ATOM 685 NE2 GLN A 64 -7.867 0.003 4.057 1.00 21.72 N ANISOU 685 NE2 GLN A 64 2850 2750 2653 608 454 734 N ATOM 686 H GLN A 64 -4.209 1.348 8.335 1.00 13.25 H ATOM 687 HA GLN A 64 -6.806 0.572 8.554 1.00 11.68 H ATOM 688 HB2 GLN A 64 -6.074 1.147 6.374 1.00 12.98 H ATOM 689 HB3 GLN A 64 -5.022 -0.042 6.437 1.00 12.98 H ATOM 690 HG2 GLN A 64 -6.758 -1.592 6.488 1.00 13.96 H ATOM 691 HG3 GLN A 64 -7.823 -0.412 6.465 1.00 13.96 H ATOM 692 HE21 GLN A 64 -7.911 0.020 3.198 1.00 26.07 H ATOM 693 HE22 GLN A 64 -8.423 0.463 4.525 1.00 26.07 H ATOM 694 N VAL A 65 -6.519 -1.656 9.467 1.00 8.27 N ANISOU 694 N VAL A 65 944 1093 1105 65 -29 134 N ATOM 695 CA VAL A 65 -6.329 -2.978 10.053 1.00 6.84 C ANISOU 695 CA VAL A 65 762 868 968 -34 -125 151 C ATOM 696 C VAL A 65 -6.716 -4.039 9.036 1.00 7.42 C ANISOU 696 C VAL A 65 867 1082 869 97 -41 70 C ATOM 697 O VAL A 65 -7.800 -3.975 8.453 1.00 8.86 O ANISOU 697 O VAL A 65 1124 1259 985 155 118 -149 O ATOM 698 CB VAL A 65 -7.188 -3.142 11.320 1.00 8.97 C ANISOU 698 CB VAL A 65 1117 1085 1207 -54 -148 238 C ATOM 699 CG1 VAL A 65 -7.054 -4.560 11.878 1.00 11.03 C ANISOU 699 CG1 VAL A 65 1400 1350 1442 130 -306 387 C ATOM 700 CG2 VAL A 65 -6.788 -2.143 12.369 1.00 11.66 C ANISOU 700 CG2 VAL A 65 1420 1475 1536 -240 -52 136 C ATOM 701 H VAL A 65 -7.312 -1.340 9.571 1.00 9.92 H ATOM 702 HA VAL A 65 -5.386 -3.101 10.293 1.00 8.20 H ATOM 703 HB VAL A 65 -8.129 -2.989 11.094 1.00 10.77 H ATOM 704 HG11 VAL A 65 -7.597 -4.638 12.666 1.00 13.24 H ATOM 705 HG12 VAL A 65 -7.349 -5.186 11.213 1.00 13.24 H ATOM 706 HG13 VAL A 65 -6.134 -4.724 12.097 1.00 13.24 H ATOM 707 HG21 VAL A 65 -7.339 -2.269 13.145 1.00 13.99 H ATOM 708 HG22 VAL A 65 -5.865 -2.281 12.596 1.00 13.99 H ATOM 709 HG23 VAL A 65 -6.911 -1.257 12.020 1.00 13.99 H ATOM 710 N ARG A 66 -5.819 -4.994 8.804 1.00 6.71 N ANISOU 710 N ARG A 66 870 892 789 58 -144 136 N ATOM 711 CA ARG A 66 -6.061 -6.071 7.847 1.00 6.25 C ANISOU 711 CA ARG A 66 801 784 791 166 -117 41 C ATOM 712 C ARG A 66 -6.174 -7.394 8.583 1.00 6.70 C ANISOU 712 C ARG A 66 863 935 748 188 -38 71 C ATOM 713 O ARG A 66 -5.185 -7.883 9.149 1.00 7.18 O ANISOU 713 O ARG A 66 931 1094 702 172 90 182 O ATOM 714 CB ARG A 66 -4.974 -6.095 6.766 1.00 7.13 C ANISOU 714 CB ARG A 66 941 861 906 188 -11 -167 C ATOM 715 CG ARG A 66 -4.935 -4.798 5.941 1.00 6.59 C ANISOU 715 CG ARG A 66 858 786 859 236 58 -199 C ATOM 716 CD ARG A 66 -4.040 -4.868 4.715 1.00 7.25 C ANISOU 716 CD ARG A 66 1020 832 904 306 150 -161 C ATOM 717 NE ARG A 66 -4.308 -3.703 3.893 1.00 9.77 N ANISOU 717 NE ARG A 66 1339 1123 1251 519 226 -85 N ATOM 718 CZ ARG A 66 -3.873 -3.532 2.656 1.00 12.00 C ANISOU 718 CZ ARG A 66 1652 1402 1504 521 324 80 C ATOM 719 NH1 ARG A 66 -3.112 -4.450 2.081 1.00 13.48 N ANISOU 719 NH1 ARG A 66 1748 1630 1745 400 182 164 N ATOM 720 NH2 ARG A 66 -4.209 -2.431 1.992 1.00 13.33 N ANISOU 720 NH2 ARG A 66 1913 1511 1643 723 506 168 N ATOM 721 H ARG A 66 -5.053 -5.042 9.192 1.00 8.06 H ATOM 722 HA ARG A 66 -6.918 -5.906 7.401 1.00 7.51 H ATOM 723 HB2 ARG A 66 -4.109 -6.208 7.190 1.00 8.55 H ATOM 724 HB3 ARG A 66 -5.147 -6.832 6.160 1.00 8.55 H ATOM 725 HG2 ARG A 66 -5.833 -4.594 5.639 1.00 7.91 H ATOM 726 HG3 ARG A 66 -4.607 -4.080 6.504 1.00 7.91 H ATOM 727 HD2 ARG A 66 -3.108 -4.855 4.984 1.00 8.70 H ATOM 728 HD3 ARG A 66 -4.242 -5.667 4.203 1.00 8.70 H ATOM 729 HE ARG A 66 -4.847 -2.996 4.281 1.00 11.73 H ATOM 730 HH11 ARG A 66 -2.902 -5.166 2.510 1.00 16.18 H ATOM 731 HH12 ARG A 66 -2.829 -4.333 1.278 1.00 16.18 H ATOM 732 HH21 ARG A 66 -4.699 -1.833 2.370 1.00 16.00 H ATOM 733 HH22 ARG A 66 -3.921 -2.307 1.191 1.00 16.00 H ATOM 734 N LEU A 67 -7.392 -7.951 8.565 1.00 7.36 N ANISOU 734 N LEU A 67 920 957 921 159 -149 -33 N ATOM 735 CA LEU A 67 -7.740 -9.203 9.246 1.00 7.96 C ANISOU 735 CA LEU A 67 914 1081 1029 87 -96 -84 C ATOM 736 C LEU A 67 -7.836 -10.332 8.226 1.00 7.62 C ANISOU 736 C LEU A 67 853 1055 987 90 -127 -122 C ATOM 737 O LEU A 67 -8.030 -10.075 7.026 1.00 8.42 O ANISOU 737 O LEU A 67 958 1214 1027 106 -188 -141 O ATOM 738 CB LEU A 67 -9.084 -9.055 9.993 1.00 9.20 C ANISOU 738 CB LEU A 67 1102 1197 1197 -17 -60 -311 C ATOM 739 CG LEU A 67 -9.133 -7.833 10.902 1.00 11.23 C ANISOU 739 CG LEU A 67 1412 1300 1555 -104 13 -489 C ATOM 740 CD1 LEU A 67 -9.865 -6.668 10.227 1.00 15.47 C ANISOU 740 CD1 LEU A 67 1955 1951 1970 15 7 -652 C ATOM 741 CD2 LEU A 67 -9.793 -8.162 12.239 1.00 18.03 C ANISOU 741 CD2 LEU A 67 2272 2260 2320 -119 78 -575 C ATOM 742 H LEU A 67 -8.059 -7.605 8.147 1.00 8.83 H ATOM 743 HA LEU A 67 -7.043 -9.428 9.897 1.00 9.55 H ATOM 744 HB2 LEU A 67 -9.798 -8.972 9.343 1.00 11.04 H ATOM 745 HB3 LEU A 67 -9.226 -9.842 10.543 1.00 11.04 H ATOM 746 HG LEU A 67 -8.225 -7.545 11.084 1.00 13.47 H ATOM 747 HD11 LEU A 67 -9.877 -5.918 10.826 1.00 18.56 H ATOM 748 HD12 LEU A 67 -9.403 -6.435 9.419 1.00 18.56 H ATOM 749 HD13 LEU A 67 -10.764 -6.940 10.025 1.00 18.56 H ATOM 750 HD21 LEU A 67 -9.805 -7.371 12.783 1.00 21.64 H ATOM 751 HD22 LEU A 67 -10.689 -8.464 12.078 1.00 21.64 H ATOM 752 HD23 LEU A 67 -9.287 -8.852 12.675 1.00 21.64 H ATOM 753 N GLY A 69 -7.660 -11.580 8.675 1.00 7.33 N ANISOU 753 N GLY A 69 819 1047 918 229 -119 -137 N ATOM 754 CA GLY A 69 -7.815 -12.731 7.790 1.00 7.80 C ANISOU 754 CA GLY A 69 919 994 1052 72 -98 -241 C ATOM 755 C GLY A 69 -6.694 -12.923 6.780 1.00 8.94 C ANISOU 755 C GLY A 69 1098 1233 1064 29 -140 -269 C ATOM 756 O GLY A 69 -6.857 -13.623 5.769 1.00 10.65 O ANISOU 756 O GLY A 69 1221 1787 1039 16 -89 -239 O ATOM 757 H GLY A 69 -7.451 -11.782 9.484 1.00 8.79 H ATOM 758 HA2 GLY A 69 -7.872 -13.536 8.329 1.00 9.36 H ATOM 759 HA3 GLY A 69 -8.647 -12.640 7.299 1.00 9.36 H ATOM 760 N GLU A 70 -5.543 -12.314 7.046 1.00 9.25 N ANISOU 760 N GLU A 70 1142 1226 1146 24 -153 -272 N ATOM 761 CA GLU A 70 -4.409 -12.397 6.133 1.00 8.43 C ANISOU 761 CA GLU A 70 1036 1116 1051 82 -108 -224 C ATOM 762 C GLU A 70 -3.537 -13.610 6.375 1.00 8.42 C ANISOU 762 C GLU A 70 1068 1154 979 18 -14 -232 C ATOM 763 O GLU A 70 -3.352 -14.045 7.518 1.00 8.90 O ANISOU 763 O GLU A 70 1008 1408 966 35 -64 -39 O ATOM 764 CB GLU A 70 -3.508 -11.154 6.276 1.00 8.60 C ANISOU 764 CB GLU A 70 1065 1080 1123 5 -160 -203 C ATOM 765 CG GLU A 70 -4.061 -9.882 5.659 1.00 9.15 C ANISOU 765 CG GLU A 70 1149 1182 1146 94 -183 -75 C ATOM 766 CD GLU A 70 -3.914 -9.859 4.162 1.00 9.68 C ANISOU 766 CD GLU A 70 1296 1303 1078 262 -57 -52 C ATOM 767 OE1 GLU A 70 -3.695 -10.936 3.566 1.00 10.38 O ANISOU 767 OE1 GLU A 70 1342 1548 1053 160 -19 -38 O ATOM 768 OE2 GLU A 70 -4.028 -8.764 3.575 1.00 10.55 O ANISOU 768 OE2 GLU A 70 1445 1496 1066 242 6 19 O ATOM 769 H GLU A 70 -5.393 -11.846 7.751 1.00 11.10 H ATOM 770 HA GLU A 70 -4.738 -12.434 5.211 1.00 10.12 H ATOM 771 HB2 GLU A 70 -3.367 -10.983 7.220 1.00 10.32 H ATOM 772 HB3 GLU A 70 -2.658 -11.340 5.849 1.00 10.32 H ATOM 773 HG2 GLU A 70 -5.005 -9.811 5.870 1.00 10.98 H ATOM 774 HG3 GLU A 70 -3.581 -9.120 6.021 1.00 10.98 H ATOM 775 N HIS A 71 -2.977 -14.137 5.285 1.00 8.83 N ANISOU 775 N HIS A 71 1125 1167 1064 182 26 -312 N ATOM 776 CA HIS A 71 -1.854 -15.051 5.375 1.00 8.87 C ANISOU 776 CA HIS A 71 1150 1146 1073 138 -8 -222 C ATOM 777 C HIS A 71 -0.696 -14.516 4.542 1.00 8.44 C ANISOU 777 C HIS A 71 1084 1177 946 129 -87 -236 C ATOM 778 O HIS A 71 0.344 -14.168 5.085 1.00 7.55 O ANISOU 778 O HIS A 71 938 1192 738 207 -153 -200 O ATOM 779 CB HIS A 71 -2.198 -16.472 4.938 1.00 11.30 C ANISOU 779 CB HIS A 71 1475 1394 1425 150 80 -162 C ATOM 780 CG HIS A 71 -1.070 -17.418 5.191 1.00 11.04 C ANISOU 780 CG HIS A 71 1459 1313 1424 101 218 -218 C ATOM 781 ND1 HIS A 71 -0.384 -18.076 4.188 1.00 13.31 N ANISOU 781 ND1 HIS A 71 1851 1626 1580 -16 251 -244 N ATOM 782 CD2 HIS A 71 -0.450 -17.741 6.343 1.00 9.90 C ANISOU 782 CD2 HIS A 71 1349 1171 1241 96 66 -123 C ATOM 783 CE1 HIS A 71 0.594 -18.783 4.728 1.00 12.03 C ANISOU 783 CE1 HIS A 71 1681 1428 1464 307 176 -194 C ATOM 784 NE2 HIS A 71 0.569 -18.605 6.035 1.00 12.65 N ANISOU 784 NE2 HIS A 71 1802 1493 1511 52 67 -28 N ATOM 785 H HIS A 71 -3.235 -13.976 4.480 1.00 10.60 H ATOM 786 HA HIS A 71 -1.557 -15.091 6.308 1.00 10.64 H ATOM 787 HB2 HIS A 71 -2.971 -16.781 5.437 1.00 13.56 H ATOM 788 HB3 HIS A 71 -2.390 -16.476 3.987 1.00 13.56 H ATOM 789 HD2 HIS A 71 -0.681 -17.445 7.194 1.00 11.88 H ATOM 790 HE1 HIS A 71 1.183 -19.336 4.266 1.00 14.44 H ATOM 791 N ASN A 72 -0.887 -14.441 3.223 1.00 8.83 N ANISOU 791 N ASN A 72 1167 1126 1061 17 3 -175 N ATOM 792 CA ASN A 72 0.051 -13.769 2.340 1.00 8.42 C ANISOU 792 CA ASN A 72 1070 1090 1039 152 5 -257 C ATOM 793 C ASN A 72 -0.411 -12.316 2.185 1.00 8.00 C ANISOU 793 C ASN A 72 1027 1043 969 18 22 -60 C ATOM 794 O ASN A 72 -1.444 -12.063 1.564 1.00 7.99 O ANISOU 794 O ASN A 72 1025 1149 861 -60 -28 21 O ATOM 795 CB ASN A 72 0.051 -14.471 0.980 1.00 8.43 C ANISOU 795 CB ASN A 72 1080 1035 1088 144 85 -399 C ATOM 796 CG ASN A 72 1.074 -13.910 0.033 1.00 9.64 C ANISOU 796 CG ASN A 72 1339 1127 1196 102 67 -207 C ATOM 797 OD1 ASN A 72 1.315 -12.706 0.002 1.00 8.76 O ANISOU 797 OD1 ASN A 72 1339 942 1048 -27 -14 -46 O ATOM 798 ND2 ASN A 72 1.672 -14.785 -0.774 1.00 12.27 N ANISOU 798 ND2 ASN A 72 1578 1547 1538 334 114 -104 N ATOM 799 H ASN A 72 -1.564 -14.780 2.815 1.00 10.59 H ATOM 800 HA ASN A 72 0.954 -13.787 2.719 1.00 10.10 H ATOM 801 HB2 ASN A 72 0.248 -15.412 1.111 1.00 10.11 H ATOM 802 HB3 ASN A 72 -0.823 -14.369 0.572 1.00 10.11 H ATOM 803 HD21 ASN A 72 2.348 -14.479 -1.414 1.00 14.73 H ATOM 804 HD22 ASN A 72 1.435 -15.735 -0.727 1.00 14.73 H ATOM 805 N ILE A 73 0.314 -11.368 2.771 1.00 8.14 N ANISOU 805 N ILE A 73 1071 938 1082 36 -114 -11 N ATOM 806 CA ILE A 73 -0.109 -9.961 2.737 1.00 9.23 C ANISOU 806 CA ILE A 73 1193 1089 1226 26 -220 -40 C ATOM 807 C ILE A 73 0.051 -9.260 1.359 1.00 9.72 C ANISOU 807 C ILE A 73 1370 1117 1208 205 -150 38 C ATOM 808 O ILE A 73 -0.413 -8.124 1.179 1.00 9.51 O ANISOU 808 O ILE A 73 1486 1119 1008 273 -171 114 O ATOM 809 CB ILE A 73 0.582 -9.128 3.871 1.00 10.18 C ANISOU 809 CB ILE A 73 1280 1312 1276 -14 -277 -38 C ATOM 810 CG1 ILE A 73 2.103 -9.292 3.831 1.00 10.84 C ANISOU 810 CG1 ILE A 73 1399 1345 1374 11 -221 -13 C ATOM 811 CG2 ILE A 73 0.019 -9.541 5.251 1.00 11.63 C ANISOU 811 CG2 ILE A 73 1462 1514 1443 -48 -357 -157 C ATOM 812 CD1 ILE A 73 2.866 -8.240 4.658 1.00 10.23 C ANISOU 812 CD1 ILE A 73 1287 1270 1329 -47 -162 153 C ATOM 813 H ILE A 73 1.050 -11.507 3.194 1.00 9.76 H ATOM 814 HA ILE A 73 -1.068 -9.947 2.936 1.00 11.08 H ATOM 815 HB ILE A 73 0.374 -8.191 3.727 1.00 12.22 H ATOM 816 HG12 ILE A 73 2.332 -10.167 4.182 1.00 13.01 H ATOM 817 HG13 ILE A 73 2.401 -9.219 2.911 1.00 13.01 H ATOM 818 HG21 ILE A 73 0.452 -9.022 5.932 1.00 13.96 H ATOM 819 HG22 ILE A 73 -0.926 -9.376 5.264 1.00 13.96 H ATOM 820 HG23 ILE A 73 0.191 -10.475 5.391 1.00 13.96 H ATOM 821 HD11 ILE A 73 3.808 -8.408 4.584 1.00 12.27 H ATOM 822 HD12 ILE A 73 2.661 -7.367 4.316 1.00 12.27 H ATOM 823 HD13 ILE A 73 2.592 -8.306 5.575 1.00 12.27 H ATOM 824 N LYS A 74 0.674 -9.937 0.397 1.00 12.01 N ANISOU 824 N LYS A 74 1616 1481 1465 30 -107 21 N ATOM 825 CA LYS A 74 0.875 -9.388 -0.946 1.00 14.87 C ANISOU 825 CA LYS A 74 1948 1851 1851 72 -4 124 C ATOM 826 C LYS A 74 -0.115 -9.895 -1.993 1.00 13.84 C ANISOU 826 C LYS A 74 1961 1752 1545 -13 18 54 C ATOM 827 O LYS A 74 -0.139 -9.377 -3.113 1.00 15.32 O ANISOU 827 O LYS A 74 2418 1892 1510 -305 -12 253 O ATOM 828 CB LYS A 74 2.298 -9.701 -1.442 1.00 18.33 C ANISOU 828 CB LYS A 74 2316 2308 2341 6 106 199 C ATOM 829 CG LYS A 74 3.408 -9.215 -0.529 1.00 26.89 C ANISOU 829 CG LYS A 74 3395 3426 3396 30 235 241 C ATOM 830 CD LYS A 74 3.215 -7.756 -0.156 1.00 31.10 C ANISOU 830 CD LYS A 74 3927 3949 3940 23 229 281 C ATOM 831 CE LYS A 74 4.279 -7.280 0.820 0.00 29.97 C ANISOU 831 CE LYS A 74 3783 3788 3815 34 231 278 C ATOM 832 NZ LYS A 74 5.632 -7.242 0.202 0.00 29.91 N ANISOU 832 NZ LYS A 74 3772 3764 3827 45 222 274 N ATOM 833 H LYS A 74 0.995 -10.729 0.497 1.00 14.41 H ATOM 834 HA LYS A 74 0.784 -8.413 -0.901 1.00 17.85 H ATOM 835 HB2 LYS A 74 2.390 -10.663 -1.530 1.00 22.00 H ATOM 836 HB3 LYS A 74 2.424 -9.281 -2.307 1.00 22.00 H ATOM 837 HG2 LYS A 74 3.406 -9.741 0.287 1.00 32.27 H ATOM 838 HG3 LYS A 74 4.260 -9.304 -0.984 1.00 32.27 H ATOM 839 HD2 LYS A 74 3.273 -7.212 -0.957 1.00 37.32 H ATOM 840 HD3 LYS A 74 2.347 -7.646 0.263 1.00 37.32 H ATOM 841 HE2 LYS A 74 4.058 -6.384 1.119 0.00 35.96 H ATOM 842 HE3 LYS A 74 4.310 -7.886 1.577 0.00 35.96 H ATOM 843 HZ1 LYS A 74 6.277 -6.938 0.844 0.00 35.89 H ATOM 844 HZ2 LYS A 74 5.880 -8.120 -0.098 0.00 35.89 H ATOM 845 HZ3 LYS A 74 5.633 -6.644 -0.549 0.00 35.89 H ATOM 846 N VAL A 75 -0.912 -10.902 -1.651 1.00 11.01 N ANISOU 846 N VAL A 75 1421 1412 1350 56 -81 -269 N ATOM 847 CA VAL A 75 -1.792 -11.553 -2.602 1.00 11.94 C ANISOU 847 CA VAL A 75 1438 1610 1490 -35 -216 -261 C ATOM 848 C VAL A 75 -3.213 -11.669 -2.035 1.00 11.57 C ANISOU 848 C VAL A 75 1448 1634 1315 164 -314 -190 C ATOM 849 O VAL A 75 -3.393 -12.044 -0.895 1.00 11.18 O ANISOU 849 O VAL A 75 1460 1780 1009 197 -513 -118 O ATOM 850 CB VAL A 75 -1.275 -12.977 -2.925 1.00 14.45 C ANISOU 850 CB VAL A 75 1781 1855 1854 -297 -280 -473 C ATOM 851 CG1 VAL A 75 -2.257 -13.698 -3.807 1.00 18.75 C ANISOU 851 CG1 VAL A 75 2362 2353 2409 -242 -275 -563 C ATOM 852 CG2 VAL A 75 0.130 -12.934 -3.589 1.00 17.08 C ANISOU 852 CG2 VAL A 75 2172 2144 2174 -330 -288 -494 C ATOM 853 H VAL A 75 -0.958 -11.229 -0.857 1.00 13.21 H ATOM 854 HA VAL A 75 -1.825 -11.034 -3.432 1.00 14.33 H ATOM 855 HB VAL A 75 -1.196 -13.482 -2.089 1.00 17.34 H ATOM 856 HG11 VAL A 75 -1.920 -14.577 -3.996 1.00 22.50 H ATOM 857 HG12 VAL A 75 -3.099 -13.761 -3.350 1.00 22.50 H ATOM 858 HG13 VAL A 75 -2.363 -13.205 -4.624 1.00 22.50 H ATOM 859 HG21 VAL A 75 0.415 -13.832 -3.774 1.00 20.50 H ATOM 860 HG22 VAL A 75 0.073 -12.433 -4.406 1.00 20.50 H ATOM 861 HG23 VAL A 75 0.747 -12.511 -2.987 1.00 20.50 H ATOM 862 N LEU A 76 -4.222 -11.362 -2.833 1.00 12.86 N ANISOU 862 N LEU A 76 1617 1738 1531 240 -364 -119 N ATOM 863 CA LEU A 76 -5.615 -11.584 -2.440 1.00 15.55 C ANISOU 863 CA LEU A 76 1979 2041 1888 276 -435 -91 C ATOM 864 C LEU A 76 -5.929 -13.082 -2.389 1.00 16.18 C ANISOU 864 C LEU A 76 2097 2235 1815 56 -287 -399 C ATOM 865 O LEU A 76 -5.753 -13.801 -3.383 1.00 16.69 O ANISOU 865 O LEU A 76 2319 2339 1683 -197 -81 -694 O ATOM 866 CB LEU A 76 -6.567 -10.889 -3.418 1.00 20.32 C ANISOU 866 CB LEU A 76 2538 2625 2558 208 -621 57 C ATOM 867 CG LEU A 76 -8.056 -11.211 -3.232 1.00 24.91 C ANISOU 867 CG LEU A 76 3154 3186 3124 301 -780 235 C ATOM 868 CD1 LEU A 76 -8.594 -10.552 -1.960 1.00 30.89 C ANISOU 868 CD1 LEU A 76 3895 3927 3915 316 -756 277 C ATOM 869 CD2 LEU A 76 -8.874 -10.771 -4.459 1.00 23.36 C ANISOU 869 CD2 LEU A 76 2944 2941 2991 293 -898 340 C ATOM 870 H LEU A 76 -4.132 -11.019 -3.617 1.00 15.43 H ATOM 871 HA LEU A 76 -5.763 -11.208 -1.547 1.00 18.66 H ATOM 872 HB2 LEU A 76 -6.462 -9.930 -3.320 1.00 24.38 H ATOM 873 HB3 LEU A 76 -6.324 -11.151 -4.321 1.00 24.38 H ATOM 874 HG LEU A 76 -8.159 -12.170 -3.135 1.00 29.89 H ATOM 875 HD11 LEU A 76 -9.525 -10.768 -1.866 1.00 37.07 H ATOM 876 HD12 LEU A 76 -8.103 -10.884 -1.204 1.00 37.07 H ATOM 877 HD13 LEU A 76 -8.483 -9.601 -2.030 1.00 37.07 H ATOM 878 HD21 LEU A 76 -9.798 -10.985 -4.311 1.00 28.03 H ATOM 879 HD22 LEU A 76 -8.772 -9.824 -4.579 1.00 28.03 H ATOM 880 HD23 LEU A 76 -8.549 -11.236 -5.233 1.00 28.03 H ATOM 881 N GLU A 77 -6.371 -13.556 -1.225 1.00 14.88 N ANISOU 881 N GLU A 77 1836 2000 1819 86 -450 -316 N ATOM 882 CA GLU A 77 -6.659 -14.968 -1.023 1.00 16.26 C ANISOU 882 CA GLU A 77 1991 2200 1987 0 -668 -282 C ATOM 883 C GLU A 77 -8.158 -15.204 -0.833 1.00 16.66 C ANISOU 883 C GLU A 77 2029 2320 1981 -175 -751 -381 C ATOM 884 O GLU A 77 -8.649 -16.318 -1.024 1.00 17.94 O ANISOU 884 O GLU A 77 2173 2617 2025 -49 -674 -367 O ATOM 885 CB GLU A 77 -5.886 -15.478 0.189 1.00 16.39 C ANISOU 885 CB GLU A 77 2066 2091 2071 -194 -791 -176 C ATOM 886 CG GLU A 77 -4.389 -15.299 0.067 1.00 17.33 C ANISOU 886 CG GLU A 77 2209 2218 2156 -181 -847 -75 C ATOM 887 CD GLU A 77 -3.701 -15.152 1.418 1.00 16.60 C ANISOU 887 CD GLU A 77 2065 2273 1970 -83 -803 69 C ATOM 888 OE1 GLU A 77 -2.886 -16.036 1.697 1.00 16.45 O ANISOU 888 OE1 GLU A 77 2081 2238 1930 121 -739 -53 O ATOM 889 OE2 GLU A 77 -3.966 -14.173 2.188 1.00 15.12 O ANISOU 889 OE2 GLU A 77 1828 2063 1855 -113 -742 198 O ATOM 890 H GLU A 77 -6.513 -13.071 -0.529 1.00 17.86 H ATOM 891 HA GLU A 77 -6.366 -15.473 -1.810 1.00 19.51 H ATOM 892 HB2 GLU A 77 -6.181 -14.993 0.976 1.00 19.67 H ATOM 893 HB3 GLU A 77 -6.065 -16.425 0.299 1.00 19.67 H ATOM 894 HG2 GLU A 77 -4.013 -16.075 -0.378 1.00 20.79 H ATOM 895 HG3 GLU A 77 -4.207 -14.500 -0.451 1.00 20.79 H ATOM 896 N GLY A 78 -8.871 -14.150 -0.445 1.00 16.71 N ANISOU 896 N GLY A 78 2001 2298 2051 -150 -696 -557 N ATOM 897 CA GLY A 78 -10.324 -14.181 -0.356 1.00 18.29 C ANISOU 897 CA GLY A 78 2199 2493 2256 -221 -582 -644 C ATOM 898 C GLY A 78 -10.885 -14.248 1.057 1.00 18.42 C ANISOU 898 C GLY A 78 2019 2775 2204 -254 -428 -628 C ATOM 899 O GLY A 78 -12.098 -14.296 1.219 1.00 19.82 O ANISOU 899 O GLY A 78 1999 3270 2263 -218 -358 -658 O ATOM 900 H GLY A 78 -8.528 -13.393 -0.224 1.00 20.06 H ATOM 901 HA2 GLY A 78 -10.682 -13.386 -0.781 1.00 21.94 H ATOM 902 HA3 GLY A 78 -10.652 -14.953 -0.843 1.00 21.94 H ATOM 903 N ASN A 79 -10.022 -14.273 2.070 1.00 16.81 N ANISOU 903 N ASN A 79 2009 2280 2100 -395 -469 -680 N ATOM 904 CA ASN A 79 -10.474 -14.312 3.470 1.00 16.64 C ANISOU 904 CA ASN A 79 2086 2149 2086 -189 -413 -388 C ATOM 905 C ASN A 79 -10.237 -13.003 4.220 1.00 14.89 C ANISOU 905 C ASN A 79 1805 2034 1818 97 -380 -341 C ATOM 906 O ASN A 79 -10.524 -12.889 5.422 1.00 14.56 O ANISOU 906 O ASN A 79 1702 2190 1640 122 -267 -263 O ATOM 907 CB ASN A 79 -9.775 -15.459 4.202 1.00 19.68 C ANISOU 907 CB ASN A 79 2500 2444 2533 -286 -348 -316 C ATOM 908 CG ASN A 79 -10.174 -16.815 3.648 1.00 24.07 C ANISOU 908 CG ASN A 79 3162 2890 3094 -341 -247 -211 C ATOM 909 OD1 ASN A 79 -11.353 -17.161 3.630 1.00 25.44 O ANISOU 909 OD1 ASN A 79 3464 2938 3265 -490 -135 -223 O ATOM 910 ND2 ASN A 79 -9.205 -17.565 3.165 1.00 27.94 N ANISOU 910 ND2 ASN A 79 3607 3440 3569 -197 -237 -120 N ATOM 911 H ASN A 79 -9.167 -14.270 1.978 1.00 20.18 H ATOM 912 HA ASN A 79 -11.438 -14.492 3.484 1.00 19.96 H ATOM 913 HB2 ASN A 79 -8.815 -15.363 4.102 1.00 23.61 H ATOM 914 HB3 ASN A 79 -10.017 -15.433 5.141 1.00 23.61 H ATOM 915 HD21 ASN A 79 -9.409 -18.449 2.796 1.00 33.53 H ATOM 916 HD22 ASN A 79 -8.281 -17.239 3.176 1.00 33.53 H ATOM 917 N GLU A 80 -9.738 -12.006 3.505 1.00 14.03 N ANISOU 917 N GLU A 80 1754 1800 1778 254 -336 -332 N ATOM 918 CA GLU A 80 -9.301 -10.760 4.121 1.00 13.63 C ANISOU 918 CA GLU A 80 1652 1848 1680 271 -482 -352 C ATOM 919 C GLU A 80 -10.485 -9.862 4.450 1.00 11.63 C ANISOU 919 C GLU A 80 1251 1798 1370 308 -453 -143 C ATOM 920 O GLU A 80 -11.536 -9.919 3.793 1.00 12.82 O ANISOU 920 O GLU A 80 1292 2277 1303 252 -420 -299 O ATOM 921 CB GLU A 80 -8.353 -10.002 3.195 1.00 15.94 C ANISOU 921 CB GLU A 80 1937 2093 2025 138 -487 -614 C ATOM 922 CG GLU A 80 -7.048 -10.750 2.878 1.00 14.12 C ANISOU 922 CG GLU A 80 1656 1921 1788 97 -526 -634 C ATOM 923 CD GLU A 80 -7.114 -11.566 1.588 1.00 12.62 C ANISOU 923 CD GLU A 80 1413 2023 1357 -61 -441 -426 C ATOM 924 OE1 GLU A 80 -8.222 -11.905 1.144 1.00 12.97 O ANISOU 924 OE1 GLU A 80 1566 2227 1136 -265 -476 -474 O ATOM 925 OE2 GLU A 80 -6.046 -11.890 1.019 1.00 12.04 O ANISOU 925 OE2 GLU A 80 1391 1900 1284 -38 -420 -297 O ATOM 926 H GLU A 80 -9.641 -12.025 2.651 1.00 16.84 H ATOM 927 HA GLU A 80 -8.824 -10.960 4.954 1.00 16.36 H ATOM 928 HB2 GLU A 80 -8.808 -9.833 2.355 1.00 19.12 H ATOM 929 HB3 GLU A 80 -8.116 -9.159 3.613 1.00 19.12 H ATOM 930 HG2 GLU A 80 -6.331 -10.104 2.785 1.00 16.94 H ATOM 931 HG3 GLU A 80 -6.851 -11.359 3.606 1.00 16.94 H ATOM 932 N GLN A 81 -10.312 -9.044 5.482 1.00 9.72 N ANISOU 932 N GLN A 81 1047 1409 1239 207 -437 -28 N ATOM 933 CA GLN A 81 -11.197 -7.923 5.737 1.00 10.03 C ANISOU 933 CA GLN A 81 1205 1360 1244 230 -185 8 C ATOM 934 C GLN A 81 -10.301 -6.736 6.054 1.00 9.89 C ANISOU 934 C GLN A 81 1075 1541 1141 265 -97 -75 C ATOM 935 O GLN A 81 -9.447 -6.810 6.942 1.00 11.69 O ANISOU 935 O GLN A 81 1260 1890 1293 105 -261 -2 O ATOM 936 CB GLN A 81 -12.124 -8.168 6.941 1.00 12.48 C ANISOU 936 CB GLN A 81 1517 1596 1627 -61 74 -10 C ATOM 937 CG GLN A 81 -12.977 -9.401 6.894 1.00 17.42 C ANISOU 937 CG GLN A 81 2158 2263 2198 -88 391 -87 C ATOM 938 CD GLN A 81 -13.713 -9.618 8.210 1.00 17.29 C ANISOU 938 CD GLN A 81 2024 2347 2197 -217 494 -34 C ATOM 939 OE1 GLN A 81 -14.256 -8.670 8.797 1.00 16.23 O ANISOU 939 OE1 GLN A 81 1686 2447 2033 -23 452 -234 O ATOM 940 NE2 GLN A 81 -13.702 -10.856 8.697 1.00 17.68 N ANISOU 940 NE2 GLN A 81 2167 2247 2302 -480 556 102 N ATOM 941 H GLN A 81 -9.676 -9.121 6.057 1.00 11.67 H ATOM 942 HA GLN A 81 -11.736 -7.724 4.943 1.00 12.03 H ATOM 943 HB2 GLN A 81 -11.574 -8.229 7.738 1.00 14.97 H ATOM 944 HB3 GLN A 81 -12.721 -7.408 7.021 1.00 14.97 H ATOM 945 HG2 GLN A 81 -13.637 -9.308 6.188 1.00 20.90 H ATOM 946 HG3 GLN A 81 -12.415 -10.174 6.729 1.00 20.90 H ATOM 947 HE21 GLN A 81 -14.103 -11.030 9.438 1.00 21.21 H ATOM 948 HE22 GLN A 81 -13.293 -11.482 8.272 1.00 21.21 H ATOM 949 N PHE A 82 -10.509 -5.636 5.357 1.00 9.43 N ANISOU 949 N PHE A 82 1066 1433 1083 318 -45 -80 N ATOM 950 CA PHE A 82 -9.749 -4.414 5.587 1.00 9.69 C ANISOU 950 CA PHE A 82 1157 1406 1118 258 -174 -83 C ATOM 951 C PHE A 82 -10.664 -3.372 6.230 1.00 9.52 C ANISOU 951 C PHE A 82 1057 1549 1012 283 -200 -22 C ATOM 952 O PHE A 82 -11.691 -2.989 5.651 1.00 10.02 O ANISOU 952 O PHE A 82 1095 1792 922 514 -241 -66 O ATOM 953 CB PHE A 82 -9.174 -3.834 4.268 1.00 10.35 C ANISOU 953 CB PHE A 82 1274 1353 1304 239 -188 -74 C ATOM 954 CG PHE A 82 -8.210 -4.741 3.516 1.00 12.44 C ANISOU 954 CG PHE A 82 1593 1519 1616 405 -265 -102 C ATOM 955 CD1 PHE A 82 -7.801 -4.373 2.238 1.00 15.96 C ANISOU 955 CD1 PHE A 82 2046 2020 1998 630 -210 -206 C ATOM 956 CD2 PHE A 82 -7.716 -5.920 4.049 1.00 12.29 C ANISOU 956 CD2 PHE A 82 1503 1517 1651 663 -270 -199 C ATOM 957 CE1 PHE A 82 -6.930 -5.145 1.506 1.00 15.02 C ANISOU 957 CE1 PHE A 82 1902 1916 1891 691 -76 -248 C ATOM 958 CE2 PHE A 82 -6.833 -6.712 3.306 1.00 14.16 C ANISOU 958 CE2 PHE A 82 1825 1794 1761 653 -190 -149 C ATOM 959 CZ PHE A 82 -6.435 -6.312 2.037 1.00 13.81 C ANISOU 959 CZ PHE A 82 1759 1743 1747 714 -70 -332 C ATOM 960 H PHE A 82 -11.096 -5.566 4.732 1.00 11.31 H ATOM 961 HA PHE A 82 -9.006 -4.598 6.198 1.00 11.62 H ATOM 962 HB2 PHE A 82 -9.914 -3.638 3.671 1.00 12.42 H ATOM 963 HB3 PHE A 82 -8.700 -3.014 4.475 1.00 12.42 H ATOM 964 HD1 PHE A 82 -8.124 -3.582 1.870 1.00 19.15 H ATOM 965 HD2 PHE A 82 -7.976 -6.188 4.901 1.00 14.75 H ATOM 966 HE1 PHE A 82 -6.671 -4.875 0.655 1.00 18.03 H ATOM 967 HE2 PHE A 82 -6.501 -7.501 3.669 1.00 16.99 H ATOM 968 HZ PHE A 82 -5.850 -6.839 1.542 1.00 16.57 H ATOM 969 N ILE A 83 -10.322 -2.938 7.442 1.00 8.57 N ANISOU 969 N ILE A 83 1000 1191 1065 181 -158 -63 N ATOM 970 CA ILE A 83 -11.153 -1.999 8.195 1.00 8.60 C ANISOU 970 CA ILE A 83 1056 1130 1083 120 -84 161 C ATOM 971 C ILE A 83 -10.295 -0.871 8.766 1.00 8.53 C ANISOU 971 C ILE A 83 997 1212 1033 327 -13 175 C ATOM 972 O ILE A 83 -9.334 -1.126 9.492 1.00 8.69 O ANISOU 972 O ILE A 83 878 1341 1083 509 -10 152 O ATOM 973 CB ILE A 83 -11.873 -2.715 9.355 1.00 11.02 C ANISOU 973 CB ILE A 83 1369 1409 1408 37 -10 163 C ATOM 974 CG1 ILE A 83 -12.667 -3.928 8.834 1.00 13.56 C ANISOU 974 CG1 ILE A 83 1703 1684 1765 -104 105 315 C ATOM 975 CG2 ILE A 83 -12.794 -1.739 10.091 1.00 11.47 C ANISOU 975 CG2 ILE A 83 1436 1449 1472 204 -93 78 C ATOM 976 CD1 ILE A 83 -13.174 -4.849 9.960 1.00 15.16 C ANISOU 976 CD1 ILE A 83 1917 1880 1963 -96 147 377 C ATOM 977 H ILE A 83 -9.605 -3.175 7.854 1.00 10.28 H ATOM 978 HA ILE A 83 -11.828 -1.609 7.601 1.00 10.32 H ATOM 979 HB ILE A 83 -11.203 -3.033 9.980 1.00 13.22 H ATOM 980 HG12 ILE A 83 -13.438 -3.611 8.339 1.00 16.27 H ATOM 981 HG13 ILE A 83 -12.095 -4.454 8.253 1.00 16.27 H ATOM 982 HG21 ILE A 83 -13.231 -2.204 10.808 1.00 13.76 H ATOM 983 HG22 ILE A 83 -12.267 -1.017 10.442 1.00 13.76 H ATOM 984 HG23 ILE A 83 -13.446 -1.400 9.474 1.00 13.76 H ATOM 985 HD11 ILE A 83 -13.658 -5.581 9.571 1.00 18.19 H ATOM 986 HD12 ILE A 83 -12.421 -5.180 10.455 1.00 18.19 H ATOM 987 HD13 ILE A 83 -13.751 -4.346 10.539 1.00 18.19 H ATOM 988 N ASN A 84 -10.639 0.376 8.461 1.00 9.64 N ANISOU 988 N ASN A 84 1188 1304 1169 284 -119 317 N ATOM 989 CA ASN A 84 -9.887 1.512 9.004 1.00 10.82 C ANISOU 989 CA ASN A 84 1406 1335 1370 451 -134 384 C ATOM 990 C ASN A 84 -10.135 1.701 10.502 1.00 10.77 C ANISOU 990 C ASN A 84 1397 1362 1333 481 38 316 C ATOM 991 O ASN A 84 -11.227 1.450 11.013 1.00 11.46 O ANISOU 991 O ASN A 84 1453 1602 1300 333 157 120 O ATOM 992 CB ASN A 84 -10.220 2.809 8.270 1.00 14.14 C ANISOU 992 CB ASN A 84 1837 1744 1790 413 -151 462 C ATOM 993 CG ASN A 84 -9.773 2.796 6.829 1.00 17.72 C ANISOU 993 CG ASN A 84 2246 2264 2223 365 -132 753 C ATOM 994 OD1 ASN A 84 -8.806 2.113 6.459 1.00 17.32 O ANISOU 994 OD1 ASN A 84 2217 2299 2066 254 -167 750 O ATOM 995 ND2 ASN A 84 -10.468 3.566 5.999 1.00 22.82 N ANISOU 995 ND2 ASN A 84 2878 2903 2891 326 -114 857 N ATOM 996 H ASN A 84 -11.294 0.593 7.948 1.00 11.56 H ATOM 997 HA ASN A 84 -8.930 1.340 8.882 1.00 12.98 H ATOM 998 HB2 ASN A 84 -11.181 2.943 8.284 1.00 16.96 H ATOM 999 HB3 ASN A 84 -9.776 3.548 8.715 1.00 16.96 H ATOM 1000 HD21 ASN A 84 -10.229 3.603 5.049 1.00 27.39 H ATOM 1001 HD22 ASN A 84 -11.219 4.097 6.337 1.00 27.39 H ATOM 1002 N ALA A 85 -9.100 2.137 11.203 1.00 10.72 N ANISOU 1002 N ALA A 85 1493 1216 1364 523 -4 335 N ATOM 1003 CA ALA A 85 -9.224 2.491 12.608 1.00 12.77 C ANISOU 1003 CA ALA A 85 1751 1465 1635 646 23 446 C ATOM 1004 C ALA A 85 -10.069 3.757 12.755 1.00 13.14 C ANISOU 1004 C ALA A 85 1966 1374 1655 651 48 397 C ATOM 1005 O ALA A 85 -9.895 4.724 11.999 1.00 13.83 O ANISOU 1005 O ALA A 85 2309 1271 1675 623 363 356 O ATOM 1006 CB ALA A 85 -7.868 2.714 13.195 1.00 13.85 C ANISOU 1006 CB ALA A 85 1755 1702 1808 711 -115 430 C ATOM 1007 H ALA A 85 -8.307 2.237 10.886 1.00 12.87 H ATOM 1008 HA ALA A 85 -9.662 1.762 13.096 1.00 15.32 H ATOM 1009 HB1 ALA A 85 -7.963 2.947 14.121 1.00 16.63 H ATOM 1010 HB2 ALA A 85 -7.355 1.906 13.111 1.00 16.63 H ATOM 1011 HB3 ALA A 85 -7.436 3.427 12.720 1.00 16.63 H ATOM 1012 N ALA A 86 -11.004 3.720 13.700 1.00 13.46 N ANISOU 1012 N ALA A 86 1861 1588 1666 520 -195 316 N ATOM 1013 CA ALA A 86 -11.814 4.881 14.082 1.00 13.06 C ANISOU 1013 CA ALA A 86 1743 1488 1732 500 -254 304 C ATOM 1014 C ALA A 86 -11.254 5.614 15.299 1.00 13.65 C ANISOU 1014 C ALA A 86 1962 1392 1834 465 -239 181 C ATOM 1015 O ALA A 86 -11.415 6.836 15.431 1.00 14.92 O ANISOU 1015 O ALA A 86 2286 1384 1997 477 -274 72 O ATOM 1016 CB ALA A 86 -13.251 4.455 14.366 1.00 14.87 C ANISOU 1016 CB ALA A 86 1903 1796 1949 401 -251 227 C ATOM 1017 H ALA A 86 -11.194 3.012 14.150 1.00 16.15 H ATOM 1018 HA ALA A 86 -11.831 5.513 13.333 1.00 15.67 H ATOM 1019 HB1 ALA A 86 -13.763 5.228 14.613 1.00 17.84 H ATOM 1020 HB2 ALA A 86 -13.621 4.056 13.575 1.00 17.84 H ATOM 1021 HB3 ALA A 86 -13.251 3.818 15.085 1.00 17.84 H ATOM 1022 N LYS A 87 -10.627 4.880 16.209 1.00 13.82 N ANISOU 1022 N LYS A 87 1782 1623 1847 447 -228 96 N ATOM 1023 CA LYS A 87 -9.992 5.513 17.365 1.00 15.25 C ANISOU 1023 CA LYS A 87 1938 1903 1955 407 -128 127 C ATOM 1024 C LYS A 87 -8.737 4.751 17.709 1.00 11.68 C ANISOU 1024 C LYS A 87 1494 1433 1510 324 -23 221 C ATOM 1025 O LYS A 87 -8.711 3.530 17.583 1.00 10.61 O ANISOU 1025 O LYS A 87 1359 1298 1373 165 145 332 O ATOM 1026 CB LYS A 87 -10.930 5.579 18.583 1.00 20.45 C ANISOU 1026 CB LYS A 87 2570 2609 2592 224 -115 128 C ATOM 1027 CG LYS A 87 -10.512 6.684 19.548 0.00 21.96 C ANISOU 1027 CG LYS A 87 2774 2780 2788 218 -132 151 C ATOM 1028 CD LYS A 87 -11.515 6.947 20.657 0.00 22.17 C ANISOU 1028 CD LYS A 87 2803 2805 2816 206 -134 149 C ATOM 1029 CE LYS A 87 -11.076 8.158 21.474 0.00 21.90 C ANISOU 1029 CE LYS A 87 2769 2769 2785 193 -137 134 C ATOM 1030 NZ LYS A 87 -11.692 8.222 22.825 0.00 21.91 N ANISOU 1030 NZ LYS A 87 2763 2759 2802 183 -145 117 N ATOM 1031 H LYS A 87 -10.554 4.024 16.184 1.00 16.59 H ATOM 1032 HA LYS A 87 -9.737 6.429 17.129 1.00 18.30 H ATOM 1033 HB2 LYS A 87 -11.833 5.763 18.282 1.00 24.54 H ATOM 1034 HB3 LYS A 87 -10.899 4.733 19.057 1.00 24.54 H ATOM 1035 HG2 LYS A 87 -9.672 6.435 19.962 0.00 26.35 H ATOM 1036 HG3 LYS A 87 -10.401 7.508 19.048 0.00 26.35 H ATOM 1037 HD2 LYS A 87 -12.385 7.133 20.271 0.00 26.60 H ATOM 1038 HD3 LYS A 87 -11.560 6.177 21.245 0.00 26.60 H ATOM 1039 HE2 LYS A 87 -10.114 8.126 21.588 0.00 26.28 H ATOM 1040 HE3 LYS A 87 -11.324 8.964 20.996 0.00 26.28 H ATOM 1041 HZ1 LYS A 87 -11.381 9.001 23.291 0.00 26.29 H ATOM 1042 HZ2 LYS A 87 -12.648 8.266 22.747 0.00 26.29 H ATOM 1043 HZ3 LYS A 87 -11.456 7.441 23.330 0.00 26.29 H ATOM 1044 N ILE A 88 -7.693 5.474 18.115 1.00 10.60 N ANISOU 1044 N ILE A 88 1363 1246 1419 361 6 281 N ATOM 1045 CA ILE A 88 -6.406 4.867 18.448 1.00 10.32 C ANISOU 1045 CA ILE A 88 1416 1130 1377 167 -102 258 C ATOM 1046 C ILE A 88 -5.938 5.471 19.765 1.00 11.29 C ANISOU 1046 C ILE A 88 1691 1179 1421 19 -161 255 C ATOM 1047 O ILE A 88 -5.716 6.684 19.853 1.00 12.02 O ANISOU 1047 O ILE A 88 2129 1010 1430 25 -282 239 O ATOM 1048 CB ILE A 88 -5.389 5.111 17.321 1.00 12.36 C ANISOU 1048 CB ILE A 88 1567 1460 1669 149 -47 170 C ATOM 1049 CG1 ILE A 88 -5.987 4.624 15.991 1.00 13.92 C ANISOU 1049 CG1 ILE A 88 1759 1701 1827 207 119 129 C ATOM 1050 CG2 ILE A 88 -4.064 4.424 17.622 1.00 16.09 C ANISOU 1050 CG2 ILE A 88 2059 1947 2108 23 36 126 C ATOM 1051 CD1 ILE A 88 -5.243 5.101 14.735 1.00 18.11 C ANISOU 1051 CD1 ILE A 88 2299 2269 2313 137 151 87 C ATOM 1052 H ILE A 88 -7.706 6.329 18.206 1.00 12.72 H ATOM 1053 HA ILE A 88 -6.517 3.900 18.568 1.00 12.39 H ATOM 1054 HB ILE A 88 -5.230 6.065 17.254 1.00 14.83 H ATOM 1055 HG12 ILE A 88 -5.979 3.654 15.986 1.00 16.70 H ATOM 1056 HG13 ILE A 88 -6.901 4.943 15.929 1.00 16.70 H ATOM 1057 HG21 ILE A 88 -3.453 4.595 16.901 1.00 19.31 H ATOM 1058 HG22 ILE A 88 -3.710 4.774 18.442 1.00 19.31 H ATOM 1059 HG23 ILE A 88 -4.214 3.479 17.706 1.00 19.31 H ATOM 1060 HD11 ILE A 88 -5.686 4.750 13.959 1.00 21.73 H ATOM 1061 HD12 ILE A 88 -5.253 6.061 14.712 1.00 21.73 H ATOM 1062 HD13 ILE A 88 -4.338 4.783 14.769 1.00 21.73 H ATOM 1063 N ILE A 89 -5.807 4.616 20.778 1.00 10.52 N ANISOU 1063 N ILE A 89 1443 1139 1417 40 -44 315 N ATOM 1064 CA ILE A 89 -5.641 5.038 22.174 1.00 9.62 C ANISOU 1064 CA ILE A 89 1226 1126 1303 228 -10 365 C ATOM 1065 C ILE A 89 -4.407 4.394 22.817 1.00 8.33 C ANISOU 1065 C ILE A 89 1081 939 1145 245 191 252 C ATOM 1066 O ILE A 89 -4.407 3.198 23.115 1.00 7.63 O ANISOU 1066 O ILE A 89 1031 801 1068 203 179 67 O ATOM 1067 CB ILE A 89 -6.890 4.675 23.006 1.00 10.80 C ANISOU 1067 CB ILE A 89 1395 1280 1431 517 -44 379 C ATOM 1068 CG1 ILE A 89 -8.142 5.261 22.339 1.00 12.67 C ANISOU 1068 CG1 ILE A 89 1588 1564 1661 456 -13 438 C ATOM 1069 CG2 ILE A 89 -6.712 5.116 24.448 1.00 10.30 C ANISOU 1069 CG2 ILE A 89 1312 1222 1380 372 70 387 C ATOM 1070 CD1 ILE A 89 -9.434 4.790 22.961 1.00 11.67 C ANISOU 1070 CD1 ILE A 89 1446 1436 1552 291 -61 487 C ATOM 1071 H ILE A 89 -5.812 3.762 20.681 1.00 12.63 H ATOM 1072 HA ILE A 89 -5.528 6.010 22.204 1.00 11.54 H ATOM 1073 HB ILE A 89 -6.978 3.709 23.001 1.00 12.96 H ATOM 1074 HG12 ILE A 89 -8.113 6.228 22.413 1.00 15.20 H ATOM 1075 HG13 ILE A 89 -8.150 5.002 21.405 1.00 15.20 H ATOM 1076 HG21 ILE A 89 -7.499 4.880 24.946 1.00 12.36 H ATOM 1077 HG22 ILE A 89 -5.945 4.671 24.818 1.00 12.36 H ATOM 1078 HG23 ILE A 89 -6.582 6.066 24.470 1.00 12.36 H ATOM 1079 HD11 ILE A 89 -10.170 5.195 22.496 1.00 14.00 H ATOM 1080 HD12 ILE A 89 -9.485 3.834 22.887 1.00 14.00 H ATOM 1081 HD13 ILE A 89 -9.448 5.049 23.885 1.00 14.00 H ATOM 1082 N ARG A 90 -3.353 5.196 22.990 1.00 8.44 N ANISOU 1082 N ARG A 90 1138 966 1104 295 134 142 N ATOM 1083 CA ARG A 90 -2.122 4.767 23.647 1.00 7.58 C ANISOU 1083 CA ARG A 90 1002 854 1024 16 197 88 C ATOM 1084 C ARG A 90 -2.348 4.719 25.156 1.00 6.57 C ANISOU 1084 C ARG A 90 888 714 893 91 108 -48 C ATOM 1085 O ARG A 90 -3.096 5.529 25.710 1.00 7.09 O ANISOU 1085 O ARG A 90 827 1008 859 255 300 -152 O ATOM 1086 CB ARG A 90 -0.965 5.728 23.338 1.00 8.86 C ANISOU 1086 CB ARG A 90 1100 1055 1210 -6 363 19 C ATOM 1087 CG ARG A 90 -0.480 5.679 21.901 1.00 12.60 C ANISOU 1087 CG ARG A 90 1637 1481 1669 -146 535 -31 C ATOM 1088 CD ARG A 90 0.663 6.645 21.694 1.00 18.66 C ANISOU 1088 CD ARG A 90 2364 2297 2428 -59 889 58 C ATOM 1089 NE ARG A 90 0.168 8.014 21.645 1.00 27.56 N ANISOU 1089 NE ARG A 90 3472 3410 3591 -59 1065 0 N ATOM 1090 CZ ARG A 90 0.848 9.027 21.131 1.00 38.23 C ANISOU 1090 CZ ARG A 90 4869 4747 4910 -127 1040 -55 C ATOM 1091 NH1 ARG A 90 2.067 8.828 20.640 1.00 33.62 N ANISOU 1091 NH1 ARG A 90 4280 4132 4362 -210 1012 -82 N ATOM 1092 NH2 ARG A 90 0.311 10.238 21.115 1.00 54.54 N ANISOU 1092 NH2 ARG A 90 6908 6854 6961 -61 1069 -46 N ATOM 1093 H ARG A 90 -3.330 6.014 22.726 1.00 10.13 H ATOM 1094 HA ARG A 90 -1.877 3.870 23.336 1.00 9.09 H ATOM 1095 HB2 ARG A 90 -1.257 6.635 23.520 1.00 10.63 H ATOM 1096 HB3 ARG A 90 -0.214 5.505 23.911 1.00 10.63 H ATOM 1097 HG2 ARG A 90 -0.167 4.784 21.695 1.00 15.12 H ATOM 1098 HG3 ARG A 90 -1.205 5.930 21.306 1.00 15.12 H ATOM 1099 HD2 ARG A 90 1.287 6.570 22.433 1.00 22.39 H ATOM 1100 HD3 ARG A 90 1.105 6.447 20.854 1.00 22.39 H ATOM 1101 HE ARG A 90 -0.746 8.177 21.927 1.00 33.08 H ATOM 1102 HH11 ARG A 90 2.410 8.039 20.648 1.00 40.34 H ATOM 1103 HH12 ARG A 90 2.510 9.486 20.308 1.00 40.34 H ATOM 1104 HH21 ARG A 90 -0.476 10.363 21.438 1.00 65.45 H ATOM 1105 HH22 ARG A 90 0.753 10.900 20.790 1.00 65.45 H ATOM 1106 N HIS A 91 -1.695 3.784 25.834 1.00 6.51 N ANISOU 1106 N HIS A 91 981 654 841 45 5 74 N ATOM 1107 CA HIS A 91 -1.736 3.797 27.295 1.00 6.33 C ANISOU 1107 CA HIS A 91 884 695 826 68 -11 -1 C ATOM 1108 C HIS A 91 -1.246 5.157 27.821 1.00 6.19 C ANISOU 1108 C HIS A 91 803 671 880 20 23 -134 C ATOM 1109 O HIS A 91 -0.243 5.688 27.342 1.00 6.80 O ANISOU 1109 O HIS A 91 899 703 982 38 148 -217 O ATOM 1110 CB HIS A 91 -0.898 2.663 27.886 1.00 5.86 C ANISOU 1110 CB HIS A 91 802 612 814 90 -102 -33 C ATOM 1111 CG HIS A 91 -1.189 2.431 29.335 1.00 5.73 C ANISOU 1111 CG HIS A 91 716 688 774 95 -133 -191 C ATOM 1112 ND1 HIS A 91 -0.606 3.168 30.349 1.00 6.22 N ANISOU 1112 ND1 HIS A 91 658 863 842 -61 -63 -45 N ATOM 1113 CD2 HIS A 91 -2.071 1.601 29.934 1.00 6.57 C ANISOU 1113 CD2 HIS A 91 802 821 872 157 -101 -138 C ATOM 1114 CE1 HIS A 91 -1.088 2.768 31.507 1.00 6.44 C ANISOU 1114 CE1 HIS A 91 725 835 888 -7 3 -224 C ATOM 1115 NE2 HIS A 91 -1.989 1.824 31.283 1.00 6.49 N ANISOU 1115 NE2 HIS A 91 717 882 867 96 -58 -170 N ATOM 1116 H HIS A 91 -1.233 3.147 25.487 1.00 7.82 H ATOM 1117 HA HIS A 91 -2.663 3.674 27.589 1.00 7.60 H ATOM 1118 HB2 HIS A 91 -1.091 1.843 27.406 1.00 7.03 H ATOM 1119 HB3 HIS A 91 0.042 2.886 27.800 1.00 7.03 H ATOM 1120 HD2 HIS A 91 -2.627 0.988 29.509 1.00 7.88 H ATOM 1121 HE1 HIS A 91 -0.843 3.097 32.341 1.00 7.73 H ATOM 1122 N PRO A 92 -1.946 5.732 28.810 1.00 6.52 N ANISOU 1122 N PRO A 92 817 628 1034 43 38 -152 N ATOM 1123 CA PRO A 92 -1.598 7.098 29.231 1.00 8.12 C ANISOU 1123 CA PRO A 92 1052 860 1175 2 109 -211 C ATOM 1124 C PRO A 92 -0.252 7.217 29.947 1.00 7.80 C ANISOU 1124 C PRO A 92 1090 644 1231 8 103 -217 C ATOM 1125 O PRO A 92 0.255 8.335 30.074 1.00 9.12 O ANISOU 1125 O PRO A 92 1356 631 1479 -1 72 -107 O ATOM 1126 CB PRO A 92 -2.751 7.487 30.165 1.00 9.94 C ANISOU 1126 CB PRO A 92 1267 1190 1321 119 204 -281 C ATOM 1127 CG PRO A 92 -3.308 6.197 30.645 1.00 8.33 C ANISOU 1127 CG PRO A 92 989 1009 1168 74 244 -348 C ATOM 1128 CD PRO A 92 -3.181 5.266 29.466 1.00 7.74 C ANISOU 1128 CD PRO A 92 916 927 1098 -91 91 -329 C ATOM 1129 HA PRO A 92 -1.600 7.698 28.455 1.00 9.75 H ATOM 1130 HB2 PRO A 92 -2.409 8.010 30.907 1.00 11.93 H ATOM 1131 HB3 PRO A 92 -3.419 7.987 29.671 1.00 11.93 H ATOM 1132 HG2 PRO A 92 -2.787 5.874 31.397 1.00 10.00 H ATOM 1133 HG3 PRO A 92 -4.238 6.314 30.893 1.00 10.00 H ATOM 1134 HD2 PRO A 92 -3.080 4.349 29.767 1.00 9.29 H ATOM 1135 HD3 PRO A 92 -3.940 5.366 28.871 1.00 9.29 H ATOM 1136 N LYS A 93 0.311 6.097 30.392 1.00 7.55 N ANISOU 1136 N LYS A 93 912 878 1081 128 41 -134 N ATOM 1137 CA LYS A 93 1.613 6.101 31.050 1.00 8.39 C ANISOU 1137 CA LYS A 93 1038 962 1189 257 89 -113 C ATOM 1138 C LYS A 93 2.725 5.564 30.142 1.00 7.00 C ANISOU 1138 C LYS A 93 984 646 1030 107 94 13 C ATOM 1139 O LYS A 93 3.833 5.302 30.615 1.00 7.21 O ANISOU 1139 O LYS A 93 902 866 971 134 -79 -18 O ATOM 1140 CB LYS A 93 1.558 5.329 32.381 1.00 10.83 C ANISOU 1140 CB LYS A 93 1284 1404 1429 512 62 -334 C ATOM 1141 CG LYS A 93 0.533 5.897 33.379 1.00 13.83 C ANISOU 1141 CG LYS A 93 1688 1754 1813 599 133 -429 C ATOM 1142 CD LYS A 93 0.578 5.140 34.690 1.00 20.23 C ANISOU 1142 CD LYS A 93 2515 2552 2621 673 133 -411 C ATOM 1143 CE LYS A 93 1.844 5.440 35.468 1.00 30.19 C ANISOU 1143 CE LYS A 93 3806 3851 3813 690 93 -350 C ATOM 1144 NZ LYS A 93 1.880 6.835 35.988 0.00 29.74 N ANISOU 1144 NZ LYS A 93 3739 3751 3809 659 100 -345 N ATOM 1145 H LYS A 93 -0.044 5.317 30.325 1.00 9.06 H ATOM 1146 HA LYS A 93 1.842 7.030 31.265 1.00 10.07 H ATOM 1147 HB2 LYS A 93 1.317 4.407 32.199 1.00 13.00 H ATOM 1148 HB3 LYS A 93 2.432 5.365 32.800 1.00 13.00 H ATOM 1149 HG2 LYS A 93 0.738 6.829 33.556 1.00 16.60 H ATOM 1150 HG3 LYS A 93 -0.359 5.813 33.007 1.00 16.60 H ATOM 1151 HD2 LYS A 93 -0.181 5.399 35.235 1.00 24.28 H ATOM 1152 HD3 LYS A 93 0.552 4.187 34.510 1.00 24.28 H ATOM 1153 HE2 LYS A 93 1.902 4.836 36.225 1.00 36.22 H ATOM 1154 HE3 LYS A 93 2.610 5.317 34.885 1.00 36.22 H ATOM 1155 HZ1 LYS A 93 2.695 6.984 36.472 0.00 35.68 H ATOM 1156 HZ2 LYS A 93 1.832 7.458 35.259 0.00 35.68 H ATOM 1157 HZ3 LYS A 93 1.135 6.984 36.576 0.00 35.68 H ATOM 1158 N TYR A 94 2.448 5.416 28.844 1.00 6.41 N ANISOU 1158 N TYR A 94 903 551 981 2 189 55 N ATOM 1159 CA TYR A 94 3.507 5.069 27.887 1.00 6.76 C ANISOU 1159 CA TYR A 94 943 663 961 -92 128 -44 C ATOM 1160 C TYR A 94 4.634 6.095 27.963 1.00 7.69 C ANISOU 1160 C TYR A 94 998 856 1067 -16 140 47 C ATOM 1161 O TYR A 94 4.386 7.302 27.947 1.00 7.93 O ANISOU 1161 O TYR A 94 1043 829 1139 -52 106 84 O ATOM 1162 CB TYR A 94 2.974 4.980 26.459 1.00 5.91 C ANISOU 1162 CB TYR A 94 809 590 847 -276 86 -22 C ATOM 1163 CG TYR A 94 4.069 4.784 25.423 1.00 6.78 C ANISOU 1163 CG TYR A 94 911 811 855 -300 157 -175 C ATOM 1164 CD1 TYR A 94 4.925 3.694 25.489 1.00 7.14 C ANISOU 1164 CD1 TYR A 94 868 905 940 -463 183 -181 C ATOM 1165 CD2 TYR A 94 4.238 5.675 24.377 1.00 8.04 C ANISOU 1165 CD2 TYR A 94 1082 896 1076 -293 281 -162 C ATOM 1166 CE1 TYR A 94 5.931 3.510 24.566 1.00 9.04 C ANISOU 1166 CE1 TYR A 94 1101 1142 1191 -443 293 -359 C ATOM 1167 CE2 TYR A 94 5.241 5.487 23.428 1.00 9.12 C ANISOU 1167 CE2 TYR A 94 1220 1087 1159 -441 426 -150 C ATOM 1168 CZ TYR A 94 6.079 4.399 23.525 1.00 9.79 C ANISOU 1168 CZ TYR A 94 1180 1279 1259 -414 455 -300 C ATOM 1169 OH TYR A 94 7.098 4.196 22.597 1.00 12.51 O ANISOU 1169 OH TYR A 94 1651 1596 1508 -531 660 -516 O ATOM 1170 H TYR A 94 1.668 5.509 28.494 1.00 7.69 H ATOM 1171 HA TYR A 94 3.878 4.194 28.126 1.00 8.11 H ATOM 1172 HB2 TYR A 94 2.365 4.227 26.397 1.00 7.09 H ATOM 1173 HB3 TYR A 94 2.505 5.802 26.247 1.00 7.09 H ATOM 1174 HD1 TYR A 94 4.833 3.087 26.188 1.00 8.57 H ATOM 1175 HD2 TYR A 94 3.672 6.409 24.305 1.00 9.64 H ATOM 1176 HE1 TYR A 94 6.493 2.772 24.632 1.00 10.85 H ATOM 1177 HE2 TYR A 94 5.345 6.096 22.732 1.00 10.94 H ATOM 1178 HH TYR A 94 7.606 4.840 22.593 1.00 15.01 H ATOM 1179 N ASN A 95 5.865 5.606 28.093 1.00 7.95 N ANISOU 1179 N ASN A 95 1006 951 1063 35 114 -65 N ATOM 1180 CA ASN A 95 7.049 6.458 28.101 1.00 8.19 C ANISOU 1180 CA ASN A 95 939 1107 1065 -24 -47 -132 C ATOM 1181 C ASN A 95 7.943 6.068 26.930 1.00 7.38 C ANISOU 1181 C ASN A 95 811 963 1028 66 -13 -10 C ATOM 1182 O ASN A 95 8.435 4.941 26.867 1.00 6.20 O ANISOU 1182 O ASN A 95 637 850 866 80 105 13 O ATOM 1183 CB ASN A 95 7.775 6.293 29.451 1.00 8.84 C ANISOU 1183 CB ASN A 95 1120 1191 1050 -36 -131 -79 C ATOM 1184 CG ASN A 95 8.909 7.279 29.645 1.00 9.60 C ANISOU 1184 CG ASN A 95 1371 1253 1022 -29 -165 -341 C ATOM 1185 OD1 ASN A 95 8.929 8.070 30.606 1.00 13.25 O ANISOU 1185 OD1 ASN A 95 1908 1793 1331 -215 -160 -398 O ATOM 1186 ND2 ASN A 95 9.863 7.231 28.759 1.00 6.51 N ANISOU 1186 ND2 ASN A 95 823 806 844 -234 -263 -434 N ATOM 1187 H ASN A 95 6.043 4.769 28.180 1.00 9.53 H ATOM 1188 HA ASN A 95 6.784 7.395 27.997 1.00 9.82 H ATOM 1189 HB2 ASN A 95 7.137 6.427 30.169 1.00 10.61 H ATOM 1190 HB3 ASN A 95 8.147 5.398 29.501 1.00 10.61 H ATOM 1191 HD21 ASN A 95 10.626 7.843 28.827 1.00 7.81 H ATOM 1192 HD22 ASN A 95 9.818 6.584 28.025 1.00 7.81 H ATOM 1193 N ARG A 96 8.128 6.990 25.991 1.00 9.07 N ANISOU 1193 N ARG A 96 1057 1187 1203 248 77 124 N ATOM 1194 CA ARG A 96 8.823 6.691 24.734 1.00 11.96 C ANISOU 1194 CA ARG A 96 1430 1508 1607 218 86 240 C ATOM 1195 C ARG A 96 10.351 6.560 24.895 1.00 10.38 C ANISOU 1195 C ARG A 96 1260 1187 1496 83 185 283 C ATOM 1196 O ARG A 96 11.035 6.152 23.962 1.00 10.44 O ANISOU 1196 O ARG A 96 1318 1156 1493 -87 337 297 O ATOM 1197 CB ARG A 96 8.493 7.759 23.687 1.00 16.12 C ANISOU 1197 CB ARG A 96 1989 2044 2094 147 12 249 C ATOM 1198 CG ARG A 96 9.080 9.125 23.999 1.00 22.86 C ANISOU 1198 CG ARG A 96 2885 2879 2920 166 -145 237 C ATOM 1199 CD ARG A 96 9.059 10.078 22.801 1.00 28.92 C ANISOU 1199 CD ARG A 96 3642 3627 3718 90 -234 209 C ATOM 1200 NE ARG A 96 7.734 10.647 22.556 1.00 40.45 N ANISOU 1200 NE ARG A 96 5121 5070 5177 46 -170 178 N ATOM 1201 CZ ARG A 96 6.918 10.279 21.568 1.00 49.87 C ANISOU 1201 CZ ARG A 96 6312 6282 6355 -9 -185 155 C ATOM 1202 NH1 ARG A 96 7.281 9.337 20.708 1.00 54.33 N ANISOU 1202 NH1 ARG A 96 6870 6825 6950 -71 -170 112 N ATOM 1203 NH2 ARG A 96 5.732 10.857 21.435 1.00 56.30 N ANISOU 1203 NH2 ARG A 96 7109 7082 7202 -2 -187 148 N ATOM 1204 H ARG A 96 7.860 7.805 26.054 1.00 10.89 H ATOM 1205 HA ARG A 96 8.491 5.834 24.394 1.00 14.35 H ATOM 1206 HB2 ARG A 96 8.844 7.475 22.828 1.00 19.35 H ATOM 1207 HB3 ARG A 96 7.529 7.856 23.632 1.00 19.35 H ATOM 1208 HG2 ARG A 96 8.566 9.533 24.714 1.00 27.43 H ATOM 1209 HG3 ARG A 96 10.003 9.015 24.277 1.00 27.43 H ATOM 1210 HD2 ARG A 96 9.674 10.809 22.967 1.00 34.70 H ATOM 1211 HD3 ARG A 96 9.328 9.592 22.006 1.00 34.70 H ATOM 1212 HE ARG A 96 7.426 11.344 23.156 1.00 48.54 H ATOM 1213 HH11 ARG A 96 8.048 8.955 20.786 1.00 65.20 H ATOM 1214 HH12 ARG A 96 6.748 9.106 20.073 1.00 65.20 H ATOM 1215 HH21 ARG A 96 5.488 11.470 21.987 1.00 67.57 H ATOM 1216 HH22 ARG A 96 5.207 10.621 20.796 1.00 67.57 H ATOM 1217 N ASP A 97 10.878 6.893 26.071 1.00 10.27 N ANISOU 1217 N ASP A 97 1232 1208 1462 -38 184 144 N ATOM 1218 CA AASP A 97 12.303 6.730 26.316 0.57 13.30 C ANISOU 1218 CA AASP A 97 1696 1626 1733 -256 194 237 C ATOM 1219 CA BASP A 97 12.307 6.777 26.371 0.43 10.37 C ANISOU 1219 CA BASP A 97 1282 1223 1434 -284 180 174 C ATOM 1220 C ASP A 97 12.665 5.487 27.126 1.00 10.66 C ANISOU 1220 C ASP A 97 1342 1258 1450 -307 172 136 C ATOM 1221 O ASP A 97 13.637 4.809 26.787 1.00 11.15 O ANISOU 1221 O ASP A 97 1309 1503 1423 -337 250 189 O ATOM 1222 CB AASP A 97 12.870 8.002 26.944 0.57 18.64 C ANISOU 1222 CB AASP A 97 2406 2313 2362 -395 197 342 C ATOM 1223 CB BASP A 97 12.783 7.993 27.181 0.43 10.13 C ANISOU 1223 CB BASP A 97 1180 1214 1457 -496 199 153 C ATOM 1224 CG AASP A 97 13.010 9.121 25.931 0.57 19.89 C ANISOU 1224 CG AASP A 97 2690 2412 2458 -517 204 444 C ATOM 1225 CG BASP A 97 14.282 8.235 27.050 0.43 10.90 C ANISOU 1225 CG BASP A 97 1180 1396 1567 -691 297 182 C ATOM 1226 OD1AASP A 97 13.499 8.852 24.811 0.57 20.92 O ANISOU 1226 OD1AASP A 97 2927 2502 2522 -730 204 574 O ATOM 1227 OD1BASP A 97 14.849 7.893 25.995 0.43 11.21 O ANISOU 1227 OD1BASP A 97 1163 1405 1691 -897 278 19 O ATOM 1228 OD2AASP A 97 12.626 10.255 26.249 0.57 20.63 O ANISOU 1228 OD2AASP A 97 2797 2539 2501 -331 167 440 O ATOM 1229 OD2BASP A 97 14.890 8.798 27.979 0.43 11.54 O ANISOU 1229 OD2BASP A 97 1142 1682 1561 -605 303 358 O ATOM 1230 H AASP A 97 10.435 7.212 26.735 1.00 12.32 H ATOM 1231 HA AASP A 97 12.741 6.630 25.446 0.57 15.96 H ATOM 1232 HB2AASP A 97 12.273 8.304 27.647 0.57 22.37 H ATOM 1233 HB3AASP A 97 13.748 7.813 27.310 0.57 22.37 H ATOM 1234 N THR A 98 11.896 5.165 28.171 1.00 8.78 N ANISOU 1234 N THR A 98 1136 984 1218 -329 120 6 N ATOM 1235 CA THR A 98 12.104 3.908 28.911 1.00 7.91 C ANISOU 1235 CA THR A 98 962 991 1054 -325 83 13 C ATOM 1236 C THR A 98 11.359 2.719 28.285 1.00 7.79 C ANISOU 1236 C THR A 98 1004 835 1122 -69 184 165 C ATOM 1237 O THR A 98 11.669 1.552 28.582 1.00 8.10 O ANISOU 1237 O THR A 98 1012 785 1278 -30 115 153 O ATOM 1238 CB THR A 98 11.644 4.016 30.383 1.00 8.93 C ANISOU 1238 CB THR A 98 1112 1120 1161 -447 1 -233 C ATOM 1239 OG1 THR A 98 10.230 4.237 30.412 1.00 7.97 O ANISOU 1239 OG1 THR A 98 962 1086 979 -391 71 -318 O ATOM 1240 CG2 THR A 98 12.376 5.143 31.111 1.00 10.97 C ANISOU 1240 CG2 THR A 98 1370 1361 1436 -711 -59 -200 C ATOM 1241 H THR A 98 11.252 5.650 28.471 1.00 10.54 H ATOM 1242 HA THR A 98 13.061 3.696 28.911 1.00 9.50 H ATOM 1243 HB THR A 98 11.844 3.183 30.839 1.00 10.71 H ATOM 1244 HG1 THR A 98 9.971 4.297 31.188 1.00 9.56 H ATOM 1245 HG21 THR A 98 12.076 5.193 32.022 1.00 13.16 H ATOM 1246 HG22 THR A 98 13.322 4.979 31.103 1.00 13.16 H ATOM 1247 HG23 THR A 98 12.200 5.981 30.678 1.00 13.16 H ATOM 1248 N LEU A 99 10.369 3.032 27.446 1.00 7.79 N ANISOU 1248 N LEU A 99 1041 892 1026 -200 220 88 N ATOM 1249 CA LEU A 99 9.480 2.065 26.797 1.00 7.27 C ANISOU 1249 CA LEU A 99 946 848 969 -93 122 131 C ATOM 1250 C LEU A 99 8.491 1.397 27.762 1.00 5.90 C ANISOU 1250 C LEU A 99 747 752 744 -8 109 -51 C ATOM 1251 O LEU A 99 7.841 0.401 27.413 1.00 5.35 O ANISOU 1251 O LEU A 99 644 698 691 6 188 -77 O ATOM 1252 CB LEU A 99 10.281 1.032 25.982 1.00 8.56 C ANISOU 1252 CB LEU A 99 1077 1033 1142 9 202 259 C ATOM 1253 CG LEU A 99 11.396 1.608 25.108 1.00 11.44 C ANISOU 1253 CG LEU A 99 1484 1418 1446 372 496 330 C ATOM 1254 CD1 LEU A 99 12.064 0.499 24.317 1.00 10.94 C ANISOU 1254 CD1 LEU A 99 1396 1335 1427 244 606 398 C ATOM 1255 CD2 LEU A 99 10.842 2.691 24.181 1.00 14.11 C ANISOU 1255 CD2 LEU A 99 1855 1717 1789 606 601 277 C ATOM 1256 H LEU A 99 10.186 3.843 27.227 1.00 9.35 H ATOM 1257 HA LEU A 99 8.936 2.561 26.150 1.00 8.73 H ATOM 1258 HB2 LEU A 99 10.689 0.405 26.599 1.00 10.27 H ATOM 1259 HB3 LEU A 99 9.668 0.560 25.398 1.00 10.27 H ATOM 1260 HG LEU A 99 12.066 2.015 25.679 1.00 13.73 H ATOM 1261 HD11 LEU A 99 12.760 0.878 23.775 1.00 13.13 H ATOM 1262 HD12 LEU A 99 12.436 -0.141 24.929 1.00 13.13 H ATOM 1263 HD13 LEU A 99 11.408 0.075 23.759 1.00 13.13 H ATOM 1264 HD21 LEU A 99 11.557 3.037 23.643 1.00 16.93 H ATOM 1265 HD22 LEU A 99 10.166 2.304 23.619 1.00 16.93 H ATOM 1266 HD23 LEU A 99 10.462 3.393 24.714 1.00 16.93 H ATOM 1267 N ASP A 100 8.338 1.970 28.961 1.00 5.77 N ANISOU 1267 N ASP A 100 805 690 695 -200 65 105 N ATOM 1268 CA ASP A 100 7.366 1.496 29.954 1.00 5.35 C ANISOU 1268 CA ASP A 100 662 662 709 -42 77 57 C ATOM 1269 C ASP A 100 5.930 1.598 29.396 1.00 5.00 C ANISOU 1269 C ASP A 100 675 648 579 -32 2 77 C ATOM 1270 O ASP A 100 5.598 2.561 28.714 1.00 5.21 O ANISOU 1270 O ASP A 100 667 733 579 -39 35 210 O ATOM 1271 CB ASP A 100 7.541 2.356 31.232 1.00 6.15 C ANISOU 1271 CB ASP A 100 777 839 720 46 82 -43 C ATOM 1272 CG ASP A 100 7.031 1.692 32.511 1.00 7.64 C ANISOU 1272 CG ASP A 100 1049 1062 791 230 61 -208 C ATOM 1273 OD1 ASP A 100 6.931 2.437 33.519 1.00 10.16 O ANISOU 1273 OD1 ASP A 100 1434 1479 948 170 -43 -269 O ATOM 1274 OD2 ASP A 100 6.733 0.477 32.548 1.00 7.17 O ANISOU 1274 OD2 ASP A 100 961 1016 747 329 117 -230 O ATOM 1275 H ASP A 100 8.795 2.648 29.227 1.00 6.92 H ATOM 1276 HA ASP A 100 7.551 0.560 30.176 1.00 6.42 H ATOM 1277 HB2 ASP A 100 8.485 2.544 31.353 1.00 7.38 H ATOM 1278 HB3 ASP A 100 7.055 3.187 31.117 1.00 7.38 H ATOM 1279 N ASN A 101 5.083 0.612 29.704 1.00 5.16 N ANISOU 1279 N ASN A 101 714 610 635 -40 49 -14 N ATOM 1280 CA ASN A 101 3.662 0.602 29.303 1.00 5.50 C ANISOU 1280 CA ASN A 101 768 631 692 -117 -7 -145 C ATOM 1281 C ASN A 101 3.447 0.734 27.795 1.00 4.82 C ANISOU 1281 C ASN A 101 653 587 592 54 -36 -22 C ATOM 1282 O ASN A 101 2.617 1.545 27.331 1.00 4.86 O ANISOU 1282 O ASN A 101 682 618 548 -43 99 98 O ATOM 1283 CB ASN A 101 2.877 1.713 30.030 1.00 8.07 C ANISOU 1283 CB ASN A 101 1064 992 1009 -151 38 -202 C ATOM 1284 CG ASN A 101 3.057 1.670 31.559 1.00 7.35 C ANISOU 1284 CG ASN A 101 991 910 890 -105 143 -194 C ATOM 1285 OD1 ASN A 101 2.599 0.745 32.238 1.00 8.15 O ANISOU 1285 OD1 ASN A 101 1110 1105 881 -4 178 -143 O ATOM 1286 ND2 ASN A 101 3.747 2.674 32.096 1.00 7.89 N ANISOU 1286 ND2 ASN A 101 1106 850 1040 9 241 -279 N ATOM 1287 H ASN A 101 5.310 -0.082 30.158 1.00 6.19 H ATOM 1288 HA ASN A 101 3.273 -0.255 29.577 1.00 6.60 H ATOM 1289 HB2 ASN A 101 3.188 2.576 29.715 1.00 9.68 H ATOM 1290 HB3 ASN A 101 1.932 1.610 29.836 1.00 9.68 H ATOM 1291 HD21 ASN A 101 3.896 2.704 33.064 1.00 9.46 H ATOM 1292 HD22 ASN A 101 4.106 3.384 31.523 1.00 9.46 H ATOM 1293 N ASP A 102 4.184 -0.074 27.038 1.00 4.88 N ANISOU 1293 N ASP A 102 674 603 576 80 -35 -12 N ATOM 1294 CA ASP A 102 4.108 -0.069 25.584 1.00 4.24 C ANISOU 1294 CA ASP A 102 546 517 549 115 73 48 C ATOM 1295 C ASP A 102 2.912 -0.896 25.087 1.00 4.59 C ANISOU 1295 C ASP A 102 599 551 594 136 111 -75 C ATOM 1296 O ASP A 102 3.056 -2.057 24.684 1.00 4.98 O ANISOU 1296 O ASP A 102 644 583 664 184 90 125 O ATOM 1297 CB ASP A 102 5.428 -0.586 24.983 1.00 4.70 C ANISOU 1297 CB ASP A 102 667 525 594 157 239 41 C ATOM 1298 CG ASP A 102 5.506 -0.378 23.474 1.00 5.39 C ANISOU 1298 CG ASP A 102 848 572 626 15 295 34 C ATOM 1299 OD1 ASP A 102 4.690 0.394 22.918 1.00 4.70 O ANISOU 1299 OD1 ASP A 102 759 440 587 81 148 81 O ATOM 1300 OD2 ASP A 102 6.399 -0.979 22.843 1.00 6.65 O ANISOU 1300 OD2 ASP A 102 1070 893 564 -9 346 -48 O ATOM 1301 H ASP A 102 4.745 -0.645 27.351 1.00 5.85 H ATOM 1302 HA ASP A 102 3.981 0.854 25.278 1.00 5.09 H ATOM 1303 HB2 ASP A 102 6.169 -0.111 25.391 1.00 5.64 H ATOM 1304 HB3 ASP A 102 5.505 -1.537 25.160 1.00 5.64 H ATOM 1305 N ILE A 103 1.728 -0.285 25.122 1.00 4.23 N ANISOU 1305 N ILE A 103 518 504 586 150 -18 -146 N ATOM 1306 CA ILE A 103 0.488 -0.956 24.716 1.00 3.69 C ANISOU 1306 CA ILE A 103 393 460 550 178 -49 -75 C ATOM 1307 C ILE A 103 -0.508 0.111 24.240 1.00 4.92 C ANISOU 1307 C ILE A 103 627 538 704 248 -15 -10 C ATOM 1308 O ILE A 103 -0.466 1.266 24.698 1.00 4.99 O ANISOU 1308 O ILE A 103 683 448 764 260 -11 20 O ATOM 1309 CB ILE A 103 -0.094 -1.836 25.852 1.00 5.01 C ANISOU 1309 CB ILE A 103 645 595 663 -49 -142 -67 C ATOM 1310 CG1 ILE A 103 -1.171 -2.792 25.320 1.00 5.61 C ANISOU 1310 CG1 ILE A 103 635 735 760 -227 -64 88 C ATOM 1311 CG2 ILE A 103 -0.578 -0.990 27.053 1.00 6.30 C ANISOU 1311 CG2 ILE A 103 886 680 829 101 -186 -40 C ATOM 1312 CD1 ILE A 103 -1.520 -3.868 26.307 1.00 7.66 C ANISOU 1312 CD1 ILE A 103 964 953 992 -363 72 71 C ATOM 1313 H ILE A 103 1.613 0.527 25.381 1.00 5.08 H ATOM 1314 HA ILE A 103 0.683 -1.543 23.955 1.00 4.43 H ATOM 1315 HB ILE A 103 0.633 -2.389 26.177 1.00 6.01 H ATOM 1316 HG12 ILE A 103 -1.977 -2.286 25.129 1.00 6.73 H ATOM 1317 HG13 ILE A 103 -0.846 -3.218 24.512 1.00 6.73 H ATOM 1318 HG21 ILE A 103 -0.928 -1.577 27.728 1.00 7.56 H ATOM 1319 HG22 ILE A 103 0.164 -0.493 27.404 1.00 7.56 H ATOM 1320 HG23 ILE A 103 -1.264 -0.388 26.754 1.00 7.56 H ATOM 1321 HD11 ILE A 103 -2.195 -4.435 25.926 1.00 9.19 H ATOM 1322 HD12 ILE A 103 -0.732 -4.382 26.501 1.00 9.19 H ATOM 1323 HD13 ILE A 103 -1.851 -3.460 27.111 1.00 9.19 H ATOM 1324 N MET A 104 -1.372 -0.288 23.306 1.00 6.14 N ANISOU 1324 N MET A 104 764 702 866 198 -5 -60 N ATOM 1325 CA MET A 104 -2.296 0.603 22.611 1.00 7.64 C ANISOU 1325 CA MET A 104 899 983 1019 9 -36 34 C ATOM 1326 C MET A 104 -3.527 -0.205 22.217 1.00 5.52 C ANISOU 1326 C MET A 104 666 660 771 101 58 112 C ATOM 1327 O MET A 104 -3.435 -1.401 21.967 1.00 5.02 O ANISOU 1327 O MET A 104 472 612 822 183 -15 -59 O ATOM 1328 CB MET A 104 -1.581 1.145 21.362 1.00 13.46 C ANISOU 1328 CB MET A 104 1647 1707 1760 -200 -45 295 C ATOM 1329 CG MET A 104 -2.354 2.002 20.426 1.00 15.42 C ANISOU 1329 CG MET A 104 1933 1975 1953 -149 74 242 C ATOM 1330 SD MET A 104 -1.244 2.650 19.158 1.00 10.01 S ANISOU 1330 SD MET A 104 1251 1355 1196 150 197 350 S ATOM 1331 CE MET A 104 -1.086 1.331 17.965 1.00 11.57 C ANISOU 1331 CE MET A 104 1517 1386 1492 50 133 502 C ATOM 1332 H MET A 104 -1.443 -1.106 23.050 1.00 7.36 H ATOM 1333 HA MET A 104 -2.549 1.351 23.190 1.00 9.16 H ATOM 1334 HB2 MET A 104 -0.820 1.667 21.659 1.00 16.15 H ATOM 1335 HB3 MET A 104 -1.261 0.385 20.849 1.00 16.15 H ATOM 1336 HG2 MET A 104 -3.045 1.475 19.995 1.00 18.51 H ATOM 1337 HG3 MET A 104 -2.742 2.747 20.910 1.00 18.51 H ATOM 1338 HE1 MET A 104 -0.503 1.617 17.258 1.00 13.88 H ATOM 1339 HE2 MET A 104 -0.719 0.558 18.401 1.00 13.88 H ATOM 1340 HE3 MET A 104 -1.955 1.126 17.610 1.00 13.88 H ATOM 1341 N LEU A 105 -4.676 0.457 22.159 1.00 5.31 N ANISOU 1341 N LEU A 105 649 667 700 125 3 108 N ATOM 1342 CA LEU A 105 -5.895 -0.132 21.634 1.00 5.97 C ANISOU 1342 CA LEU A 105 663 821 785 179 35 -23 C ATOM 1343 C LEU A 105 -6.337 0.610 20.372 1.00 5.79 C ANISOU 1343 C LEU A 105 758 643 800 206 3 24 C ATOM 1344 O LEU A 105 -6.252 1.847 20.286 1.00 6.42 O ANISOU 1344 O LEU A 105 897 793 749 289 20 68 O ATOM 1345 CB LEU A 105 -7.024 -0.054 22.674 1.00 7.74 C ANISOU 1345 CB LEU A 105 880 1067 994 152 71 -46 C ATOM 1346 CG LEU A 105 -6.977 -1.058 23.810 1.00 8.53 C ANISOU 1346 CG LEU A 105 1025 1055 1160 337 23 39 C ATOM 1347 CD1 LEU A 105 -7.895 -0.622 24.939 1.00 11.76 C ANISOU 1347 CD1 LEU A 105 1541 1395 1532 443 64 114 C ATOM 1348 CD2 LEU A 105 -7.388 -2.430 23.313 1.00 9.54 C ANISOU 1348 CD2 LEU A 105 1216 1143 1267 327 126 56 C ATOM 1349 H LEU A 105 -4.774 1.270 22.424 1.00 6.37 H ATOM 1350 HA LEU A 105 -5.739 -1.073 21.409 1.00 7.16 H ATOM 1351 HB2 LEU A 105 -7.007 0.830 23.073 1.00 9.29 H ATOM 1352 HB3 LEU A 105 -7.868 -0.181 22.214 1.00 9.29 H ATOM 1353 HG LEU A 105 -6.072 -1.115 24.154 1.00 10.23 H ATOM 1354 HD11 LEU A 105 -7.850 -1.271 25.645 1.00 14.11 H ATOM 1355 HD12 LEU A 105 -7.607 0.235 25.262 1.00 14.11 H ATOM 1356 HD13 LEU A 105 -8.793 -0.562 24.606 1.00 14.11 H ATOM 1357 HD21 LEU A 105 -7.353 -3.051 24.045 1.00 11.45 H ATOM 1358 HD22 LEU A 105 -8.283 -2.382 22.968 1.00 11.45 H ATOM 1359 HD23 LEU A 105 -6.784 -2.706 22.621 1.00 11.45 H ATOM 1360 N ILE A 106 -6.833 -0.155 19.410 1.00 6.22 N ANISOU 1360 N ILE A 106 818 662 883 197 37 25 N ATOM 1361 CA ILE A 106 -7.419 0.364 18.197 1.00 7.04 C ANISOU 1361 CA ILE A 106 919 749 1005 195 -90 -56 C ATOM 1362 C ILE A 106 -8.880 -0.063 18.112 1.00 6.58 C ANISOU 1362 C ILE A 106 804 820 875 82 -3 -35 C ATOM 1363 O ILE A 106 -9.189 -1.255 18.188 1.00 7.03 O ANISOU 1363 O ILE A 106 797 1063 812 75 9 -36 O ATOM 1364 CB ILE A 106 -6.688 -0.178 16.965 1.00 8.07 C ANISOU 1364 CB ILE A 106 1071 880 1114 214 -136 -96 C ATOM 1365 CG1 ILE A 106 -5.231 0.287 16.968 1.00 10.69 C ANISOU 1365 CG1 ILE A 106 1343 1309 1408 306 -90 -109 C ATOM 1366 CG2 ILE A 106 -7.404 0.274 15.682 1.00 9.64 C ANISOU 1366 CG2 ILE A 106 1251 1168 1243 308 -102 -46 C ATOM 1367 CD1 ILE A 106 -4.349 -0.429 15.948 1.00 12.75 C ANISOU 1367 CD1 ILE A 106 1614 1596 1635 148 -21 6 C ATOM 1368 H ILE A 106 -6.838 -1.015 19.446 1.00 7.46 H ATOM 1369 HA ILE A 106 -7.371 1.343 18.193 1.00 8.44 H ATOM 1370 HB ILE A 106 -6.702 -1.147 17.000 1.00 9.68 H ATOM 1371 HG12 ILE A 106 -5.205 1.235 16.768 1.00 12.82 H ATOM 1372 HG13 ILE A 106 -4.855 0.127 17.848 1.00 12.82 H ATOM 1373 HG21 ILE A 106 -6.932 -0.075 14.922 1.00 11.57 H ATOM 1374 HG22 ILE A 106 -8.303 -0.062 15.692 1.00 11.57 H ATOM 1375 HG23 ILE A 106 -7.413 1.233 15.651 1.00 11.57 H ATOM 1376 HD11 ILE A 106 -3.455 -0.084 16.012 1.00 15.30 H ATOM 1377 HD12 ILE A 106 -4.352 -1.370 16.138 1.00 15.30 H ATOM 1378 HD13 ILE A 106 -4.699 -0.271 15.068 1.00 15.30 H ATOM 1379 N LYS A 107 -9.776 0.906 17.972 1.00 7.27 N ANISOU 1379 N LYS A 107 890 874 998 139 -70 -33 N ATOM 1380 CA LYS A 107 -11.179 0.624 17.692 1.00 8.92 C ANISOU 1380 CA LYS A 107 1083 1124 1181 266 -255 -138 C ATOM 1381 C LYS A 107 -11.433 0.650 16.181 1.00 8.32 C ANISOU 1381 C LYS A 107 943 1134 1085 322 -156 76 C ATOM 1382 O LYS A 107 -11.104 1.627 15.496 1.00 9.05 O ANISOU 1382 O LYS A 107 1079 1217 1142 527 -62 27 O ATOM 1383 CB LYS A 107 -12.099 1.637 18.384 1.00 12.17 C ANISOU 1383 CB LYS A 107 1470 1597 1555 432 -503 -263 C ATOM 1384 CG LYS A 107 -13.580 1.247 18.256 1.00 14.95 C ANISOU 1384 CG LYS A 107 1816 1985 1880 642 -787 -466 C ATOM 1385 CD LYS A 107 -14.510 2.328 18.806 1.00 16.40 C ANISOU 1385 CD LYS A 107 2056 2109 2065 775 -968 -500 C ATOM 1386 CE LYS A 107 -15.953 1.878 18.671 1.00 18.36 C ANISOU 1386 CE LYS A 107 2287 2361 2329 901 -1152 -659 C ATOM 1387 NZ LYS A 107 -16.921 2.951 19.054 1.00 23.30 N ANISOU 1387 NZ LYS A 107 2900 3010 2943 912 -1214 -723 N ATOM 1388 H LYS A 107 -9.596 1.744 18.035 1.00 8.72 H ATOM 1389 HA LYS A 107 -11.402 -0.270 18.025 1.00 10.70 H ATOM 1390 HB2 LYS A 107 -11.877 1.677 19.328 1.00 14.60 H ATOM 1391 HB3 LYS A 107 -11.979 2.508 17.975 1.00 14.60 H ATOM 1392 HG2 LYS A 107 -13.793 1.112 17.319 1.00 17.94 H ATOM 1393 HG3 LYS A 107 -13.738 0.430 18.755 1.00 17.94 H ATOM 1394 HD2 LYS A 107 -14.318 2.476 19.745 1.00 19.68 H ATOM 1395 HD3 LYS A 107 -14.393 3.147 18.300 1.00 19.68 H ATOM 1396 HE2 LYS A 107 -16.124 1.633 17.748 1.00 22.03 H ATOM 1397 HE3 LYS A 107 -16.103 1.115 19.251 1.00 22.03 H ATOM 1398 HZ1 LYS A 107 -17.821 2.631 18.956 1.00 27.96 H ATOM 1399 HZ2 LYS A 107 -16.779 3.210 19.968 1.00 27.96 H ATOM 1400 HZ3 LYS A 107 -16.800 3.719 18.490 1.00 27.96 H ATOM 1401 N LEU A 108 -11.967 -0.447 15.664 1.00 7.85 N ANISOU 1401 N LEU A 108 980 981 1022 353 45 217 N ATOM 1402 CA LEU A 108 -12.337 -0.557 14.250 1.00 9.05 C ANISOU 1402 CA LEU A 108 1168 1130 1141 535 179 394 C ATOM 1403 C LEU A 108 -13.575 0.300 13.896 1.00 10.45 C ANISOU 1403 C LEU A 108 1346 1394 1230 513 134 255 C ATOM 1404 O LEU A 108 -14.504 0.446 14.695 1.00 10.41 O ANISOU 1404 O LEU A 108 1480 1315 1160 531 202 109 O ATOM 1405 CB LEU A 108 -12.603 -2.026 13.909 1.00 12.04 C ANISOU 1405 CB LEU A 108 1558 1528 1488 660 513 462 C ATOM 1406 CG LEU A 108 -11.470 -3.003 14.248 1.00 12.74 C ANISOU 1406 CG LEU A 108 1615 1552 1674 906 648 559 C ATOM 1407 CD1 LEU A 108 -11.852 -4.457 13.896 1.00 14.07 C ANISOU 1407 CD1 LEU A 108 1786 1775 1785 787 596 513 C ATOM 1408 CD2 LEU A 108 -10.187 -2.591 13.538 1.00 15.71 C ANISOU 1408 CD2 LEU A 108 1962 1952 2055 1268 775 584 C ATOM 1409 H LEU A 108 -12.130 -1.159 16.117 1.00 9.42 H ATOM 1410 HA LEU A 108 -11.588 -0.248 13.699 1.00 10.86 H ATOM 1411 HB2 LEU A 108 -13.391 -2.315 14.395 1.00 14.44 H ATOM 1412 HB3 LEU A 108 -12.769 -2.094 12.955 1.00 14.44 H ATOM 1413 HG LEU A 108 -11.303 -2.965 15.203 1.00 15.29 H ATOM 1414 HD11 LEU A 108 -11.120 -5.035 14.123 1.00 16.88 H ATOM 1415 HD12 LEU A 108 -12.633 -4.705 14.397 1.00 16.88 H ATOM 1416 HD13 LEU A 108 -12.035 -4.513 12.956 1.00 16.88 H ATOM 1417 HD21 LEU A 108 -9.492 -3.214 13.763 1.00 18.85 H ATOM 1418 HD22 LEU A 108 -10.339 -2.598 12.590 1.00 18.85 H ATOM 1419 HD23 LEU A 108 -9.941 -1.708 13.824 1.00 18.85 H ATOM 1420 N SER A 109 -13.574 0.857 12.682 1.00 11.53 N ANISOU 1420 N SER A 109 1442 1478 1461 489 49 388 N ATOM 1421 CA ASER A 109 -14.678 1.716 12.250 0.54 13.23 C ANISOU 1421 CA ASER A 109 1615 1699 1714 413 -38 411 C ATOM 1422 CA BSER A 109 -14.668 1.698 12.192 0.46 11.75 C ANISOU 1422 CA BSER A 109 1337 1595 1532 506 28 494 C ATOM 1423 C SER A 109 -15.985 0.924 12.103 1.00 13.15 C ANISOU 1423 C SER A 109 1506 1753 1739 473 -18 482 C ATOM 1424 O SER A 109 -17.072 1.486 12.268 1.00 14.36 O ANISOU 1424 O SER A 109 1548 1908 2002 563 -24 469 O ATOM 1425 CB ASER A 109 -14.336 2.455 10.954 0.54 16.78 C ANISOU 1425 CB ASER A 109 2101 2107 2168 170 -55 379 C ATOM 1426 CB BSER A 109 -14.312 2.291 10.825 0.46 11.65 C ANISOU 1426 CB BSER A 109 1230 1639 1559 392 132 602 C ATOM 1427 OG ASER A 109 -14.057 1.556 9.909 0.54 15.76 O ANISOU 1427 OG ASER A 109 1979 1951 2058 67 -95 374 O ATOM 1428 OG BSER A 109 -13.312 3.288 10.953 0.46 12.25 O ANISOU 1428 OG BSER A 109 1282 1789 1583 443 129 696 O ATOM 1429 H ASER A 109 -12.953 0.755 12.097 1.00 13.84 H ATOM 1430 HA ASER A 109 -14.826 2.395 12.941 0.54 15.88 H ATOM 1431 HB2ASER A 109 -15.092 3.007 10.699 0.54 20.14 H ATOM 1432 HB3ASER A 109 -13.557 3.012 11.106 0.54 20.14 H ATOM 1433 HG ASER A 109 -14.126 0.784 10.176 0.54 18.91 H ATOM 1434 N SER A 110 -15.876 -0.366 11.817 1.00 13.04 N ANISOU 1434 N SER A 110 1500 1710 1747 412 -110 438 N ATOM 1435 CA SER A 110 -17.014 -1.282 11.824 1.00 15.06 C ANISOU 1435 CA SER A 110 1808 1936 1978 358 -209 458 C ATOM 1436 C SER A 110 -16.541 -2.590 12.447 1.00 14.03 C ANISOU 1436 C SER A 110 1574 1858 1898 191 -181 296 C ATOM 1437 O SER A 110 -15.348 -2.871 12.485 1.00 11.79 O ANISOU 1437 O SER A 110 1187 1642 1651 51 -29 281 O ATOM 1438 CB SER A 110 -17.556 -1.522 10.410 1.00 18.01 C ANISOU 1438 CB SER A 110 2217 2294 2332 386 -356 478 C ATOM 1439 OG SER A 110 -16.572 -2.088 9.565 1.00 20.28 O ANISOU 1439 OG SER A 110 2617 2612 2477 461 -451 381 O ATOM 1440 H SER A 110 -15.133 -0.746 11.609 1.00 15.65 H ATOM 1441 HA SER A 110 -17.733 -0.912 12.377 1.00 18.07 H ATOM 1442 HB2 SER A 110 -18.311 -2.129 10.463 1.00 21.61 H ATOM 1443 HB3 SER A 110 -17.840 -0.674 10.036 1.00 21.61 H ATOM 1444 HG SER A 110 -16.881 -2.208 8.816 1.00 24.34 H ATOM 1445 N PRO A 111 -17.475 -3.395 12.954 1.00 16.04 N ANISOU 1445 N PRO A 111 1840 2072 2183 143 -223 406 N ATOM 1446 CA PRO A 111 -17.098 -4.679 13.541 1.00 15.48 C ANISOU 1446 CA PRO A 111 1788 1980 2116 102 -208 405 C ATOM 1447 C PRO A 111 -16.512 -5.625 12.494 1.00 13.22 C ANISOU 1447 C PRO A 111 1505 1741 1777 -18 -156 355 C ATOM 1448 O PRO A 111 -16.966 -5.678 11.352 1.00 14.75 O ANISOU 1448 O PRO A 111 1640 1996 1969 140 -9 390 O ATOM 1449 CB PRO A 111 -18.429 -5.236 14.075 1.00 20.26 C ANISOU 1449 CB PRO A 111 2517 2529 2652 134 -94 480 C ATOM 1450 CG PRO A 111 -19.352 -4.080 14.127 1.00 23.12 C ANISOU 1450 CG PRO A 111 2853 2941 2990 151 -113 472 C ATOM 1451 CD PRO A 111 -18.920 -3.135 13.059 1.00 20.90 C ANISOU 1451 CD PRO A 111 2547 2674 2720 283 -209 456 C ATOM 1452 HA PRO A 111 -16.464 -4.558 14.279 1.00 18.58 H ATOM 1453 HB2 PRO A 111 -18.765 -5.914 13.468 1.00 24.31 H ATOM 1454 HB3 PRO A 111 -18.295 -5.607 14.961 1.00 24.31 H ATOM 1455 HG2 PRO A 111 -20.259 -4.383 13.964 1.00 27.74 H ATOM 1456 HG3 PRO A 111 -19.289 -3.657 14.998 1.00 27.74 H ATOM 1457 HD2 PRO A 111 -19.364 -3.343 12.222 1.00 25.08 H ATOM 1458 HD3 PRO A 111 -19.081 -2.218 13.330 1.00 25.08 H ATOM 1459 N ALA A 112 -15.499 -6.372 12.894 1.00 11.66 N ANISOU 1459 N ALA A 112 1342 1503 1583 -74 -132 294 N ATOM 1460 CA ALA A 112 -15.017 -7.480 12.093 1.00 13.03 C ANISOU 1460 CA ALA A 112 1569 1627 1753 -76 -181 274 C ATOM 1461 C ALA A 112 -16.074 -8.570 12.028 1.00 12.26 C ANISOU 1461 C ALA A 112 1318 1641 1698 -136 -276 190 C ATOM 1462 O ALA A 112 -16.796 -8.812 12.997 1.00 12.23 O ANISOU 1462 O ALA A 112 1417 1657 1572 -180 17 184 O ATOM 1463 CB ALA A 112 -13.724 -8.032 12.697 1.00 15.20 C ANISOU 1463 CB ALA A 112 1882 1914 1979 -119 -173 132 C ATOM 1464 H ALA A 112 -15.070 -6.256 13.630 1.00 13.99 H ATOM 1465 HA ALA A 112 -14.830 -7.171 11.182 1.00 15.63 H ATOM 1466 HB1 ALA A 112 -13.416 -8.764 12.158 1.00 18.24 H ATOM 1467 HB2 ALA A 112 -13.064 -7.335 12.712 1.00 18.24 H ATOM 1468 HB3 ALA A 112 -13.902 -8.335 13.591 1.00 18.24 H ATOM 1469 N VAL A 113 -16.159 -9.240 10.887 1.00 13.05 N ANISOU 1469 N VAL A 113 1408 1739 1813 -257 -420 76 N ATOM 1470 CA VAL A 113 -16.995 -10.426 10.752 1.00 16.02 C ANISOU 1470 CA VAL A 113 1920 2017 2150 -318 -567 0 C ATOM 1471 C VAL A 113 -16.270 -11.614 11.345 1.00 14.13 C ANISOU 1471 C VAL A 113 1690 1678 1999 -243 -303 80 C ATOM 1472 O VAL A 113 -15.206 -12.001 10.869 1.00 13.86 O ANISOU 1472 O VAL A 113 1664 1571 2031 -10 -21 305 O ATOM 1473 CB VAL A 113 -17.310 -10.707 9.275 1.00 22.44 C ANISOU 1473 CB VAL A 113 2801 2824 2902 -538 -938 -145 C ATOM 1474 CG1 VAL A 113 -18.256 -11.898 9.144 1.00 24.93 C ANISOU 1474 CG1 VAL A 113 3122 3150 3199 -621 -1056 -173 C ATOM 1475 CG2 VAL A 113 -17.899 -9.469 8.642 1.00 30.40 C ANISOU 1475 CG2 VAL A 113 3812 3857 3881 -712 -1088 -215 C ATOM 1476 H VAL A 113 -15.738 -9.026 10.168 1.00 15.66 H ATOM 1477 HA VAL A 113 -17.838 -10.296 11.236 1.00 19.22 H ATOM 1478 HB VAL A 113 -16.479 -10.925 8.805 1.00 26.93 H ATOM 1479 HG11 VAL A 113 -18.437 -12.053 8.214 1.00 29.91 H ATOM 1480 HG12 VAL A 113 -17.838 -12.672 9.530 1.00 29.91 H ATOM 1481 HG13 VAL A 113 -19.073 -11.701 9.609 1.00 29.91 H ATOM 1482 HG21 VAL A 113 -18.093 -9.653 7.720 1.00 36.48 H ATOM 1483 HG22 VAL A 113 -18.705 -9.235 9.107 1.00 36.48 H ATOM 1484 HG23 VAL A 113 -17.263 -8.753 8.707 1.00 36.48 H ATOM 1485 N ILE A 114 -16.823 -12.164 12.414 1.00 13.36 N ANISOU 1485 N ILE A 114 1532 1686 1857 -393 -329 43 N ATOM 1486 CA ILE A 114 -16.224 -13.310 13.084 1.00 13.45 C ANISOU 1486 CA ILE A 114 1504 1737 1869 -440 -278 -91 C ATOM 1487 C ILE A 114 -16.568 -14.602 12.345 1.00 14.35 C ANISOU 1487 C ILE A 114 1416 1924 2114 -493 -298 -225 C ATOM 1488 O ILE A 114 -17.740 -14.904 12.103 1.00 14.83 O ANISOU 1488 O ILE A 114 1158 2117 2359 -296 -332 -369 O ATOM 1489 CB ILE A 114 -16.712 -13.397 14.552 1.00 14.54 C ANISOU 1489 CB ILE A 114 1744 1881 1899 -385 -285 -139 C ATOM 1490 CG1 ILE A 114 -16.361 -12.116 15.317 1.00 17.16 C ANISOU 1490 CG1 ILE A 114 2110 2208 2202 -314 -398 -160 C ATOM 1491 CG2 ILE A 114 -16.140 -14.622 15.225 1.00 15.76 C ANISOU 1491 CG2 ILE A 114 1913 2074 2000 -396 -346 -90 C ATOM 1492 CD1 ILE A 114 -14.875 -11.774 15.337 1.00 17.84 C ANISOU 1492 CD1 ILE A 114 2208 2270 2301 -315 -565 -206 C ATOM 1493 H ILE A 114 -17.553 -11.890 12.776 1.00 16.03 H ATOM 1494 HA ILE A 114 -15.249 -13.208 13.090 1.00 16.14 H ATOM 1495 HB ILE A 114 -17.678 -13.484 14.542 1.00 17.45 H ATOM 1496 HG12 ILE A 114 -16.827 -11.372 14.905 1.00 20.59 H ATOM 1497 HG13 ILE A 114 -16.652 -12.215 16.237 1.00 20.59 H ATOM 1498 HG21 ILE A 114 -16.455 -14.656 16.131 1.00 18.91 H ATOM 1499 HG22 ILE A 114 -16.429 -15.404 14.748 1.00 18.91 H ATOM 1500 HG23 ILE A 114 -15.182 -14.567 15.212 1.00 18.91 H ATOM 1501 HD11 ILE A 114 -14.748 -10.963 15.834 1.00 21.41 H ATOM 1502 HD12 ILE A 114 -14.395 -12.493 15.755 1.00 21.41 H ATOM 1503 HD13 ILE A 114 -14.569 -11.657 14.434 1.00 21.41 H ATOM 1504 N ASN A 115 -15.545 -15.360 11.968 1.00 14.89 N ANISOU 1504 N ASN A 115 1733 1832 2093 -331 -263 -79 N ATOM 1505 CA ASN A 115 -15.721 -16.615 11.244 1.00 16.10 C ANISOU 1505 CA ASN A 115 1940 2002 2177 -320 -127 -96 C ATOM 1506 C ASN A 115 -14.519 -17.547 11.494 1.00 15.39 C ANISOU 1506 C ASN A 115 1756 1922 2169 -231 -36 -232 C ATOM 1507 O ASN A 115 -13.713 -17.299 12.391 1.00 14.55 O ANISOU 1507 O ASN A 115 1648 1817 2062 54 53 -235 O ATOM 1508 CB ASN A 115 -15.930 -16.348 9.743 1.00 17.06 C ANISOU 1508 CB ASN A 115 2102 2123 2258 -164 -81 -42 C ATOM 1509 CG ASN A 115 -14.759 -15.613 9.104 1.00 19.57 C ANISOU 1509 CG ASN A 115 2349 2505 2581 -52 88 67 C ATOM 1510 OD1 ASN A 115 -13.609 -15.940 9.341 1.00 20.38 O ANISOU 1510 OD1 ASN A 115 2367 2645 2733 -12 104 145 O ATOM 1511 ND2 ASN A 115 -15.057 -14.628 8.279 1.00 22.20 N ANISOU 1511 ND2 ASN A 115 2753 2814 2867 -23 293 12 N ATOM 1512 H ASN A 115 -14.722 -15.166 12.124 1.00 17.87 H ATOM 1513 HA ASN A 115 -16.524 -17.065 11.582 1.00 19.32 H ATOM 1514 HB2 ASN A 115 -16.038 -17.195 9.283 1.00 20.47 H ATOM 1515 HB3 ASN A 115 -16.725 -15.804 9.626 1.00 20.47 H ATOM 1516 HD21 ASN A 115 -14.342 -14.122 7.841 1.00 26.64 H ATOM 1517 HD22 ASN A 115 -15.995 -14.403 8.103 1.00 26.64 H ATOM 1518 N ALA A 116 -14.407 -18.625 10.721 1.00 16.73 N ANISOU 1518 N ALA A 116 1993 2066 2298 -420 -87 -287 N ATOM 1519 CA ALA A 116 -13.345 -19.610 10.948 1.00 18.59 C ANISOU 1519 CA ALA A 116 2279 2329 2457 -451 -212 -260 C ATOM 1520 C ALA A 116 -11.954 -18.985 10.843 1.00 17.61 C ANISOU 1520 C ALA A 116 2168 2252 2271 -131 -144 -156 C ATOM 1521 O ALA A 116 -11.021 -19.405 11.532 1.00 19.09 O ANISOU 1521 O ALA A 116 2404 2476 2375 80 -31 147 O ATOM 1522 CB ALA A 116 -13.464 -20.767 9.957 1.00 21.62 C ANISOU 1522 CB ALA A 116 2699 2703 2814 -433 -181 -216 C ATOM 1523 H ALA A 116 -14.928 -18.810 10.062 1.00 20.08 H ATOM 1524 HA ALA A 116 -13.442 -19.977 11.851 1.00 22.31 H ATOM 1525 HB1 ALA A 116 -12.760 -21.396 10.126 1.00 25.95 H ATOM 1526 HB2 ALA A 116 -14.318 -21.191 10.073 1.00 25.95 H ATOM 1527 HB3 ALA A 116 -13.389 -20.422 9.064 1.00 25.95 H ATOM 1528 N ARG A 117 -11.817 -17.979 9.990 1.00 15.29 N ANISOU 1528 N ARG A 117 1919 1884 2007 -169 -208 -307 N ATOM 1529 CA ARG A 117 -10.503 -17.390 9.715 1.00 16.77 C ANISOU 1529 CA ARG A 117 2071 2162 2138 -79 -324 -268 C ATOM 1530 C ARG A 117 -10.241 -16.036 10.376 1.00 13.33 C ANISOU 1530 C ARG A 117 1590 1822 1655 -120 -289 -128 C ATOM 1531 O ARG A 117 -9.137 -15.521 10.297 1.00 12.22 O ANISOU 1531 O ARG A 117 1356 1816 1471 -112 -180 -244 O ATOM 1532 CB ARG A 117 -10.305 -17.278 8.208 1.00 22.38 C ANISOU 1532 CB ARG A 117 2802 2812 2890 -151 -433 -358 C ATOM 1533 CG ARG A 117 -10.273 -18.642 7.550 1.00 32.64 C ANISOU 1533 CG ARG A 117 4095 4116 4191 -252 -473 -480 C ATOM 1534 CD ARG A 117 -10.298 -18.543 6.058 1.00 44.61 C ANISOU 1534 CD ARG A 117 5634 5633 5682 -295 -519 -479 C ATOM 1535 NE ARG A 117 -10.613 -19.830 5.440 1.00 45.01 N ANISOU 1535 NE ARG A 117 5653 5646 5804 -345 -502 -495 N ATOM 1536 CZ ARG A 117 -9.724 -20.783 5.166 1.00 50.79 C ANISOU 1536 CZ ARG A 117 6403 6396 6501 -273 -481 -451 C ATOM 1537 NH1 ARG A 117 -8.437 -20.618 5.451 1.00 45.95 N ANISOU 1537 NH1 ARG A 117 5783 5749 5926 -259 -486 -455 N ATOM 1538 NH2 ARG A 117 -10.130 -21.915 4.598 1.00 63.23 N ANISOU 1538 NH2 ARG A 117 7971 7972 8080 -222 -448 -431 N ATOM 1539 H ARG A 117 -12.464 -17.617 9.555 1.00 18.35 H ATOM 1540 HA ARG A 117 -9.820 -18.007 10.050 1.00 20.12 H ATOM 1541 HB2 ARG A 117 -11.039 -16.773 7.825 1.00 26.86 H ATOM 1542 HB3 ARG A 117 -9.461 -16.834 8.028 1.00 26.86 H ATOM 1543 HG2 ARG A 117 -9.460 -19.103 7.810 1.00 39.17 H ATOM 1544 HG3 ARG A 117 -11.050 -19.151 7.833 1.00 39.17 H ATOM 1545 HD2 ARG A 117 -10.976 -17.903 5.791 1.00 53.53 H ATOM 1546 HD3 ARG A 117 -9.426 -18.259 5.741 1.00 53.53 H ATOM 1547 HE ARG A 117 -11.540 -20.004 5.213 1.00 54.02 H ATOM 1548 HH11 ARG A 117 -8.168 -19.888 5.818 1.00 55.13 H ATOM 1549 HH12 ARG A 117 -7.872 -21.241 5.270 1.00 55.13 H ATOM 1550 HH21 ARG A 117 -10.961 -22.028 4.412 1.00 75.87 H ATOM 1551 HH22 ARG A 117 -9.561 -22.534 4.420 1.00 75.87 H ATOM 1552 N VAL A 118 -11.238 -15.485 11.065 1.00 11.71 N ANISOU 1552 N VAL A 118 1343 1559 1546 -27 -288 4 N ATOM 1553 CA VAL A 118 -11.083 -14.221 11.790 1.00 11.06 C ANISOU 1553 CA VAL A 118 1254 1501 1449 -414 -67 15 C ATOM 1554 C VAL A 118 -11.854 -14.343 13.097 1.00 9.38 C ANISOU 1554 C VAL A 118 1054 1273 1238 -300 97 -26 C ATOM 1555 O VAL A 118 -13.073 -14.464 13.082 1.00 9.49 O ANISOU 1555 O VAL A 118 1002 1471 1133 -425 66 -57 O ATOM 1556 CB VAL A 118 -11.632 -13.003 11.000 1.00 13.48 C ANISOU 1556 CB VAL A 118 1641 1771 1709 -558 -2 84 C ATOM 1557 CG1 VAL A 118 -11.511 -11.699 11.808 1.00 14.82 C ANISOU 1557 CG1 VAL A 118 1850 1838 1944 -960 -44 -23 C ATOM 1558 CG2 VAL A 118 -10.906 -12.827 9.644 1.00 14.55 C ANISOU 1558 CG2 VAL A 118 1781 1901 1845 -605 -56 204 C ATOM 1559 H VAL A 118 -12.024 -15.828 11.130 1.00 14.05 H ATOM 1560 HA VAL A 118 -10.137 -14.067 11.993 1.00 13.28 H ATOM 1561 HB VAL A 118 -12.583 -13.151 10.813 1.00 16.17 H ATOM 1562 HG11 VAL A 118 -11.860 -10.974 11.285 1.00 17.79 H ATOM 1563 HG12 VAL A 118 -12.013 -11.788 12.622 1.00 17.79 H ATOM 1564 HG13 VAL A 118 -10.585 -11.541 12.010 1.00 17.79 H ATOM 1565 HG21 VAL A 118 -11.273 -12.066 9.189 1.00 17.46 H ATOM 1566 HG22 VAL A 118 -9.969 -12.691 9.807 1.00 17.46 H ATOM 1567 HG23 VAL A 118 -11.035 -13.619 9.116 1.00 17.46 H ATOM 1568 N SER A 119 -11.141 -14.335 14.217 1.00 8.69 N ANISOU 1568 N SER A 119 955 1121 1226 -332 25 17 N ATOM 1569 CA SER A 119 -11.776 -14.491 15.515 1.00 10.10 C ANISOU 1569 CA SER A 119 1201 1274 1361 -289 -100 20 C ATOM 1570 C SER A 119 -10.863 -13.979 16.612 1.00 8.66 C ANISOU 1570 C SER A 119 919 1228 1141 -169 -94 104 C ATOM 1571 O SER A 119 -9.721 -13.616 16.359 1.00 7.75 O ANISOU 1571 O SER A 119 739 1252 953 -88 -139 -67 O ATOM 1572 CB SER A 119 -12.213 -15.951 15.758 1.00 14.28 C ANISOU 1572 CB SER A 119 1792 1755 1878 -289 -190 -69 C ATOM 1573 OG SER A 119 -11.106 -16.821 15.782 1.00 17.33 O ANISOU 1573 OG SER A 119 2261 2077 2246 -411 -49 -37 O ATOM 1574 H SER A 119 -10.287 -14.241 14.251 1.00 10.43 H ATOM 1575 HA SER A 119 -12.586 -13.939 15.529 1.00 12.11 H ATOM 1576 HB2 SER A 119 -12.673 -16.004 16.611 1.00 17.13 H ATOM 1577 HB3 SER A 119 -12.811 -16.223 15.044 1.00 17.13 H ATOM 1578 HG SER A 119 -11.358 -17.591 15.912 1.00 20.79 H ATOM 1579 N THR A 120 -11.388 -13.927 17.828 1.00 9.27 N ANISOU 1579 N THR A 120 1127 1220 1176 -149 -7 335 N ATOM 1580 CA THR A 120 -10.713 -13.254 18.921 1.00 8.10 C ANISOU 1580 CA THR A 120 999 950 1127 -205 0 171 C ATOM 1581 C THR A 120 -9.797 -14.167 19.727 1.00 7.60 C ANISOU 1581 C THR A 120 917 938 1032 -244 -31 119 C ATOM 1582 O THR A 120 -9.975 -15.405 19.742 1.00 8.98 O ANISOU 1582 O THR A 120 949 1278 1184 -31 -253 -21 O ATOM 1583 CB THR A 120 -11.739 -12.624 19.895 1.00 11.31 C ANISOU 1583 CB THR A 120 1383 1438 1478 -3 139 159 C ATOM 1584 OG1 THR A 120 -12.599 -13.647 20.428 1.00 12.28 O ANISOU 1584 OG1 THR A 120 1336 1669 1661 -113 228 127 O ATOM 1585 CG2 THR A 120 -12.589 -11.584 19.183 1.00 11.47 C ANISOU 1585 CG2 THR A 120 1426 1408 1522 256 126 124 C ATOM 1586 H THR A 120 -12.143 -14.277 18.045 1.00 11.13 H ATOM 1587 HA THR A 120 -10.164 -12.530 18.554 1.00 9.71 H ATOM 1588 HB THR A 120 -11.268 -12.188 20.623 1.00 13.58 H ATOM 1589 HG1 THR A 120 -12.154 -14.204 20.832 1.00 14.74 H ATOM 1590 HG21 THR A 120 -13.221 -11.201 19.796 1.00 13.76 H ATOM 1591 HG22 THR A 120 -12.030 -10.886 18.835 1.00 13.76 H ATOM 1592 HG23 THR A 120 -13.068 -11.992 18.458 1.00 13.76 H ATOM 1593 N ILE A 121 -8.843 -13.543 20.426 1.00 6.63 N ANISOU 1593 N ILE A 121 839 865 817 -155 41 257 N ATOM 1594 CA ILE A 121 -7.986 -14.249 21.369 1.00 6.39 C ANISOU 1594 CA ILE A 121 793 820 815 65 29 124 C ATOM 1595 C ILE A 121 -8.337 -13.759 22.780 1.00 5.85 C ANISOU 1595 C ILE A 121 723 780 718 78 -36 9 C ATOM 1596 O ILE A 121 -8.495 -12.564 23.012 1.00 5.34 O ANISOU 1596 O ILE A 121 748 622 659 68 6 37 O ATOM 1597 CB ILE A 121 -6.466 -14.077 21.045 1.00 7.36 C ANISOU 1597 CB ILE A 121 946 914 936 -30 120 208 C ATOM 1598 CG1 ILE A 121 -5.597 -14.876 22.031 1.00 9.15 C ANISOU 1598 CG1 ILE A 121 1117 1195 1164 27 162 191 C ATOM 1599 CG2 ILE A 121 -6.051 -12.606 21.033 1.00 6.04 C ANISOU 1599 CG2 ILE A 121 724 771 802 -84 24 413 C ATOM 1600 CD1 ILE A 121 -5.682 -16.389 21.877 1.00 9.40 C ANISOU 1600 CD1 ILE A 121 1129 1220 1222 108 279 323 C ATOM 1601 H ILE A 121 -8.674 -12.702 20.367 1.00 7.96 H ATOM 1602 HA ILE A 121 -8.193 -15.206 21.326 1.00 7.67 H ATOM 1603 HB ILE A 121 -6.311 -14.435 20.157 1.00 8.83 H ATOM 1604 HG12 ILE A 121 -4.670 -14.620 21.903 1.00 10.98 H ATOM 1605 HG13 ILE A 121 -5.874 -14.657 22.934 1.00 10.98 H ATOM 1606 HG21 ILE A 121 -5.115 -12.547 20.831 1.00 7.25 H ATOM 1607 HG22 ILE A 121 -6.561 -12.144 20.364 1.00 7.25 H ATOM 1608 HG23 ILE A 121 -6.225 -12.226 21.897 1.00 7.25 H ATOM 1609 HD11 ILE A 121 -5.111 -16.801 22.529 1.00 11.28 H ATOM 1610 HD12 ILE A 121 -6.591 -16.666 22.015 1.00 11.28 H ATOM 1611 HD13 ILE A 121 -5.397 -16.629 20.993 1.00 11.28 H ATOM 1612 N SER A 122 -8.506 -14.697 23.701 1.00 7.11 N ANISOU 1612 N SER A 122 844 939 917 -205 -17 50 N ATOM 1613 CA SER A 122 -8.847 -14.381 25.098 1.00 8.71 C ANISOU 1613 CA SER A 122 1032 1138 1141 -443 26 84 C ATOM 1614 C SER A 122 -7.804 -13.538 25.827 1.00 6.47 C ANISOU 1614 C SER A 122 834 713 910 -225 102 120 C ATOM 1615 O SER A 122 -6.602 -13.773 25.700 1.00 5.94 O ANISOU 1615 O SER A 122 736 737 785 -138 117 86 O ATOM 1616 CB SER A 122 -9.010 -15.685 25.900 1.00 12.23 C ANISOU 1616 CB SER A 122 1539 1450 1658 -887 -161 144 C ATOM 1617 OG SER A 122 -10.156 -16.412 25.489 1.00 17.19 O ANISOU 1617 OG SER A 122 2202 2180 2151 -908 -74 190 O ATOM 1618 H SER A 122 -8.429 -15.540 23.547 1.00 8.53 H ATOM 1619 HA SER A 122 -9.700 -13.898 25.120 1.00 10.46 H ATOM 1620 HB2 SER A 122 -8.224 -16.237 25.764 1.00 14.68 H ATOM 1621 HB3 SER A 122 -9.099 -15.465 26.840 1.00 14.68 H ATOM 1622 HG SER A 122 -10.542 -16.010 24.887 1.00 20.63 H ATOM 1623 N LEU A 123 -8.265 -12.582 26.623 1.00 6.84 N ANISOU 1623 N LEU A 123 821 839 937 -43 36 147 N ATOM 1624 CA LEU A 123 -7.402 -11.906 27.582 1.00 6.34 C ANISOU 1624 CA LEU A 123 766 765 877 -74 11 143 C ATOM 1625 C LEU A 123 -7.023 -12.892 28.703 1.00 5.76 C ANISOU 1625 C LEU A 123 734 626 830 -179 108 277 C ATOM 1626 O LEU A 123 -7.781 -13.850 28.999 1.00 6.94 O ANISOU 1626 O LEU A 123 839 816 981 -229 101 398 O ATOM 1627 CB LEU A 123 -8.102 -10.660 28.146 1.00 7.05 C ANISOU 1627 CB LEU A 123 905 799 974 -132 -66 90 C ATOM 1628 CG LEU A 123 -8.391 -9.555 27.118 1.00 10.19 C ANISOU 1628 CG LEU A 123 1255 1280 1335 56 -135 101 C ATOM 1629 CD1 LEU A 123 -9.074 -8.379 27.830 1.00 10.87 C ANISOU 1629 CD1 LEU A 123 1389 1306 1435 25 -235 154 C ATOM 1630 CD2 LEU A 123 -7.117 -9.064 26.384 1.00 12.91 C ANISOU 1630 CD2 LEU A 123 1645 1600 1659 96 -168 90 C ATOM 1631 H LEU A 123 -9.079 -12.305 26.627 1.00 8.20 H ATOM 1632 HA LEU A 123 -6.579 -11.620 27.132 1.00 7.61 H ATOM 1633 HB2 LEU A 123 -8.951 -10.930 28.530 1.00 8.46 H ATOM 1634 HB3 LEU A 123 -7.540 -10.276 28.837 1.00 8.46 H ATOM 1635 HG LEU A 123 -9.006 -9.898 26.452 1.00 12.22 H ATOM 1636 HD11 LEU A 123 -9.255 -7.688 27.189 1.00 13.04 H ATOM 1637 HD12 LEU A 123 -9.895 -8.686 28.222 1.00 13.04 H ATOM 1638 HD13 LEU A 123 -8.489 -8.046 28.515 1.00 13.04 H ATOM 1639 HD21 LEU A 123 -7.363 -8.378 25.759 1.00 15.49 H ATOM 1640 HD22 LEU A 123 -6.500 -8.713 27.031 1.00 15.49 H ATOM 1641 HD23 LEU A 123 -6.720 -9.804 25.919 1.00 15.49 H ATOM 1642 N PRO A 124 -5.846 -12.686 29.328 1.00 6.28 N ANISOU 1642 N PRO A 124 845 804 736 -47 184 155 N ATOM 1643 CA PRO A 124 -5.364 -13.656 30.325 1.00 6.61 C ANISOU 1643 CA PRO A 124 863 791 858 -11 254 41 C ATOM 1644 C PRO A 124 -5.930 -13.459 31.734 1.00 6.82 C ANISOU 1644 C PRO A 124 914 817 860 -63 334 9 C ATOM 1645 O PRO A 124 -6.212 -12.332 32.126 1.00 7.68 O ANISOU 1645 O PRO A 124 1061 952 904 -61 544 74 O ATOM 1646 CB PRO A 124 -3.850 -13.416 30.325 1.00 6.64 C ANISOU 1646 CB PRO A 124 823 818 882 -85 220 12 C ATOM 1647 CG PRO A 124 -3.729 -11.932 30.017 1.00 6.01 C ANISOU 1647 CG PRO A 124 767 707 809 -4 196 27 C ATOM 1648 CD PRO A 124 -4.851 -11.631 29.058 1.00 5.78 C ANISOU 1648 CD PRO A 124 774 691 729 103 53 -9 C ATOM 1649 HA PRO A 124 -5.547 -14.571 30.026 1.00 7.93 H ATOM 1650 HB2 PRO A 124 -3.481 -13.621 31.199 1.00 7.96 H ATOM 1651 HB3 PRO A 124 -3.428 -13.950 29.634 1.00 7.96 H ATOM 1652 HG2 PRO A 124 -3.830 -11.420 30.835 1.00 7.21 H ATOM 1653 HG3 PRO A 124 -2.869 -11.754 29.605 1.00 7.21 H ATOM 1654 HD2 PRO A 124 -5.228 -10.757 29.245 1.00 6.93 H ATOM 1655 HD3 PRO A 124 -4.536 -11.692 28.142 1.00 6.93 H ATOM 1656 N THR A 125 -6.105 -14.565 32.461 1.00 6.14 N ANISOU 1656 N THR A 125 834 666 833 -79 370 129 N ATOM 1657 CA THR A 125 -6.580 -14.555 33.834 1.00 6.02 C ANISOU 1657 CA THR A 125 760 682 847 -105 279 127 C ATOM 1658 C THR A 125 -5.438 -14.706 34.844 1.00 5.82 C ANISOU 1658 C THR A 125 720 634 857 -32 262 152 C ATOM 1659 O THR A 125 -5.664 -14.594 36.045 1.00 5.88 O ANISOU 1659 O THR A 125 540 857 838 85 97 53 O ATOM 1660 CB THR A 125 -7.653 -15.670 34.073 1.00 6.58 C ANISOU 1660 CB THR A 125 855 763 884 -45 257 102 C ATOM 1661 OG1 THR A 125 -7.177 -16.944 33.613 1.00 7.67 O ANISOU 1661 OG1 THR A 125 1037 934 942 -229 178 175 O ATOM 1662 CG2 THR A 125 -8.935 -15.331 33.336 1.00 7.55 C ANISOU 1662 CG2 THR A 125 926 954 988 -179 329 57 C ATOM 1663 H THR A 125 -5.948 -15.357 32.164 1.00 7.37 H ATOM 1664 HA THR A 125 -7.011 -13.692 34.005 1.00 7.23 H ATOM 1665 HB THR A 125 -7.852 -15.725 35.021 1.00 7.90 H ATOM 1666 HG1 THR A 125 -6.493 -17.150 34.016 1.00 9.20 H ATOM 1667 HG21 THR A 125 -9.590 -16.016 33.485 1.00 9.06 H ATOM 1668 HG22 THR A 125 -9.283 -14.493 33.650 1.00 9.06 H ATOM 1669 HG23 THR A 125 -8.763 -15.263 32.394 1.00 9.06 H ATOM 1670 N ALA A 127 -4.230 -14.999 34.351 1.00 6.52 N ANISOU 1670 N ALA A 127 717 799 961 -80 271 195 N ATOM 1671 CA ALA A 127 -3.016 -15.033 35.175 1.00 6.81 C ANISOU 1671 CA ALA A 127 807 813 965 -6 316 228 C ATOM 1672 C ALA A 127 -1.823 -14.865 34.244 1.00 7.04 C ANISOU 1672 C ALA A 127 772 877 1027 28 334 228 C ATOM 1673 O ALA A 127 -1.873 -15.309 33.099 1.00 7.29 O ANISOU 1673 O ALA A 127 732 951 1086 32 449 181 O ATOM 1674 CB ALA A 127 -2.900 -16.361 35.955 1.00 7.89 C ANISOU 1674 CB ALA A 127 1000 924 1072 -165 273 226 C ATOM 1675 H ALA A 127 -4.086 -15.185 33.524 1.00 7.82 H ATOM 1676 HA ALA A 127 -3.026 -14.290 35.814 1.00 8.17 H ATOM 1677 HB1 ALA A 127 -2.096 -16.345 36.480 1.00 9.46 H ATOM 1678 HB2 ALA A 127 -3.664 -16.453 36.529 1.00 9.46 H ATOM 1679 HB3 ALA A 127 -2.869 -17.089 35.331 1.00 9.46 H ATOM 1680 N PRO A 128 -0.743 -14.232 34.724 1.00 8.23 N ANISOU 1680 N PRO A 128 831 1034 1263 90 282 167 N ATOM 1681 CA PRO A 128 0.432 -14.092 33.848 1.00 10.85 C ANISOU 1681 CA PRO A 128 1248 1353 1522 64 224 130 C ATOM 1682 C PRO A 128 1.149 -15.446 33.649 1.00 8.63 C ANISOU 1682 C PRO A 128 977 990 1310 166 152 303 C ATOM 1683 O PRO A 128 0.983 -16.329 34.458 1.00 7.06 O ANISOU 1683 O PRO A 128 844 542 1296 -10 189 244 O ATOM 1684 CB PRO A 128 1.312 -13.095 34.597 1.00 12.99 C ANISOU 1684 CB PRO A 128 1562 1622 1750 -69 194 49 C ATOM 1685 CG PRO A 128 0.977 -13.262 36.022 1.00 12.15 C ANISOU 1685 CG PRO A 128 1453 1499 1666 -188 51 140 C ATOM 1686 CD PRO A 128 -0.501 -13.708 36.081 1.00 9.76 C ANISOU 1686 CD PRO A 128 1094 1208 1408 -76 38 83 C ATOM 1687 HA PRO A 128 0.176 -13.720 32.978 1.00 13.02 H ATOM 1688 HB2 PRO A 128 2.246 -13.302 34.439 1.00 15.58 H ATOM 1689 HB3 PRO A 128 1.107 -12.194 34.301 1.00 15.58 H ATOM 1690 HG2 PRO A 128 1.551 -13.941 36.410 1.00 14.58 H ATOM 1691 HG3 PRO A 128 1.094 -12.416 36.482 1.00 14.58 H ATOM 1692 HD2 PRO A 128 -0.618 -14.408 36.741 1.00 11.71 H ATOM 1693 HD3 PRO A 128 -1.078 -12.948 36.259 1.00 11.71 H ATOM 1694 N PRO A 129 1.928 -15.610 32.571 1.00 8.97 N ANISOU 1694 N PRO A 129 1058 1129 1222 274 139 420 N ATOM 1695 CA PRO A 129 2.458 -16.956 32.297 1.00 8.20 C ANISOU 1695 CA PRO A 129 944 1119 1054 195 138 333 C ATOM 1696 C PRO A 129 3.711 -17.283 33.110 1.00 8.08 C ANISOU 1696 C PRO A 129 930 1106 1032 325 52 345 C ATOM 1697 O PRO A 129 4.590 -16.438 33.264 1.00 9.46 O ANISOU 1697 O PRO A 129 965 1533 1095 184 -79 465 O ATOM 1698 CB PRO A 129 2.808 -16.889 30.808 1.00 9.72 C ANISOU 1698 CB PRO A 129 1178 1296 1219 249 189 220 C ATOM 1699 CG PRO A 129 3.198 -15.421 30.590 1.00 9.25 C ANISOU 1699 CG PRO A 129 1167 1136 1212 233 104 357 C ATOM 1700 CD PRO A 129 2.342 -14.611 31.569 1.00 10.35 C ANISOU 1700 CD PRO A 129 1290 1309 1333 180 59 536 C ATOM 1701 HA PRO A 129 1.773 -17.640 32.448 1.00 9.84 H ATOM 1702 HB2 PRO A 129 3.555 -17.479 30.617 1.00 11.66 H ATOM 1703 HB3 PRO A 129 2.033 -17.125 30.275 1.00 11.66 H ATOM 1704 HG2 PRO A 129 4.141 -15.303 30.784 1.00 11.10 H ATOM 1705 HG3 PRO A 129 3.003 -15.165 29.675 1.00 11.10 H ATOM 1706 HD2 PRO A 129 2.873 -13.915 31.986 1.00 12.42 H ATOM 1707 HD3 PRO A 129 1.567 -14.245 31.116 1.00 12.42 H ATOM 1708 N ALA A 130 3.785 -18.501 33.609 1.00 9.16 N ANISOU 1708 N ALA A 130 1078 1297 1104 295 161 190 N ATOM 1709 CA ALA A 130 4.931 -18.942 34.383 1.00 7.79 C ANISOU 1709 CA ALA A 130 956 1032 970 138 82 234 C ATOM 1710 C ALA A 130 6.192 -19.040 33.512 1.00 7.65 C ANISOU 1710 C ALA A 130 910 954 1042 144 68 378 C ATOM 1711 O ALA A 130 6.119 -19.349 32.313 1.00 7.63 O ANISOU 1711 O ALA A 130 908 917 1075 124 161 335 O ATOM 1712 CB ALA A 130 4.613 -20.302 34.999 1.00 9.24 C ANISOU 1712 CB ALA A 130 1161 1196 1153 -105 129 219 C ATOM 1713 H ALA A 130 3.177 -19.101 33.514 1.00 10.99 H ATOM 1714 HA ALA A 130 5.101 -18.304 35.107 1.00 9.34 H ATOM 1715 HB1 ALA A 130 5.369 -20.597 35.512 1.00 11.09 H ATOM 1716 HB2 ALA A 130 3.845 -20.215 35.569 1.00 11.09 H ATOM 1717 HB3 ALA A 130 4.429 -20.929 34.295 1.00 11.09 H ATOM 1718 N ALA A 132 7.348 -18.789 34.113 1.00 7.22 N ANISOU 1718 N ALA A 132 945 777 1019 30 -1 236 N ATOM 1719 CA ALA A 132 8.610 -19.060 33.431 1.00 7.61 C ANISOU 1719 CA ALA A 132 975 865 1052 50 -28 220 C ATOM 1720 C ALA A 132 8.599 -20.481 32.891 1.00 8.04 C ANISOU 1720 C ALA A 132 1019 971 1063 188 32 284 C ATOM 1721 O ALA A 132 8.095 -21.412 33.545 1.00 7.35 O ANISOU 1721 O ALA A 132 844 894 1055 276 5 433 O ATOM 1722 CB ALA A 132 9.777 -18.863 34.374 1.00 9.85 C ANISOU 1722 CB ALA A 132 1256 1188 1298 -75 -12 142 C ATOM 1723 H ALA A 132 7.431 -18.466 34.906 1.00 8.66 H ATOM 1724 HA ALA A 132 8.713 -18.442 32.677 1.00 9.13 H ATOM 1725 HB1 ALA A 132 10.593 -19.047 33.902 1.00 11.81 H ATOM 1726 HB2 ALA A 132 9.777 -17.956 34.686 1.00 11.81 H ATOM 1727 HB3 ALA A 132 9.684 -19.466 35.115 1.00 11.81 H ATOM 1728 N GLY A 133 9.129 -20.642 31.682 1.00 8.87 N ANISOU 1728 N GLY A 133 1136 1111 1124 252 67 334 N ATOM 1729 CA GLY A 133 9.196 -21.949 31.045 1.00 9.03 C ANISOU 1729 CA GLY A 133 1222 1067 1143 305 122 286 C ATOM 1730 C GLY A 133 7.989 -22.291 30.184 1.00 8.61 C ANISOU 1730 C GLY A 133 1249 975 1047 326 132 105 C ATOM 1731 O GLY A 133 8.033 -23.247 29.409 1.00 10.59 O ANISOU 1731 O GLY A 133 1586 1252 1186 356 257 100 O ATOM 1732 H GLY A 133 9.458 -20.004 31.209 1.00 10.65 H ATOM 1733 HA2 GLY A 133 9.986 -21.986 30.483 1.00 10.84 H ATOM 1734 HA3 GLY A 133 9.281 -22.631 31.730 1.00 10.84 H ATOM 1735 N THR A 134 6.910 -21.513 30.299 1.00 7.02 N ANISOU 1735 N THR A 134 980 787 900 218 -2 -2 N ATOM 1736 CA THR A 134 5.710 -21.759 29.504 1.00 8.56 C ANISOU 1736 CA THR A 134 1182 1016 1053 259 97 239 C ATOM 1737 C THR A 134 6.047 -21.580 28.028 1.00 8.80 C ANISOU 1737 C THR A 134 1352 958 1036 254 278 267 C ATOM 1738 O THR A 134 6.675 -20.592 27.637 1.00 8.61 O ANISOU 1738 O THR A 134 1320 990 961 45 355 242 O ATOM 1739 CB THR A 134 4.563 -20.810 29.892 1.00 9.89 C ANISOU 1739 CB THR A 134 1247 1302 1209 2 87 277 C ATOM 1740 OG1 THR A 134 4.217 -21.002 31.270 1.00 9.68 O ANISOU 1740 OG1 THR A 134 1104 1435 1139 -26 155 164 O ATOM 1741 CG2 THR A 134 3.330 -21.067 29.065 1.00 12.11 C ANISOU 1741 CG2 THR A 134 1499 1605 1497 -25 115 362 C ATOM 1742 H THR A 134 6.850 -20.839 30.829 1.00 8.42 H ATOM 1743 HA THR A 134 5.410 -22.681 29.644 1.00 10.27 H ATOM 1744 HB THR A 134 4.841 -19.891 29.753 1.00 11.87 H ATOM 1745 HG1 THR A 134 4.866 -20.846 31.746 1.00 11.62 H ATOM 1746 HG21 THR A 134 2.629 -20.464 29.324 1.00 14.53 H ATOM 1747 HG22 THR A 134 3.526 -20.935 28.134 1.00 14.53 H ATOM 1748 HG23 THR A 134 3.030 -21.969 29.196 1.00 14.53 H ATOM 1749 N GLU A 135 5.630 -22.537 27.206 1.00 9.96 N ANISOU 1749 N GLU A 135 1518 1082 1183 315 325 234 N ATOM 1750 CA GLU A 135 5.836 -22.417 25.765 1.00 11.08 C ANISOU 1750 CA GLU A 135 1550 1277 1384 387 358 73 C ATOM 1751 C GLU A 135 4.727 -21.567 25.177 1.00 8.57 C ANISOU 1751 C GLU A 135 1052 1149 1053 257 184 33 C ATOM 1752 O GLU A 135 3.548 -21.769 25.459 1.00 9.40 O ANISOU 1752 O GLU A 135 1134 1436 1001 39 164 146 O ATOM 1753 CB GLU A 135 5.895 -23.783 25.071 1.00 16.24 C ANISOU 1753 CB GLU A 135 2158 1930 2081 544 589 -277 C ATOM 1754 CG GLU A 135 6.342 -23.659 23.611 1.00 25.60 C ANISOU 1754 CG GLU A 135 3335 3099 3292 485 831 -447 C ATOM 1755 CD GLU A 135 6.740 -24.990 23.004 1.00 27.41 C ANISOU 1755 CD GLU A 135 3685 3219 3511 252 1046 -446 C ATOM 1756 OE1 GLU A 135 5.983 -25.977 23.201 1.00 29.62 O ANISOU 1756 OE1 GLU A 135 4020 3485 3749 -21 1148 -472 O ATOM 1757 OE2 GLU A 135 7.808 -25.052 22.350 1.00 26.49 O ANISOU 1757 OE2 GLU A 135 3598 2940 3525 366 1138 -503 O ATOM 1758 H GLU A 135 5.231 -23.258 27.452 1.00 11.95 H ATOM 1759 HA GLU A 135 6.687 -21.959 25.603 1.00 13.30 H ATOM 1760 HB2 GLU A 135 6.531 -24.350 25.536 1.00 19.48 H ATOM 1761 HB3 GLU A 135 5.013 -24.187 25.085 1.00 19.48 H ATOM 1762 HG2 GLU A 135 5.611 -23.296 23.086 1.00 30.72 H ATOM 1763 HG3 GLU A 135 7.110 -23.067 23.565 1.00 30.72 H ATOM 1764 N CYS A 136 5.144 -20.589 24.386 1.00 6.96 N ANISOU 1764 N CYS A 136 859 866 920 205 133 112 N ATOM 1765 CA CYS A 136 4.259 -19.628 23.751 1.00 7.40 C ANISOU 1765 CA CYS A 136 987 880 946 142 108 54 C ATOM 1766 C CYS A 136 4.464 -19.590 22.224 1.00 6.22 C ANISOU 1766 C CYS A 136 792 789 781 108 172 -59 C ATOM 1767 O CYS A 136 5.452 -20.090 21.693 1.00 7.99 O ANISOU 1767 O CYS A 136 932 1256 849 281 189 -67 O ATOM 1768 CB CYS A 136 4.545 -18.240 24.312 1.00 8.34 C ANISOU 1768 CB CYS A 136 1116 1038 1017 273 170 -62 C ATOM 1769 SG CYS A 136 4.352 -18.108 26.113 1.00 8.64 S ANISOU 1769 SG CYS A 136 1131 1208 943 239 4 -32 S ATOM 1770 H CYS A 136 5.972 -20.458 24.196 1.00 8.35 H ATOM 1771 HA CYS A 136 3.326 -19.859 23.940 1.00 8.88 H ATOM 1772 HB2 CYS A 136 5.459 -17.999 24.095 1.00 10.01 H ATOM 1773 HB3 CYS A 136 3.934 -17.607 23.903 1.00 10.01 H ATOM 1774 N LEU A 137 3.511 -18.984 21.529 1.00 4.82 N ANISOU 1774 N LEU A 137 656 548 627 97 96 135 N ATOM 1775 CA LEU A 137 3.556 -18.827 20.083 1.00 5.15 C ANISOU 1775 CA LEU A 137 727 556 672 117 94 50 C ATOM 1776 C LEU A 137 3.616 -17.326 19.756 1.00 5.33 C ANISOU 1776 C LEU A 137 788 531 707 254 79 82 C ATOM 1777 O LEU A 137 2.708 -16.560 20.133 1.00 5.60 O ANISOU 1777 O LEU A 137 783 625 720 146 74 114 O ATOM 1778 CB LEU A 137 2.309 -19.445 19.451 1.00 6.78 C ANISOU 1778 CB LEU A 137 854 899 822 173 135 166 C ATOM 1779 CG LEU A 137 2.241 -19.416 17.913 1.00 8.03 C ANISOU 1779 CG LEU A 137 1016 1060 977 -24 146 27 C ATOM 1780 CD1 LEU A 137 3.367 -20.220 17.296 1.00 7.86 C ANISOU 1780 CD1 LEU A 137 1025 1016 946 -90 282 -48 C ATOM 1781 CD2 LEU A 137 0.885 -19.929 17.452 1.00 10.94 C ANISOU 1781 CD2 LEU A 137 1387 1401 1370 -40 172 -17 C ATOM 1782 H LEU A 137 2.806 -18.645 21.886 1.00 5.78 H ATOM 1783 HA LEU A 137 4.353 -19.267 19.720 1.00 6.17 H ATOM 1784 HB2 LEU A 137 2.258 -20.375 19.724 1.00 8.13 H ATOM 1785 HB3 LEU A 137 1.532 -18.969 19.783 1.00 8.13 H ATOM 1786 HG LEU A 137 2.330 -18.498 17.612 1.00 9.64 H ATOM 1787 HD11 LEU A 137 3.292 -20.179 16.340 1.00 9.43 H ATOM 1788 HD12 LEU A 137 4.206 -19.848 17.575 1.00 9.43 H ATOM 1789 HD13 LEU A 137 3.298 -21.131 17.591 1.00 9.43 H ATOM 1790 HD21 LEU A 137 0.853 -19.907 16.493 1.00 13.13 H ATOM 1791 HD22 LEU A 137 0.770 -20.830 17.763 1.00 13.13 H ATOM 1792 HD23 LEU A 137 0.198 -19.367 17.816 1.00 13.13 H ATOM 1793 N ILE A 138 4.678 -16.922 19.063 1.00 4.39 N ANISOU 1793 N ILE A 138 624 397 649 177 -71 -40 N ATOM 1794 CA ILE A 138 4.902 -15.536 18.662 1.00 5.37 C ANISOU 1794 CA ILE A 138 730 616 696 169 -16 -35 C ATOM 1795 C ILE A 138 4.781 -15.493 17.137 1.00 5.13 C ANISOU 1795 C ILE A 138 733 574 642 115 42 60 C ATOM 1796 O ILE A 138 5.267 -16.394 16.451 1.00 5.44 O ANISOU 1796 O ILE A 138 835 654 576 155 58 137 O ATOM 1797 CB ILE A 138 6.305 -15.075 19.068 1.00 6.82 C ANISOU 1797 CB ILE A 138 893 825 872 -8 11 -252 C ATOM 1798 CG1 ILE A 138 6.579 -15.436 20.538 1.00 7.86 C ANISOU 1798 CG1 ILE A 138 969 970 1048 -163 4 -55 C ATOM 1799 CG2 ILE A 138 6.484 -13.594 18.810 1.00 8.27 C ANISOU 1799 CG2 ILE A 138 1054 1036 1050 -313 -28 -232 C ATOM 1800 CD1 ILE A 138 7.962 -15.075 21.024 1.00 12.39 C ANISOU 1800 CD1 ILE A 138 1607 1535 1566 -182 -27 8 C ATOM 1801 H ILE A 138 5.304 -17.452 18.805 1.00 5.27 H ATOM 1802 HA ILE A 138 4.231 -14.945 19.064 1.00 6.45 H ATOM 1803 HB ILE A 138 6.947 -15.552 18.519 1.00 8.18 H ATOM 1804 HG12 ILE A 138 5.939 -14.967 21.096 1.00 9.43 H ATOM 1805 HG13 ILE A 138 6.469 -16.393 20.647 1.00 9.43 H ATOM 1806 HG21 ILE A 138 7.371 -13.336 19.073 1.00 9.92 H ATOM 1807 HG22 ILE A 138 6.358 -13.422 17.874 1.00 9.92 H ATOM 1808 HG23 ILE A 138 5.835 -13.107 19.323 1.00 9.92 H ATOM 1809 HD11 ILE A 138 8.047 -15.334 21.945 1.00 14.87 H ATOM 1810 HD12 ILE A 138 8.612 -15.541 20.492 1.00 14.87 H ATOM 1811 HD13 ILE A 138 8.086 -14.127 20.937 1.00 14.87 H ATOM 1812 N SER A 139 4.158 -14.452 16.590 1.00 4.98 N ANISOU 1812 N SER A 139 659 578 655 -56 51 -30 N ATOM 1813 CA SER A 139 3.907 -14.449 15.153 1.00 5.58 C ANISOU 1813 CA SER A 139 731 667 722 41 80 -55 C ATOM 1814 C SER A 139 3.904 -13.050 14.550 1.00 4.97 C ANISOU 1814 C SER A 139 636 633 619 98 86 -20 C ATOM 1815 O SER A 139 3.700 -12.057 15.268 1.00 4.96 O ANISOU 1815 O SER A 139 634 623 628 49 -12 -38 O ATOM 1816 CB SER A 139 2.571 -15.148 14.896 1.00 6.76 C ANISOU 1816 CB SER A 139 800 916 852 173 -36 28 C ATOM 1817 OG SER A 139 1.558 -14.578 15.702 1.00 6.47 O ANISOU 1817 OG SER A 139 676 930 853 64 -84 162 O ATOM 1818 H SER A 139 3.878 -13.757 17.013 1.00 5.98 H ATOM 1819 HA SER A 139 4.609 -14.968 14.707 1.00 6.70 H ATOM 1820 HB2 SER A 139 2.332 -15.042 13.962 1.00 8.11 H ATOM 1821 HB3 SER A 139 2.658 -16.089 15.114 1.00 8.11 H ATOM 1822 HG SER A 139 0.843 -14.955 15.561 1.00 7.77 H ATOM 1823 N GLY A 140 4.143 -12.970 13.236 1.00 4.85 N ANISOU 1823 N GLY A 140 766 505 573 -52 187 -123 N ATOM 1824 CA GLY A 140 4.173 -11.688 12.537 1.00 5.03 C ANISOU 1824 CA GLY A 140 767 497 646 175 125 -135 C ATOM 1825 C GLY A 140 4.812 -11.757 11.150 1.00 4.23 C ANISOU 1825 C GLY A 140 626 379 603 343 67 -126 C ATOM 1826 O GLY A 140 5.341 -12.819 10.730 1.00 4.70 O ANISOU 1826 O GLY A 140 612 518 656 270 -13 -277 O ATOM 1827 H GLY A 140 4.290 -13.649 12.729 1.00 5.82 H ATOM 1828 HA2 GLY A 140 3.266 -11.359 12.436 1.00 6.03 H ATOM 1829 HA3 GLY A 140 4.671 -11.048 13.068 1.00 6.03 H ATOM 1830 N TRP A 141 4.758 -10.621 10.452 1.00 4.81 N ANISOU 1830 N TRP A 141 606 612 610 238 35 -179 N ATOM 1831 CA TRP A 141 5.331 -10.453 9.122 1.00 4.84 C ANISOU 1831 CA TRP A 141 647 613 579 232 29 -45 C ATOM 1832 C TRP A 141 6.614 -9.608 9.192 1.00 5.02 C ANISOU 1832 C TRP A 141 745 663 501 41 109 -57 C ATOM 1833 O TRP A 141 7.020 -8.943 8.223 1.00 5.94 O ANISOU 1833 O TRP A 141 986 875 395 84 161 52 O ATOM 1834 CB TRP A 141 4.303 -9.802 8.189 1.00 5.44 C ANISOU 1834 CB TRP A 141 697 697 675 238 5 -31 C ATOM 1835 CG TRP A 141 3.118 -10.666 7.810 1.00 5.07 C ANISOU 1835 CG TRP A 141 711 563 653 201 -113 -20 C ATOM 1836 CD1 TRP A 141 3.041 -11.545 6.757 1.00 6.33 C ANISOU 1836 CD1 TRP A 141 870 724 812 133 -179 -12 C ATOM 1837 CD2 TRP A 141 1.827 -10.687 8.438 1.00 5.52 C ANISOU 1837 CD2 TRP A 141 812 587 697 91 -61 36 C ATOM 1838 NE1 TRP A 141 1.792 -12.108 6.704 1.00 6.01 N ANISOU 1838 NE1 TRP A 141 778 752 751 141 -94 -95 N ATOM 1839 CE2 TRP A 141 1.027 -11.612 7.724 1.00 5.96 C ANISOU 1839 CE2 TRP A 141 870 648 747 121 -43 -10 C ATOM 1840 CE3 TRP A 141 1.268 -10.008 9.526 1.00 5.84 C ANISOU 1840 CE3 TRP A 141 904 576 740 -151 39 103 C ATOM 1841 CZ2 TRP A 141 -0.307 -11.867 8.054 1.00 6.63 C ANISOU 1841 CZ2 TRP A 141 939 775 804 12 -32 -69 C ATOM 1842 CZ3 TRP A 141 -0.068 -10.262 9.864 1.00 5.79 C ANISOU 1842 CZ3 TRP A 141 865 601 736 -22 78 301 C ATOM 1843 CH2 TRP A 141 -0.835 -11.196 9.139 1.00 7.03 C ANISOU 1843 CH2 TRP A 141 955 872 843 -51 54 159 C ATOM 1844 H TRP A 141 4.378 -9.907 10.744 1.00 5.77 H ATOM 1845 HA TRP A 141 5.563 -11.333 8.757 1.00 5.81 H ATOM 1846 HB2 TRP A 141 3.956 -9.008 8.624 1.00 6.53 H ATOM 1847 HB3 TRP A 141 4.753 -9.550 7.367 1.00 6.53 H ATOM 1848 HD1 TRP A 141 3.739 -11.741 6.174 1.00 7.60 H ATOM 1849 HE1 TRP A 141 1.538 -12.699 6.134 1.00 7.21 H ATOM 1850 HE3 TRP A 141 1.768 -9.388 10.005 1.00 7.01 H ATOM 1851 HZ2 TRP A 141 -0.823 -12.457 7.554 1.00 7.95 H ATOM 1852 HZ3 TRP A 141 -0.446 -9.828 10.595 1.00 6.95 H ATOM 1853 HH2 TRP A 141 -1.714 -11.360 9.393 1.00 8.43 H ATOM 1854 N GLY A 142 7.288 -9.661 10.332 1.00 4.98 N ANISOU 1854 N GLY A 142 616 663 615 -159 8 -73 N ATOM 1855 CA GLY A 142 8.533 -8.927 10.504 1.00 6.40 C ANISOU 1855 CA GLY A 142 812 800 820 -223 129 -30 C ATOM 1856 C GLY A 142 9.732 -9.552 9.811 1.00 6.07 C ANISOU 1856 C GLY A 142 870 693 744 4 136 7 C ATOM 1857 O GLY A 142 9.652 -10.632 9.213 1.00 4.64 O ANISOU 1857 O GLY A 142 769 337 657 218 143 -15 O ATOM 1858 H GLY A 142 7.046 -10.114 11.022 1.00 5.98 H ATOM 1859 HA2 GLY A 142 8.421 -8.028 10.158 1.00 7.68 H ATOM 1860 HA3 GLY A 142 8.733 -8.862 11.451 1.00 7.68 H ATOM 1861 N ASN A 143 10.868 -8.861 9.899 1.00 6.66 N ANISOU 1861 N ASN A 143 856 863 811 31 196 -101 N ATOM 1862 CA ASN A 143 12.104 -9.314 9.262 1.00 6.32 C ANISOU 1862 CA ASN A 143 756 793 851 -27 305 -107 C ATOM 1863 C ASN A 143 12.444 -10.740 9.694 1.00 6.27 C ANISOU 1863 C ASN A 143 761 875 748 -67 333 -68 C ATOM 1864 O ASN A 143 12.321 -11.087 10.885 1.00 6.75 O ANISOU 1864 O ASN A 143 835 992 736 -144 350 -177 O ATOM 1865 CB ASN A 143 13.243 -8.369 9.652 1.00 8.11 C ANISOU 1865 CB ASN A 143 1049 948 1086 -127 316 -131 C ATOM 1866 CG ASN A 143 14.421 -8.411 8.708 1.00 9.46 C ANISOU 1866 CG ASN A 143 1183 1159 1254 -289 378 -310 C ATOM 1867 OD1 ASN A 143 14.559 -9.284 7.833 1.00 8.47 O ANISOU 1867 OD1 ASN A 143 948 1168 1102 -275 336 -296 O ATOM 1868 ND2 ASN A 143 15.307 -7.452 8.895 1.00 11.32 N ANISOU 1868 ND2 ASN A 143 1335 1429 1537 -404 519 -380 N ATOM 1869 H ASN A 143 10.949 -8.119 10.326 1.00 7.99 H ATOM 1870 HA ASN A 143 11.999 -9.297 8.288 1.00 7.58 H ATOM 1871 HB2 ASN A 143 12.905 -7.460 9.664 1.00 9.74 H ATOM 1872 HB3 ASN A 143 13.562 -8.612 10.535 1.00 9.74 H ATOM 1873 HD21 ASN A 143 16.103 -7.403 8.326 1.00 13.58 H ATOM 1874 HD22 ASN A 143 15.168 -6.789 9.603 1.00 13.58 H ATOM 1875 N THR A 144 12.873 -11.550 8.725 1.00 6.53 N ANISOU 1875 N THR A 144 818 797 866 -17 325 -39 N ATOM 1876 CA THR A 144 13.296 -12.924 8.972 1.00 7.12 C ANISOU 1876 CA THR A 144 852 932 920 -15 267 -42 C ATOM 1877 C THR A 144 14.823 -13.107 9.098 1.00 7.86 C ANISOU 1877 C THR A 144 936 1046 1004 2 123 -119 C ATOM 1878 O THR A 144 15.292 -14.232 9.287 1.00 9.01 O ANISOU 1878 O THR A 144 980 1247 1198 -59 205 -52 O ATOM 1879 CB THR A 144 12.755 -13.895 7.883 1.00 7.50 C ANISOU 1879 CB THR A 144 888 990 972 -110 296 -34 C ATOM 1880 OG1 THR A 144 13.282 -13.532 6.592 1.00 8.15 O ANISOU 1880 OG1 THR A 144 1083 1002 1010 -73 343 118 O ATOM 1881 CG2 THR A 144 11.200 -13.933 7.858 1.00 8.31 C ANISOU 1881 CG2 THR A 144 1072 1010 1077 -212 275 -117 C ATOM 1882 H THR A 144 12.928 -11.319 7.898 1.00 7.84 H ATOM 1883 HA THR A 144 12.905 -13.208 9.825 1.00 8.54 H ATOM 1884 HB THR A 144 13.061 -14.790 8.096 1.00 9.00 H ATOM 1885 HG1 THR A 144 13.056 -12.767 6.401 1.00 9.77 H ATOM 1886 HG21 THR A 144 10.898 -14.539 7.178 1.00 9.97 H ATOM 1887 HG22 THR A 144 10.866 -14.226 8.709 1.00 9.97 H ATOM 1888 HG23 THR A 144 10.854 -13.057 7.672 1.00 9.97 H ATOM 1889 N LEU A 145 15.578 -12.013 9.001 1.00 8.25 N ANISOU 1889 N LEU A 145 1000 1014 1122 -57 70 -230 N ATOM 1890 CA LEU A 145 17.033 -12.023 9.159 1.00 11.13 C ANISOU 1890 CA LEU A 145 1362 1383 1486 -166 171 -416 C ATOM 1891 C LEU A 145 17.518 -11.126 10.303 1.00 14.17 C ANISOU 1891 C LEU A 145 1680 1885 1820 -483 390 -629 C ATOM 1892 O LEU A 145 16.941 -10.076 10.567 1.00 14.32 O ANISOU 1892 O LEU A 145 1778 1825 1837 -460 268 -604 O ATOM 1893 CB LEU A 145 17.692 -11.546 7.866 1.00 13.74 C ANISOU 1893 CB LEU A 145 1744 1674 1803 -310 241 -318 C ATOM 1894 CG LEU A 145 17.479 -12.429 6.638 1.00 16.64 C ANISOU 1894 CG LEU A 145 2087 2096 2138 -446 252 -263 C ATOM 1895 CD1 LEU A 145 18.127 -11.791 5.412 1.00 17.98 C ANISOU 1895 CD1 LEU A 145 2246 2276 2310 -446 277 -233 C ATOM 1896 CD2 LEU A 145 18.044 -13.810 6.894 1.00 20.38 C ANISOU 1896 CD2 LEU A 145 2583 2543 2616 -485 348 -264 C ATOM 1897 H LEU A 145 15.260 -11.230 8.839 1.00 9.90 H ATOM 1898 HA LEU A 145 17.333 -12.939 9.338 1.00 13.36 H ATOM 1899 HB2 LEU A 145 17.343 -10.666 7.653 1.00 16.49 H ATOM 1900 HB3 LEU A 145 18.649 -11.485 8.016 1.00 16.49 H ATOM 1901 HG LEU A 145 16.528 -12.516 6.469 1.00 19.96 H ATOM 1902 HD11 LEU A 145 17.983 -12.359 4.652 1.00 21.58 H ATOM 1903 HD12 LEU A 145 17.727 -10.932 5.260 1.00 21.58 H ATOM 1904 HD13 LEU A 145 19.068 -11.691 5.573 1.00 21.58 H ATOM 1905 HD21 LEU A 145 17.903 -14.354 6.115 1.00 24.45 H ATOM 1906 HD22 LEU A 145 18.983 -13.735 7.075 1.00 24.45 H ATOM 1907 HD23 LEU A 145 17.593 -14.197 7.648 1.00 24.45 H ATOM 1908 N SER A 146 18.578 -11.563 10.982 1.00 17.52 N ANISOU 1908 N SER A 146 2009 2408 2240 -816 548 -914 N ATOM 1909 CA SER A 146 19.223 -10.784 12.048 1.00 20.06 C ANISOU 1909 CA SER A 146 2393 2615 2614 -1158 631 -1124 C ATOM 1910 C SER A 146 20.123 -9.721 11.444 1.00 21.67 C ANISOU 1910 C SER A 146 2459 2953 2821 -1276 658 -1109 C ATOM 1911 O SER A 146 20.508 -8.751 12.112 1.00 21.91 O ANISOU 1911 O SER A 146 2173 3344 2807 -1315 624 -1158 O ATOM 1912 CB SER A 146 20.079 -11.694 12.929 1.00 22.16 C ANISOU 1912 CB SER A 146 2748 2843 2830 -1082 601 -1225 C ATOM 1913 OG SER A 146 19.280 -12.599 13.674 1.00 25.83 O ANISOU 1913 OG SER A 146 3244 3323 3247 -894 657 -1227 O ATOM 1914 H SER A 146 18.952 -12.324 10.842 1.00 21.02 H ATOM 1915 HA SER A 146 18.543 -10.348 12.603 1.00 24.07 H ATOM 1916 HB2 SER A 146 20.682 -12.200 12.364 1.00 26.60 H ATOM 1917 HB3 SER A 146 20.588 -11.145 13.546 1.00 26.60 H ATOM 1918 HG SER A 146 19.757 -13.077 14.139 1.00 31.00 H ATOM 1919 N PHE A 147 20.476 -9.934 10.183 1.00 23.68 N ANISOU 1919 N PHE A 147 2845 3097 3058 -1124 642 -854 N ATOM 1920 CA PHE A 147 21.236 -8.958 9.408 1.00 28.42 C ANISOU 1920 CA PHE A 147 3473 3707 3618 -813 671 -591 C ATOM 1921 C PHE A 147 20.734 -9.013 7.970 1.00 26.42 C ANISOU 1921 C PHE A 147 3071 3685 3285 -668 817 -571 C ATOM 1922 O PHE A 147 20.686 -10.084 7.370 1.00 27.02 O ANISOU 1922 O PHE A 147 2999 4018 3247 -645 926 -351 O ATOM 1923 CB PHE A 147 22.731 -9.267 9.461 1.00 37.98 C ANISOU 1923 CB PHE A 147 4729 4831 4871 -658 523 -344 C ATOM 1924 CG PHE A 147 23.598 -8.124 9.011 1.00 46.49 C ANISOU 1924 CG PHE A 147 5782 5959 5922 -383 351 -148 C ATOM 1925 CD1 PHE A 147 24.051 -7.177 9.920 1.00 56.08 C ANISOU 1925 CD1 PHE A 147 7014 7134 7161 -263 335 -48 C ATOM 1926 CD2 PHE A 147 23.954 -7.992 7.676 1.00 46.04 C ANISOU 1926 CD2 PHE A 147 5766 5864 5864 -232 221 -65 C ATOM 1927 CE1 PHE A 147 24.847 -6.120 9.504 1.00 57.75 C ANISOU 1927 CE1 PHE A 147 7251 7328 7363 -168 314 14 C ATOM 1928 CE2 PHE A 147 24.752 -6.937 7.255 1.00 43.20 C ANISOU 1928 CE2 PHE A 147 5431 5428 5555 -145 184 -12 C ATOM 1929 CZ PHE A 147 25.196 -6.004 8.167 1.00 53.49 C ANISOU 1929 CZ PHE A 147 6745 6786 6794 -131 201 44 C ATOM 1930 H PHE A 147 20.284 -10.649 9.745 1.00 28.42 H ATOM 1931 HA PHE A 147 21.084 -8.057 9.763 1.00 34.10 H ATOM 1932 HB2 PHE A 147 22.974 -9.482 10.375 1.00 45.57 H ATOM 1933 HB3 PHE A 147 22.915 -10.025 8.884 1.00 45.57 H ATOM 1934 HD1 PHE A 147 23.818 -7.252 10.817 1.00 67.30 H ATOM 1935 HD2 PHE A 147 23.657 -8.619 7.057 1.00 55.25 H ATOM 1936 HE1 PHE A 147 25.147 -5.491 10.120 1.00 69.30 H ATOM 1937 HE2 PHE A 147 24.986 -6.860 6.358 1.00 51.84 H ATOM 1938 HZ PHE A 147 25.731 -5.297 7.886 1.00 64.19 H ATOM 1939 N GLY A 148 20.354 -7.864 7.424 1.00 25.27 N ANISOU 1939 N GLY A 148 2977 3442 3185 -461 837 -757 N ATOM 1940 CA GLY A 148 19.698 -7.818 6.130 1.00 24.27 C ANISOU 1940 CA GLY A 148 2892 3238 3092 -543 777 -858 C ATOM 1941 C GLY A 148 18.235 -7.456 6.292 1.00 21.73 C ANISOU 1941 C GLY A 148 2483 3030 2741 -614 758 -893 C ATOM 1942 O GLY A 148 17.805 -7.030 7.370 1.00 21.87 O ANISOU 1942 O GLY A 148 2343 3214 2752 -946 851 -1066 O ATOM 1943 H GLY A 148 20.467 -7.093 7.788 1.00 30.33 H ATOM 1944 HA2 GLY A 148 20.126 -7.154 5.567 1.00 29.13 H ATOM 1945 HA3 GLY A 148 19.761 -8.684 5.698 1.00 29.13 H ATOM 1946 N ALA A 149 17.476 -7.630 5.215 1.00 19.74 N ANISOU 1946 N ALA A 149 2398 2586 2517 -606 883 -717 N ATOM 1947 CA ALA A 149 16.077 -7.232 5.169 1.00 18.32 C ANISOU 1947 CA ALA A 149 2290 2366 2307 -842 793 -580 C ATOM 1948 C ALA A 149 15.322 -8.237 4.320 1.00 16.24 C ANISOU 1948 C ALA A 149 2276 2071 1822 -872 797 -317 C ATOM 1949 O ALA A 149 15.262 -8.115 3.102 1.00 17.01 O ANISOU 1949 O ALA A 149 2662 2185 1615 -1080 871 -145 O ATOM 1950 CB ALA A 149 15.936 -5.831 4.571 1.00 23.15 C ANISOU 1950 CB ALA A 149 2911 2924 2962 -857 834 -604 C ATOM 1951 H ALA A 149 17.757 -7.985 4.484 1.00 23.69 H ATOM 1952 HA ALA A 149 15.700 -7.232 6.073 1.00 21.99 H ATOM 1953 HB1 ALA A 149 15.007 -5.592 4.551 1.00 27.78 H ATOM 1954 HB2 ALA A 149 16.423 -5.209 5.116 1.00 27.78 H ATOM 1955 HB3 ALA A 149 16.293 -5.835 3.680 1.00 27.78 H ATOM 1956 N ASP A 150 14.782 -9.261 4.956 1.00 11.95 N ANISOU 1956 N ASP A 150 1547 1505 1490 -639 580 -85 N ATOM 1957 CA ASP A 150 13.969 -10.230 4.230 1.00 10.27 C ANISOU 1957 CA ASP A 150 1309 1279 1312 -148 433 37 C ATOM 1958 C ASP A 150 12.581 -10.213 4.860 1.00 8.06 C ANISOU 1958 C ASP A 150 942 1061 1061 48 223 -58 C ATOM 1959 O ASP A 150 12.300 -10.921 5.826 1.00 7.35 O ANISOU 1959 O ASP A 150 970 990 832 88 126 -175 O ATOM 1960 CB ASP A 150 14.614 -11.620 4.259 1.00 12.40 C ANISOU 1960 CB ASP A 150 1605 1505 1601 109 400 158 C ATOM 1961 CG ASP A 150 13.849 -12.649 3.447 1.00 14.28 C ANISOU 1961 CG ASP A 150 2086 1669 1669 415 443 50 C ATOM 1962 OD1 ASP A 150 12.692 -12.394 3.039 1.00 14.24 O ANISOU 1962 OD1 ASP A 150 2033 1568 1808 96 369 -52 O ATOM 1963 OD2 ASP A 150 14.416 -13.738 3.209 1.00 16.39 O ANISOU 1963 OD2 ASP A 150 2578 1975 1673 407 530 -53 O ATOM 1964 H ASP A 150 14.866 -9.420 5.797 1.00 14.34 H ATOM 1965 HA ASP A 150 13.886 -9.949 3.295 1.00 12.32 H ATOM 1966 HB2 ASP A 150 15.511 -11.559 3.895 1.00 14.88 H ATOM 1967 HB3 ASP A 150 14.650 -11.932 5.177 1.00 14.88 H ATOM 1968 N TYR A 151 11.727 -9.351 4.336 1.00 7.39 N ANISOU 1968 N TYR A 151 971 858 977 444 202 -15 N ATOM 1969 CA TYR A 151 10.367 -9.220 4.861 1.00 8.78 C ANISOU 1969 CA TYR A 151 1141 1154 1043 332 189 12 C ATOM 1970 C TYR A 151 9.453 -10.196 4.102 1.00 8.82 C ANISOU 1970 C TYR A 151 1178 1248 924 170 174 31 C ATOM 1971 O TYR A 151 9.349 -10.142 2.865 1.00 10.86 O ANISOU 1971 O TYR A 151 1622 1678 828 -108 164 89 O ATOM 1972 CB TYR A 151 9.922 -7.742 4.795 1.00 9.82 C ANISOU 1972 CB TYR A 151 1281 1258 1191 292 169 -42 C ATOM 1973 CG TYR A 151 10.669 -6.885 5.792 1.00 10.39 C ANISOU 1973 CG TYR A 151 1317 1319 1311 363 141 -133 C ATOM 1974 CD1 TYR A 151 10.213 -6.759 7.101 1.00 10.51 C ANISOU 1974 CD1 TYR A 151 1389 1217 1390 460 190 -145 C ATOM 1975 CD2 TYR A 151 11.851 -6.250 5.447 1.00 11.29 C ANISOU 1975 CD2 TYR A 151 1486 1390 1414 264 265 -308 C ATOM 1976 CE1 TYR A 151 10.909 -6.031 8.042 1.00 11.32 C ANISOU 1976 CE1 TYR A 151 1500 1300 1500 626 165 -126 C ATOM 1977 CE2 TYR A 151 12.554 -5.495 6.376 1.00 11.30 C ANISOU 1977 CE2 TYR A 151 1421 1415 1459 437 178 -365 C ATOM 1978 CZ TYR A 151 12.074 -5.395 7.683 1.00 12.01 C ANISOU 1978 CZ TYR A 151 1586 1395 1584 529 173 -316 C ATOM 1979 OH TYR A 151 12.752 -4.671 8.637 1.00 14.07 O ANISOU 1979 OH TYR A 151 1870 1602 1875 413 60 -333 O ATOM 1980 H TYR A 151 11.903 -8.828 3.676 1.00 8.86 H ATOM 1981 HA TYR A 151 10.368 -9.487 5.804 1.00 10.54 H ATOM 1982 HB2 TYR A 151 10.097 -7.396 3.906 1.00 11.78 H ATOM 1983 HB3 TYR A 151 8.974 -7.685 4.996 1.00 11.78 H ATOM 1984 HD1 TYR A 151 9.434 -7.199 7.354 1.00 12.62 H ATOM 1985 HD2 TYR A 151 12.176 -6.327 4.579 1.00 13.55 H ATOM 1986 HE1 TYR A 151 10.584 -5.958 8.910 1.00 13.58 H ATOM 1987 HE2 TYR A 151 13.347 -5.073 6.134 1.00 13.56 H ATOM 1988 HH TYR A 151 12.809 -3.887 8.406 1.00 16.89 H ATOM 1989 N PRO A 152 8.830 -11.133 4.825 1.00 7.40 N ANISOU 1989 N PRO A 152 933 966 912 116 172 -10 N ATOM 1990 CA PRO A 152 8.133 -12.245 4.166 1.00 9.59 C ANISOU 1990 CA PRO A 152 1235 1250 1160 66 262 26 C ATOM 1991 C PRO A 152 6.728 -11.899 3.690 1.00 8.38 C ANISOU 1991 C PRO A 152 1073 1078 1032 46 129 27 C ATOM 1992 O PRO A 152 6.079 -11.049 4.277 1.00 9.53 O ANISOU 1992 O PRO A 152 1206 1424 991 157 52 -3 O ATOM 1993 CB PRO A 152 8.046 -13.295 5.274 1.00 9.68 C ANISOU 1993 CB PRO A 152 1269 1197 1212 77 238 -13 C ATOM 1994 CG PRO A 152 7.914 -12.471 6.528 1.00 9.33 C ANISOU 1994 CG PRO A 152 1217 1163 1166 31 194 1 C ATOM 1995 CD PRO A 152 8.786 -11.245 6.296 1.00 7.98 C ANISOU 1995 CD PRO A 152 990 1028 1015 138 81 39 C ATOM 1996 HA PRO A 152 8.662 -12.595 3.419 1.00 11.51 H ATOM 1997 HB2 PRO A 152 7.264 -13.853 5.140 1.00 11.61 H ATOM 1998 HB3 PRO A 152 8.856 -13.827 5.291 1.00 11.61 H ATOM 1999 HG2 PRO A 152 6.987 -12.214 6.654 1.00 11.20 H ATOM 2000 HG3 PRO A 152 8.235 -12.981 7.288 1.00 11.20 H ATOM 2001 HD2 PRO A 152 8.372 -10.457 6.683 1.00 9.58 H ATOM 2002 HD3 PRO A 152 9.676 -11.390 6.651 1.00 9.58 H ATOM 2003 N ASP A 153 6.268 -12.563 2.638 1.00 8.42 N ANISOU 2003 N ASP A 153 1129 952 1119 -177 78 -180 N ATOM 2004 CA ASP A 153 4.901 -12.412 2.182 1.00 10.41 C ANISOU 2004 CA ASP A 153 1363 1308 1283 -201 81 -241 C ATOM 2005 C ASP A 153 3.946 -13.161 3.123 1.00 8.76 C ANISOU 2005 C ASP A 153 1288 1041 998 -90 75 -232 C ATOM 2006 O ASP A 153 2.854 -12.682 3.401 1.00 8.14 O ANISOU 2006 O ASP A 153 1355 902 836 -5 -86 -78 O ATOM 2007 CB ASP A 153 4.732 -12.971 0.755 1.00 13.27 C ANISOU 2007 CB ASP A 153 1638 1865 1540 -149 132 -198 C ATOM 2008 CG ASP A 153 5.541 -12.200 -0.292 1.00 17.40 C ANISOU 2008 CG ASP A 153 2136 2763 1713 -321 224 -73 C ATOM 2009 OD1 ASP A 153 6.024 -11.082 -0.017 1.00 18.12 O ANISOU 2009 OD1 ASP A 153 2223 2867 1793 -521 105 263 O ATOM 2010 OD2 ASP A 153 5.683 -12.726 -1.413 1.00 19.80 O ANISOU 2010 OD2 ASP A 153 2312 3448 1763 -257 524 54 O ATOM 2011 H ASP A 153 6.735 -13.113 2.169 1.00 10.10 H ATOM 2012 HA ASP A 153 4.658 -11.463 2.178 1.00 12.49 H ATOM 2013 HB2 ASP A 153 5.029 -13.895 0.741 1.00 15.93 H ATOM 2014 HB3 ASP A 153 3.796 -12.921 0.505 1.00 15.93 H ATOM 2015 N GLU A 154 4.367 -14.335 3.601 1.00 8.67 N ANISOU 2015 N GLU A 154 1192 1064 1040 31 134 -325 N ATOM 2016 CA GLU A 154 3.515 -15.195 4.425 1.00 7.51 C ANISOU 2016 CA GLU A 154 1026 879 949 35 -42 -304 C ATOM 2017 C GLU A 154 3.793 -15.046 5.916 1.00 5.92 C ANISOU 2017 C GLU A 154 785 710 755 41 -75 -133 C ATOM 2018 O GLU A 154 4.926 -14.872 6.327 1.00 7.25 O ANISOU 2018 O GLU A 154 936 1062 756 -19 -47 -29 O ATOM 2019 CB GLU A 154 3.695 -16.672 4.042 1.00 10.69 C ANISOU 2019 CB GLU A 154 1429 1325 1308 21 -18 -425 C ATOM 2020 CG GLU A 154 3.290 -16.992 2.597 1.00 15.92 C ANISOU 2020 CG GLU A 154 2073 2052 1924 46 79 -443 C ATOM 2021 CD GLU A 154 3.473 -18.452 2.266 1.00 20.73 C ANISOU 2021 CD GLU A 154 2766 2720 2390 89 330 -380 C ATOM 2022 OE1 GLU A 154 4.542 -18.807 1.748 1.00 23.81 O ANISOU 2022 OE1 GLU A 154 3341 2997 2709 253 509 -304 O ATOM 2023 OE2 GLU A 154 2.564 -19.253 2.542 1.00 23.38 O ANISOU 2023 OE2 GLU A 154 3190 3123 2570 11 289 -471 O ATOM 2024 H GLU A 154 5.151 -14.658 3.460 1.00 10.41 H ATOM 2025 HA GLU A 154 2.577 -14.956 4.268 1.00 9.01 H ATOM 2026 HB2 GLU A 154 4.630 -16.910 4.147 1.00 12.83 H ATOM 2027 HB3 GLU A 154 3.150 -17.216 4.631 1.00 12.83 H ATOM 2028 HG2 GLU A 154 2.354 -16.770 2.473 1.00 19.11 H ATOM 2029 HG3 GLU A 154 3.840 -16.473 1.990 1.00 19.11 H ATOM 2030 N LEU A 155 2.737 -15.195 6.707 1.00 5.72 N ANISOU 2030 N LEU A 155 711 742 719 115 53 -68 N ATOM 2031 CA LEU A 155 2.801 -15.074 8.164 1.00 6.90 C ANISOU 2031 CA LEU A 155 899 885 838 119 -15 -86 C ATOM 2032 C LEU A 155 3.746 -16.116 8.779 1.00 6.73 C ANISOU 2032 C LEU A 155 1019 732 805 157 135 33 C ATOM 2033 O LEU A 155 3.638 -17.310 8.468 1.00 6.70 O ANISOU 2033 O LEU A 155 1122 661 762 171 235 -24 O ATOM 2034 CB LEU A 155 1.395 -15.254 8.752 1.00 5.94 C ANISOU 2034 CB LEU A 155 738 724 795 112 -139 -202 C ATOM 2035 CG LEU A 155 1.301 -15.072 10.265 1.00 5.44 C ANISOU 2035 CG LEU A 155 702 585 779 51 -193 -180 C ATOM 2036 CD1 LEU A 155 1.699 -13.651 10.703 1.00 7.38 C ANISOU 2036 CD1 LEU A 155 960 883 962 121 -191 -9 C ATOM 2037 CD2 LEU A 155 -0.089 -15.393 10.744 1.00 7.79 C ANISOU 2037 CD2 LEU A 155 969 962 1028 -83 -254 -367 C ATOM 2038 H LEU A 155 1.948 -15.372 6.416 1.00 6.86 H ATOM 2039 HA LEU A 155 3.126 -14.181 8.404 1.00 8.28 H ATOM 2040 HB2 LEU A 155 0.804 -14.603 8.342 1.00 7.13 H ATOM 2041 HB3 LEU A 155 1.086 -16.149 8.545 1.00 7.13 H ATOM 2042 HG LEU A 155 1.911 -15.694 10.691 1.00 6.52 H ATOM 2043 HD11 LEU A 155 1.624 -13.587 11.658 1.00 8.86 H ATOM 2044 HD12 LEU A 155 2.604 -13.483 10.433 1.00 8.86 H ATOM 2045 HD13 LEU A 155 1.109 -13.019 10.284 1.00 8.86 H ATOM 2046 HD21 LEU A 155 -0.126 -15.273 11.695 1.00 9.35 H ATOM 2047 HD22 LEU A 155 -0.711 -14.802 10.314 1.00 9.35 H ATOM 2048 HD23 LEU A 155 -0.294 -16.304 10.520 1.00 9.35 H ATOM 2049 N LYS A 156 4.656 -15.645 9.642 1.00 6.18 N ANISOU 2049 N LYS A 156 917 665 765 110 141 47 N ATOM 2050 CA LYS A 156 5.632 -16.497 10.327 1.00 6.25 C ANISOU 2050 CA LYS A 156 888 704 783 57 222 -65 C ATOM 2051 C LYS A 156 5.311 -16.712 11.812 1.00 4.95 C ANISOU 2051 C LYS A 156 721 451 708 -12 196 -142 C ATOM 2052 O LYS A 156 4.702 -15.858 12.468 1.00 5.65 O ANISOU 2052 O LYS A 156 781 590 778 -114 244 -181 O ATOM 2053 CB LYS A 156 7.046 -15.923 10.200 1.00 6.69 C ANISOU 2053 CB LYS A 156 861 840 840 -12 362 29 C ATOM 2054 CG LYS A 156 7.536 -15.754 8.768 1.00 9.58 C ANISOU 2054 CG LYS A 156 1247 1159 1235 -102 592 -139 C ATOM 2055 CD LYS A 156 7.647 -17.120 8.086 1.00 17.10 C ANISOU 2055 CD LYS A 156 2197 2095 2205 -277 915 -369 C ATOM 2056 CE LYS A 156 8.085 -17.002 6.651 1.00 29.02 C ANISOU 2056 CE LYS A 156 3710 3607 3711 -503 1167 -476 C ATOM 2057 NZ LYS A 156 8.794 -18.243 6.251 1.00 34.28 N ANISOU 2057 NZ LYS A 156 4300 4332 4394 -641 1261 -607 N ATOM 2058 H LYS A 156 4.728 -14.814 9.850 1.00 7.41 H ATOM 2059 HA LYS A 156 5.631 -17.377 9.896 1.00 7.50 H ATOM 2060 HB2 LYS A 156 7.066 -15.050 10.623 1.00 8.02 H ATOM 2061 HB3 LYS A 156 7.664 -16.519 10.653 1.00 8.02 H ATOM 2062 HG2 LYS A 156 6.904 -15.211 8.271 1.00 11.50 H ATOM 2063 HG3 LYS A 156 8.412 -15.338 8.771 1.00 11.50 H ATOM 2064 HD2 LYS A 156 8.301 -17.659 8.558 1.00 20.52 H ATOM 2065 HD3 LYS A 156 6.780 -17.555 8.103 1.00 20.52 H ATOM 2066 HE2 LYS A 156 7.309 -16.890 6.081 1.00 34.83 H ATOM 2067 HE3 LYS A 156 8.692 -16.252 6.555 1.00 34.83 H ATOM 2068 HZ1 LYS A 156 9.078 -18.178 5.336 1.00 41.14 H ATOM 2069 HZ2 LYS A 156 9.565 -18.375 6.808 1.00 41.14 H ATOM 2070 HZ3 LYS A 156 8.209 -18.999 6.343 1.00 41.14 H ATOM 2071 N CYS A 157 5.771 -17.855 12.319 1.00 4.55 N ANISOU 2071 N CYS A 157 697 401 630 115 74 -70 N ATOM 2072 CA CYS A 157 5.476 -18.376 13.653 1.00 6.23 C ANISOU 2072 CA CYS A 157 821 726 819 105 110 -74 C ATOM 2073 C CYS A 157 6.781 -18.792 14.340 1.00 6.19 C ANISOU 2073 C CYS A 157 778 774 801 98 178 -76 C ATOM 2074 O CYS A 157 7.723 -19.242 13.682 1.00 6.57 O ANISOU 2074 O CYS A 157 779 932 784 84 94 -43 O ATOM 2075 CB CYS A 157 4.543 -19.613 13.561 1.00 7.51 C ANISOU 2075 CB CYS A 157 946 947 961 182 61 60 C ATOM 2076 SG CYS A 157 2.774 -19.236 13.498 1.00 9.09 S ANISOU 2076 SG CYS A 157 1164 1148 1144 -12 60 32 S ATOM 2077 H CYS A 157 6.290 -18.378 11.876 1.00 5.46 H ATOM 2078 HA CYS A 157 5.037 -17.686 14.193 1.00 7.47 H ATOM 2079 HB2 CYS A 157 4.765 -20.107 12.757 1.00 9.02 H ATOM 2080 HB3 CYS A 157 4.695 -20.172 14.339 1.00 9.02 H ATOM 2081 N LEU A 158 6.810 -18.668 15.667 1.00 6.34 N ANISOU 2081 N LEU A 158 872 719 818 145 247 -83 N ATOM 2082 CA LEU A 158 7.946 -19.101 16.482 1.00 5.98 C ANISOU 2082 CA LEU A 158 791 682 800 8 361 -115 C ATOM 2083 C LEU A 158 7.435 -19.630 17.815 1.00 5.38 C ANISOU 2083 C LEU A 158 747 563 733 6 342 -68 C ATOM 2084 O LEU A 158 6.667 -18.938 18.520 1.00 6.34 O ANISOU 2084 O LEU A 158 954 673 782 134 348 74 O ATOM 2085 CB LEU A 158 8.934 -17.947 16.729 1.00 6.72 C ANISOU 2085 CB LEU A 158 841 852 860 -76 313 -139 C ATOM 2086 CG LEU A 158 10.134 -18.238 17.648 1.00 6.96 C ANISOU 2086 CG LEU A 158 887 811 945 -165 101 -262 C ATOM 2087 CD1 LEU A 158 11.103 -19.158 16.935 1.00 9.89 C ANISOU 2087 CD1 LEU A 158 1213 1252 1292 -160 50 -277 C ATOM 2088 CD2 LEU A 158 10.874 -16.947 18.055 1.00 7.33 C ANISOU 2088 CD2 LEU A 158 959 850 976 -16 71 -158 C ATOM 2089 H LEU A 158 6.169 -18.328 16.128 1.00 7.61 H ATOM 2090 HA LEU A 158 8.421 -19.825 16.022 1.00 7.18 H ATOM 2091 HB2 LEU A 158 9.292 -17.668 15.872 1.00 8.06 H ATOM 2092 HB3 LEU A 158 8.444 -17.210 17.125 1.00 8.06 H ATOM 2093 HG LEU A 158 9.825 -18.682 18.453 1.00 8.35 H ATOM 2094 HD11 LEU A 158 11.848 -19.335 17.513 1.00 11.87 H ATOM 2095 HD12 LEU A 158 10.653 -19.978 16.719 1.00 11.87 H ATOM 2096 HD13 LEU A 158 11.406 -18.730 16.131 1.00 11.87 H ATOM 2097 HD21 LEU A 158 11.611 -17.177 18.625 1.00 8.79 H ATOM 2098 HD22 LEU A 158 11.195 -16.509 17.264 1.00 8.79 H ATOM 2099 HD23 LEU A 158 10.263 -16.373 18.524 1.00 8.79 H ATOM 2100 N ASP A 159 7.843 -20.848 18.148 1.00 6.12 N ANISOU 2100 N ASP A 159 881 630 817 191 228 -44 N ATOM 2101 CA AASP A 159 7.579 -21.453 19.453 0.51 8.67 C ANISOU 2101 CA AASP A 159 1228 921 1147 232 181 -48 C ATOM 2102 CA BASP A 159 7.552 -21.384 19.469 0.49 6.29 C ANISOU 2102 CA BASP A 159 1039 489 864 251 173 4 C ATOM 2103 C ASP A 159 8.722 -21.053 20.390 1.00 7.09 C ANISOU 2103 C ASP A 159 1084 635 975 305 202 -11 C ATOM 2104 O ASP A 159 9.891 -21.336 20.096 1.00 8.47 O ANISOU 2104 O ASP A 159 1200 1008 1011 203 71 -113 O ATOM 2105 CB AASP A 159 7.550 -22.992 19.351 0.51 9.11 C ANISOU 2105 CB AASP A 159 1211 1002 1247 117 134 -76 C ATOM 2106 CB BASP A 159 7.260 -22.888 19.404 0.49 7.54 C ANISOU 2106 CB BASP A 159 1243 678 945 151 76 81 C ATOM 2107 CG AASP A 159 6.624 -23.520 18.240 0.51 9.56 C ANISOU 2107 CG AASP A 159 1270 900 1464 140 81 -173 C ATOM 2108 CG BASP A 159 5.986 -23.201 18.619 0.49 8.42 C ANISOU 2108 CG BASP A 159 1366 802 1030 178 -25 101 C ATOM 2109 OD1AASP A 159 5.677 -22.812 17.813 0.51 8.80 O ANISOU 2109 OD1AASP A 159 1033 778 1532 116 153 -58 O ATOM 2110 OD1BASP A 159 4.877 -22.893 19.123 0.49 8.95 O ANISOU 2110 OD1BASP A 159 1420 947 1033 128 -69 236 O ATOM 2111 OD2AASP A 159 6.847 -24.676 17.797 0.51 10.80 O ANISOU 2111 OD2AASP A 159 1460 1047 1596 56 -84 -283 O ATOM 2112 OD2BASP A 159 6.091 -23.733 17.487 0.49 8.83 O ANISOU 2112 OD2BASP A 159 1474 773 1108 226 -158 0 O ATOM 2113 H AASP A 159 8.288 -21.361 17.620 1.00 7.35 H ATOM 2114 HA AASP A 159 6.728 -21.131 19.817 0.51 10.41 H ATOM 2115 HB2AASP A 159 8.447 -23.311 19.167 0.51 10.93 H ATOM 2116 HB3AASP A 159 7.238 -23.356 20.195 0.51 10.93 H ATOM 2117 N ALA A 160 8.410 -20.414 21.505 1.00 6.37 N ANISOU 2117 N ALA A 160 853 780 785 174 298 -84 N ATOM 2118 CA ALA A 160 9.454 -19.912 22.406 1.00 7.17 C ANISOU 2118 CA ALA A 160 912 891 922 156 216 -165 C ATOM 2119 C ALA A 160 8.985 -19.877 23.862 1.00 6.39 C ANISOU 2119 C ALA A 160 859 694 877 120 211 -27 C ATOM 2120 O ALA A 160 7.822 -19.630 24.128 1.00 6.48 O ANISOU 2120 O ALA A 160 1020 592 850 60 309 -50 O ATOM 2121 CB ALA A 160 9.878 -18.522 21.975 1.00 9.90 C ANISOU 2121 CB ALA A 160 1264 1268 1229 18 201 -196 C ATOM 2122 H ALA A 160 7.607 -20.255 21.768 1.00 7.64 H ATOM 2123 HA ALA A 160 10.235 -20.501 22.351 1.00 8.60 H ATOM 2124 HB1 ALA A 160 10.561 -18.206 22.572 1.00 11.88 H ATOM 2125 HB2 ALA A 160 10.220 -18.564 21.079 1.00 11.88 H ATOM 2126 HB3 ALA A 160 9.117 -17.939 22.009 1.00 11.88 H ATOM 2127 N PRO A 161 9.914 -20.099 24.806 1.00 7.14 N ANISOU 2127 N PRO A 161 971 830 913 290 133 39 N ATOM 2128 CA PRO A 161 9.543 -20.122 26.224 1.00 6.24 C ANISOU 2128 CA PRO A 161 800 747 825 255 109 -38 C ATOM 2129 C PRO A 161 9.673 -18.781 26.955 1.00 5.55 C ANISOU 2129 C PRO A 161 709 697 705 162 117 62 C ATOM 2130 O PRO A 161 10.552 -17.978 26.650 1.00 5.39 O ANISOU 2130 O PRO A 161 743 656 649 85 171 194 O ATOM 2131 CB PRO A 161 10.538 -21.119 26.807 1.00 8.38 C ANISOU 2131 CB PRO A 161 1133 951 1099 338 144 -132 C ATOM 2132 CG PRO A 161 11.774 -20.914 25.997 1.00 9.24 C ANISOU 2132 CG PRO A 161 1206 1058 1246 381 21 35 C ATOM 2133 CD PRO A 161 11.309 -20.546 24.596 1.00 9.27 C ANISOU 2133 CD PRO A 161 1212 1152 1158 372 48 20 C ATOM 2134 HA PRO A 161 8.632 -20.467 26.334 1.00 7.49 H ATOM 2135 HB2 PRO A 161 10.699 -20.917 27.742 1.00 10.05 H ATOM 2136 HB3 PRO A 161 10.201 -22.023 26.701 1.00 10.05 H ATOM 2137 HG2 PRO A 161 12.296 -20.193 26.382 1.00 11.08 H ATOM 2138 HG3 PRO A 161 12.289 -21.736 25.979 1.00 11.08 H ATOM 2139 HD2 PRO A 161 11.847 -19.821 24.240 1.00 11.12 H ATOM 2140 HD3 PRO A 161 11.331 -21.324 24.017 1.00 11.12 H ATOM 2141 N VAL A 162 8.814 -18.574 27.947 1.00 5.55 N ANISOU 2141 N VAL A 162 788 568 754 222 144 -12 N ATOM 2142 CA VAL A 162 8.919 -17.436 28.851 1.00 6.39 C ANISOU 2142 CA VAL A 162 840 790 800 197 227 -71 C ATOM 2143 C VAL A 162 10.181 -17.558 29.693 1.00 5.67 C ANISOU 2143 C VAL A 162 784 654 715 181 147 0 C ATOM 2144 O VAL A 162 10.467 -18.627 30.250 1.00 6.54 O ANISOU 2144 O VAL A 162 937 839 710 215 21 83 O ATOM 2145 CB VAL A 162 7.673 -17.363 29.775 1.00 6.36 C ANISOU 2145 CB VAL A 162 763 824 829 153 249 -33 C ATOM 2146 CG1 VAL A 162 7.781 -16.196 30.762 1.00 6.50 C ANISOU 2146 CG1 VAL A 162 795 801 873 208 271 -63 C ATOM 2147 CG2 VAL A 162 6.393 -17.245 28.946 1.00 7.19 C ANISOU 2147 CG2 VAL A 162 897 864 971 188 225 -149 C ATOM 2148 H VAL A 162 8.149 -19.090 28.119 1.00 6.66 H ATOM 2149 HA VAL A 162 8.971 -16.607 28.330 1.00 7.67 H ATOM 2150 HB VAL A 162 7.618 -18.192 30.295 1.00 7.63 H ATOM 2151 HG11 VAL A 162 6.997 -16.182 31.315 1.00 7.80 H ATOM 2152 HG12 VAL A 162 8.563 -16.319 31.305 1.00 7.80 H ATOM 2153 HG13 VAL A 162 7.850 -15.376 30.269 1.00 7.80 H ATOM 2154 HG21 VAL A 162 5.640 -17.202 29.540 1.00 8.63 H ATOM 2155 HG22 VAL A 162 6.437 -16.447 28.415 1.00 8.63 H ATOM 2156 HG23 VAL A 162 6.317 -18.014 28.376 1.00 8.63 H ATOM 2157 N LEU A 163 10.962 -16.484 29.775 1.00 5.51 N ANISOU 2157 N LEU A 163 812 568 715 146 37 170 N ATOM 2158 CA LEU A 163 12.141 -16.467 30.651 1.00 7.26 C ANISOU 2158 CA LEU A 163 963 868 928 120 81 249 C ATOM 2159 C LEU A 163 11.783 -15.970 32.071 1.00 7.42 C ANISOU 2159 C LEU A 163 955 938 924 71 26 141 C ATOM 2160 O LEU A 163 10.783 -15.274 32.266 1.00 6.38 O ANISOU 2160 O LEU A 163 646 1038 738 -13 106 80 O ATOM 2161 CB LEU A 163 13.242 -15.598 30.036 1.00 9.01 C ANISOU 2161 CB LEU A 163 1129 1132 1161 76 108 312 C ATOM 2162 CG LEU A 163 13.689 -15.915 28.595 1.00 12.78 C ANISOU 2162 CG LEU A 163 1603 1548 1703 91 388 361 C ATOM 2163 CD1 LEU A 163 14.925 -15.107 28.269 1.00 16.76 C ANISOU 2163 CD1 LEU A 163 2112 2051 2206 114 412 424 C ATOM 2164 CD2 LEU A 163 13.947 -17.404 28.376 1.00 15.00 C ANISOU 2164 CD2 LEU A 163 1903 1897 1901 205 411 468 C ATOM 2165 H LEU A 163 10.835 -15.754 29.339 1.00 6.61 H ATOM 2166 HA LEU A 163 12.489 -17.380 30.732 1.00 8.71 H ATOM 2167 HB2 LEU A 163 12.934 -14.678 30.040 1.00 10.81 H ATOM 2168 HB3 LEU A 163 14.029 -15.670 30.598 1.00 10.81 H ATOM 2169 HG LEU A 163 12.987 -15.643 27.984 1.00 15.33 H ATOM 2170 HD11 LEU A 163 15.200 -15.306 27.371 1.00 20.12 H ATOM 2171 HD12 LEU A 163 14.716 -14.173 28.348 1.00 20.12 H ATOM 2172 HD13 LEU A 163 15.622 -15.340 28.886 1.00 20.12 H ATOM 2173 HD21 LEU A 163 14.220 -17.543 27.466 1.00 18.00 H ATOM 2174 HD22 LEU A 163 14.640 -17.693 28.974 1.00 18.00 H ATOM 2175 HD23 LEU A 163 13.138 -17.891 28.552 1.00 18.00 H ATOM 2176 N THR A 164 12.580 -16.349 33.066 1.00 7.68 N ANISOU 2176 N THR A 164 983 919 1016 -117 -182 15 N ATOM 2177 CA THR A 164 12.390 -15.810 34.411 1.00 8.46 C ANISOU 2177 CA THR A 164 1050 1045 1120 -221 -235 138 C ATOM 2178 C THR A 164 12.645 -14.311 34.370 1.00 8.12 C ANISOU 2178 C THR A 164 1013 1046 1028 38 -190 -28 C ATOM 2179 O THR A 164 13.416 -13.812 33.556 1.00 7.09 O ANISOU 2179 O THR A 164 955 992 746 150 -151 -24 O ATOM 2180 CB THR A 164 13.336 -16.431 35.440 1.00 9.48 C ANISOU 2180 CB THR A 164 1107 1236 1258 -310 -295 418 C ATOM 2181 OG1 THR A 164 14.699 -16.131 35.084 1.00 9.27 O ANISOU 2181 OG1 THR A 164 1099 1065 1356 -325 -520 536 O ATOM 2182 CG2 THR A 164 13.133 -17.949 35.524 1.00 11.42 C ANISOU 2182 CG2 THR A 164 1407 1441 1489 -164 -272 652 C ATOM 2183 H THR A 164 13.229 -16.908 32.992 1.00 9.21 H ATOM 2184 HA THR A 164 11.466 -15.964 34.701 1.00 10.15 H ATOM 2185 HB THR A 164 13.146 -16.053 36.313 1.00 11.37 H ATOM 2186 HG1 THR A 164 15.212 -16.462 35.632 1.00 11.12 H ATOM 2187 HG21 THR A 164 13.733 -18.324 36.173 1.00 13.70 H ATOM 2188 HG22 THR A 164 12.230 -18.144 35.784 1.00 13.70 H ATOM 2189 HG23 THR A 164 13.306 -18.351 34.670 1.00 13.70 H ATOM 2190 N GLN A 165 11.997 -13.575 35.252 1.00 9.43 N ANISOU 2190 N GLN A 165 1155 1223 1207 244 -88 46 N ATOM 2191 CA GLN A 165 12.256 -12.154 35.309 1.00 10.92 C ANISOU 2191 CA GLN A 165 1401 1325 1422 544 -29 70 C ATOM 2192 C GLN A 165 13.734 -11.882 35.666 1.00 9.05 C ANISOU 2192 C GLN A 165 1182 1133 1123 316 -148 81 C ATOM 2193 O GLN A 165 14.332 -10.925 35.171 1.00 8.58 O ANISOU 2193 O GLN A 165 1234 1076 951 413 -166 -26 O ATOM 2194 CB GLN A 165 11.298 -11.481 36.293 1.00 15.71 C ANISOU 2194 CB GLN A 165 2016 2007 1945 589 131 8 C ATOM 2195 CG GLN A 165 11.081 -9.994 36.012 1.00 16.51 C ANISOU 2195 CG GLN A 165 2155 2046 2074 1050 89 110 C ATOM 2196 CD GLN A 165 10.290 -9.676 34.701 1.00 16.47 C ANISOU 2196 CD GLN A 165 2112 2124 2021 1059 -1 243 C ATOM 2197 OE1 GLN A 165 10.092 -8.513 34.373 1.00 18.17 O ANISOU 2197 OE1 GLN A 165 2245 2465 2192 916 -44 401 O ATOM 2198 NE2 GLN A 165 9.832 -10.702 33.987 1.00 14.35 N ANISOU 2198 NE2 GLN A 165 1852 1854 1747 1167 -53 50 N ATOM 2199 H GLN A 165 11.416 -13.865 35.816 1.00 11.32 H ATOM 2200 HA GLN A 165 12.089 -11.769 34.423 1.00 13.10 H ATOM 2201 HB2 GLN A 165 10.436 -11.922 36.243 1.00 18.85 H ATOM 2202 HB3 GLN A 165 11.660 -11.565 37.189 1.00 18.85 H ATOM 2203 HG2 GLN A 165 10.587 -9.609 36.752 1.00 19.82 H ATOM 2204 HG3 GLN A 165 11.948 -9.564 35.941 1.00 19.82 H ATOM 2205 HE21 GLN A 165 9.393 -10.559 33.262 1.00 17.22 H ATOM 2206 HE22 GLN A 165 9.975 -11.507 34.252 1.00 17.22 H ATOM 2207 N ALA A 166 14.333 -12.722 36.511 1.00 8.71 N ANISOU 2207 N ALA A 166 1030 1109 1168 166 -244 228 N ATOM 2208 CA ALA A 166 15.742 -12.542 36.852 1.00 8.87 C ANISOU 2208 CA ALA A 166 1133 1068 1168 -10 -262 125 C ATOM 2209 C ALA A 166 16.654 -12.632 35.613 1.00 7.89 C ANISOU 2209 C ALA A 166 1010 883 1103 -25 -296 123 C ATOM 2210 O ALA A 166 17.578 -11.828 35.461 1.00 8.15 O ANISOU 2210 O ALA A 166 949 1007 1142 -102 -348 267 O ATOM 2211 CB ALA A 166 16.169 -13.536 37.899 1.00 10.05 C ANISOU 2211 CB ALA A 166 1280 1239 1301 -12 -203 59 C ATOM 2212 H ALA A 166 13.954 -13.392 36.894 1.00 10.45 H ATOM 2213 HA ALA A 166 15.855 -11.647 37.234 1.00 10.64 H ATOM 2214 HB1 ALA A 166 17.097 -13.394 38.103 1.00 12.06 H ATOM 2215 HB2 ALA A 166 15.637 -13.407 38.688 1.00 12.06 H ATOM 2216 HB3 ALA A 166 16.040 -14.424 37.558 1.00 12.06 H ATOM 2217 N GLU A 167 16.410 -13.608 34.739 1.00 7.51 N ANISOU 2217 N GLU A 167 983 840 1030 86 -334 71 N ATOM 2218 CA GLU A 167 17.208 -13.748 33.523 1.00 9.02 C ANISOU 2218 CA GLU A 167 1190 1021 1215 85 -211 -137 C ATOM 2219 C GLU A 167 16.942 -12.612 32.539 1.00 7.34 C ANISOU 2219 C GLU A 167 989 854 947 -52 -205 0 C ATOM 2220 O GLU A 167 17.854 -12.130 31.869 1.00 7.71 O ANISOU 2220 O GLU A 167 1108 947 876 -167 -235 9 O ATOM 2221 CB GLU A 167 16.935 -15.095 32.840 1.00 11.78 C ANISOU 2221 CB GLU A 167 1525 1401 1552 69 -47 -394 C ATOM 2222 CG GLU A 167 17.905 -15.386 31.732 1.00 16.26 C ANISOU 2222 CG GLU A 167 2147 1918 2112 104 101 -450 C ATOM 2223 CD GLU A 167 18.006 -16.869 31.444 1.00 18.77 C ANISOU 2223 CD GLU A 167 2420 2267 2444 115 155 -435 C ATOM 2224 OE1 GLU A 167 17.041 -17.426 30.872 1.00 18.56 O ANISOU 2224 OE1 GLU A 167 2289 2281 2481 36 211 -495 O ATOM 2225 OE2 GLU A 167 19.064 -17.467 31.787 1.00 20.93 O ANISOU 2225 OE2 GLU A 167 2847 2419 2689 169 236 -317 O ATOM 2226 H GLU A 167 15.790 -14.198 34.827 1.00 9.01 H ATOM 2227 HA GLU A 167 18.158 -13.720 33.763 1.00 10.82 H ATOM 2228 HB2 GLU A 167 17.008 -15.804 33.497 1.00 14.14 H ATOM 2229 HB3 GLU A 167 16.042 -15.083 32.461 1.00 14.14 H ATOM 2230 HG2 GLU A 167 17.609 -14.940 30.923 1.00 19.51 H ATOM 2231 HG3 GLU A 167 18.785 -15.067 31.987 1.00 19.51 H ATOM 2232 N CYS A 168 15.692 -12.166 32.487 1.00 6.15 N ANISOU 2232 N CYS A 168 760 751 826 33 -222 198 N ATOM 2233 CA CYS A 168 15.314 -11.040 31.644 1.00 6.61 C ANISOU 2233 CA CYS A 168 806 866 840 -18 -191 38 C ATOM 2234 C CYS A 168 16.094 -9.781 32.077 1.00 7.51 C ANISOU 2234 C CYS A 168 958 934 963 -175 -156 24 C ATOM 2235 O CYS A 168 16.739 -9.128 31.242 1.00 7.28 O ANISOU 2235 O CYS A 168 743 970 1054 -184 -169 -66 O ATOM 2236 CB CYS A 168 13.780 -10.843 31.692 1.00 7.56 C ANISOU 2236 CB CYS A 168 944 983 945 147 25 99 C ATOM 2237 SG CYS A 168 13.098 -9.601 30.563 1.00 7.79 S ANISOU 2237 SG CYS A 168 1065 881 1015 28 -146 66 S ATOM 2238 H CYS A 168 15.039 -12.501 32.936 1.00 7.38 H ATOM 2239 HA CYS A 168 15.561 -11.242 30.717 1.00 7.93 H ATOM 2240 HB2 CYS A 168 13.357 -11.690 31.479 1.00 9.07 H ATOM 2241 HB3 CYS A 168 13.535 -10.579 32.593 1.00 9.07 H ATOM 2242 N LYS A 169 16.100 -9.484 33.382 1.00 8.22 N ANISOU 2242 N LYS A 169 1074 982 1069 -275 -278 -14 N ATOM 2243 CA LYS A 169 16.818 -8.309 33.885 1.00 10.03 C ANISOU 2243 CA LYS A 169 1421 1124 1267 -260 -259 30 C ATOM 2244 C LYS A 169 18.332 -8.438 33.714 1.00 9.55 C ANISOU 2244 C LYS A 169 1524 959 1144 -361 -232 61 C ATOM 2245 O LYS A 169 19.029 -7.464 33.418 1.00 9.78 O ANISOU 2245 O LYS A 169 1711 908 1095 -467 -288 48 O ATOM 2246 CB LYS A 169 16.451 -8.057 35.354 1.00 12.23 C ANISOU 2246 CB LYS A 169 1622 1442 1583 -363 -186 6 C ATOM 2247 CG LYS A 169 14.976 -7.734 35.525 1.00 15.70 C ANISOU 2247 CG LYS A 169 2044 1898 2024 -385 -6 -2 C ATOM 2248 CD LYS A 169 14.625 -7.496 36.986 1.00 24.70 C ANISOU 2248 CD LYS A 169 3111 3094 3178 -224 74 103 C ATOM 2249 CE LYS A 169 13.361 -6.680 37.107 1.00 41.85 C ANISOU 2249 CE LYS A 169 5308 5297 5295 -154 60 121 C ATOM 2250 NZ LYS A 169 13.440 -5.452 36.286 0.00 48.72 N ANISOU 2250 NZ LYS A 169 6149 6145 6217 -122 52 121 N ATOM 2251 H LYS A 169 15.699 -9.942 33.989 1.00 9.87 H ATOM 2252 HA LYS A 169 16.531 -7.526 33.371 1.00 12.04 H ATOM 2253 HB2 LYS A 169 16.648 -8.852 35.873 1.00 14.68 H ATOM 2254 HB3 LYS A 169 16.965 -7.305 35.686 1.00 14.68 H ATOM 2255 HG2 LYS A 169 14.764 -6.929 35.027 1.00 18.84 H ATOM 2256 HG3 LYS A 169 14.445 -8.479 35.202 1.00 18.84 H ATOM 2257 HD2 LYS A 169 14.482 -8.349 37.427 1.00 29.63 H ATOM 2258 HD3 LYS A 169 15.346 -7.010 37.416 1.00 29.63 H ATOM 2259 HE2 LYS A 169 12.608 -7.207 36.798 1.00 50.22 H ATOM 2260 HE3 LYS A 169 13.234 -6.421 38.033 1.00 50.22 H ATOM 2261 HZ1 LYS A 169 12.629 -4.946 36.375 0.00 58.46 H ATOM 2262 HZ2 LYS A 169 14.179 -4.911 36.575 0.00 58.46 H ATOM 2263 HZ3 LYS A 169 13.564 -5.682 35.362 0.00 58.46 H ATOM 2264 N ALA A 170 18.855 -9.642 33.905 1.00 9.25 N ANISOU 2264 N ALA A 170 1367 957 1191 -178 -290 166 N ATOM 2265 CA ALA A 170 20.282 -9.886 33.717 1.00 9.52 C ANISOU 2265 CA ALA A 170 1276 1065 1277 -238 -345 247 C ATOM 2266 C ALA A 170 20.726 -9.649 32.264 1.00 8.98 C ANISOU 2266 C ALA A 170 1124 989 1297 -132 -370 70 C ATOM 2267 O ALA A 170 21.870 -9.248 32.011 1.00 9.87 O ANISOU 2267 O ALA A 170 1093 1216 1441 -283 -430 80 O ATOM 2268 CB ALA A 170 20.627 -11.307 34.144 1.00 11.18 C ANISOU 2268 CB ALA A 170 1391 1404 1454 -85 -422 268 C ATOM 2269 H ALA A 170 18.407 -10.336 34.143 1.00 11.10 H ATOM 2270 HA ALA A 170 20.786 -9.270 34.288 1.00 11.42 H ATOM 2271 HB1 ALA A 170 21.567 -11.452 34.015 1.00 13.42 H ATOM 2272 HB2 ALA A 170 20.402 -11.417 35.071 1.00 13.42 H ATOM 2273 HB3 ALA A 170 20.123 -11.925 33.609 1.00 13.42 H ATOM 2274 N SER A 171 19.822 -9.901 31.318 1.00 8.25 N ANISOU 2274 N SER A 171 975 947 1213 58 -486 45 N ATOM 2275 CA SER A 171 20.105 -9.749 29.893 1.00 8.36 C ANISOU 2275 CA SER A 171 954 1018 1203 -48 -348 -27 C ATOM 2276 C SER A 171 20.104 -8.281 29.482 1.00 7.84 C ANISOU 2276 C SER A 171 847 990 1143 -73 -180 -87 C ATOM 2277 O SER A 171 20.815 -7.891 28.552 1.00 7.38 O ANISOU 2277 O SER A 171 799 900 1106 37 179 -106 O ATOM 2278 CB SER A 171 19.074 -10.502 29.052 1.00 10.37 C ANISOU 2278 CB SER A 171 1332 1224 1385 -118 -360 -95 C ATOM 2279 OG SER A 171 19.131 -11.913 29.300 1.00 11.53 O ANISOU 2279 OG SER A 171 1607 1196 1578 -63 -476 -117 O ATOM 2280 H SER A 171 19.021 -10.166 31.481 1.00 9.90 H ATOM 2281 HA SER A 171 20.990 -10.121 29.699 1.00 10.03 H ATOM 2282 HB2 SER A 171 18.187 -10.178 29.277 1.00 12.44 H ATOM 2283 HB3 SER A 171 19.256 -10.340 28.113 1.00 12.44 H ATOM 2284 HG SER A 171 19.711 -12.076 29.856 1.00 13.84 H ATOM 2285 N TYR A 172 19.300 -7.478 30.175 1.00 6.87 N ANISOU 2285 N TYR A 172 779 806 1023 -233 -219 -155 N ATOM 2286 CA TYR A 172 19.167 -6.058 29.880 1.00 7.12 C ANISOU 2286 CA TYR A 172 860 848 997 -292 -259 -92 C ATOM 2287 C TYR A 172 19.203 -5.243 31.189 1.00 7.37 C ANISOU 2287 C TYR A 172 985 839 978 -202 -210 -109 C ATOM 2288 O TYR A 172 18.165 -4.732 31.655 1.00 6.95 O ANISOU 2288 O TYR A 172 934 800 908 -221 -232 -144 O ATOM 2289 CB TYR A 172 17.845 -5.790 29.164 1.00 8.31 C ANISOU 2289 CB TYR A 172 1021 1037 1099 -169 -236 36 C ATOM 2290 CG TYR A 172 17.696 -6.402 27.792 1.00 7.22 C ANISOU 2290 CG TYR A 172 800 959 986 -250 -274 11 C ATOM 2291 CD1 TYR A 172 18.372 -5.867 26.691 1.00 8.58 C ANISOU 2291 CD1 TYR A 172 1124 1064 1071 -428 -238 -52 C ATOM 2292 CD2 TYR A 172 16.889 -7.510 27.585 1.00 6.65 C ANISOU 2292 CD2 TYR A 172 780 823 924 -234 -151 66 C ATOM 2293 CE1 TYR A 172 18.232 -6.422 25.421 1.00 8.02 C ANISOU 2293 CE1 TYR A 172 1039 1001 1007 -234 -192 -8 C ATOM 2294 CE2 TYR A 172 16.724 -8.054 26.312 1.00 6.72 C ANISOU 2294 CE2 TYR A 172 749 840 963 -162 -223 10 C ATOM 2295 CZ TYR A 172 17.402 -7.498 25.236 1.00 7.02 C ANISOU 2295 CZ TYR A 172 896 860 912 -88 -172 -13 C ATOM 2296 OH TYR A 172 17.256 -8.008 23.962 1.00 7.39 O ANISOU 2296 OH TYR A 172 884 911 1011 -92 -82 -85 O ATOM 2297 H TYR A 172 18.812 -7.740 30.833 1.00 8.24 H ATOM 2298 HA TYR A 172 19.904 -5.766 29.304 1.00 8.54 H ATOM 2299 HB2 TYR A 172 17.125 -6.137 29.714 1.00 9.97 H ATOM 2300 HB3 TYR A 172 17.741 -4.831 29.065 1.00 9.97 H ATOM 2301 HD1 TYR A 172 18.924 -5.128 26.808 1.00 10.29 H ATOM 2302 HD2 TYR A 172 16.419 -7.873 28.301 1.00 7.98 H ATOM 2303 HE1 TYR A 172 18.674 -6.043 24.696 1.00 9.62 H ATOM 2304 HE2 TYR A 172 16.168 -8.789 26.186 1.00 8.06 H ATOM 2305 HH TYR A 172 16.471 -7.964 23.730 1.00 8.86 H ATOM 2306 N PRO A 173 20.392 -5.112 31.794 1.00 7.60 N ANISOU 2306 N PRO A 173 933 881 1075 -82 -318 -224 N ATOM 2307 CA PRO A 173 20.452 -4.551 33.154 1.00 8.23 C ANISOU 2307 CA PRO A 173 986 1013 1128 -123 -329 -278 C ATOM 2308 C PRO A 173 19.888 -3.140 33.250 1.00 8.16 C ANISOU 2308 C PRO A 173 973 944 1184 -431 -292 -254 C ATOM 2309 O PRO A 173 20.256 -2.274 32.460 1.00 7.62 O ANISOU 2309 O PRO A 173 832 906 1156 -395 -264 -12 O ATOM 2310 CB PRO A 173 21.951 -4.592 33.477 1.00 10.65 C ANISOU 2310 CB PRO A 173 1415 1282 1350 -168 -282 -427 C ATOM 2311 CG PRO A 173 22.443 -5.742 32.674 1.00 11.78 C ANISOU 2311 CG PRO A 173 1532 1407 1536 -73 -380 -382 C ATOM 2312 CD PRO A 173 21.704 -5.630 31.368 1.00 10.09 C ANISOU 2312 CD PRO A 173 1264 1234 1338 -73 -426 -298 C ATOM 2313 HA PRO A 173 19.972 -5.132 33.781 1.00 9.88 H ATOM 2314 HB2 PRO A 173 22.374 -3.765 33.196 1.00 12.78 H ATOM 2315 HB3 PRO A 173 22.082 -4.747 34.425 1.00 12.78 H ATOM 2316 HG2 PRO A 173 23.400 -5.661 32.537 1.00 14.13 H ATOM 2317 HG3 PRO A 173 22.227 -6.573 33.123 1.00 14.13 H ATOM 2318 HD2 PRO A 173 22.145 -4.998 30.779 1.00 12.11 H ATOM 2319 HD3 PRO A 173 21.609 -6.502 30.954 1.00 12.11 H ATOM 2320 N GLY A 174 18.970 -2.927 34.191 1.00 9.50 N ANISOU 2320 N GLY A 174 1257 1077 1278 -343 -239 -175 N ATOM 2321 CA GLY A 174 18.368 -1.617 34.421 1.00 9.50 C ANISOU 2321 CA GLY A 174 1190 1145 1275 -199 -334 -332 C ATOM 2322 C GLY A 174 17.207 -1.242 33.504 1.00 8.75 C ANISOU 2322 C GLY A 174 1085 1010 1229 25 -230 -273 C ATOM 2323 O GLY A 174 16.513 -0.256 33.765 1.00 9.47 O ANISOU 2323 O GLY A 174 1207 1035 1355 114 -142 -313 O ATOM 2324 H GLY A 174 18.675 -3.538 34.720 1.00 11.40 H ATOM 2325 HA2 GLY A 174 18.046 -1.579 35.335 1.00 11.40 H ATOM 2326 HA3 GLY A 174 19.054 -0.938 34.320 1.00 11.40 H ATOM 2327 N LYS A 175 16.986 -2.024 32.442 1.00 6.84 N ANISOU 2327 N LYS A 175 826 751 1020 -19 -235 -234 N ATOM 2328 CA LYS A 175 16.023 -1.666 31.394 1.00 6.32 C ANISOU 2328 CA LYS A 175 773 729 898 -114 -225 -173 C ATOM 2329 C LYS A 175 14.644 -2.305 31.474 1.00 7.07 C ANISOU 2329 C LYS A 175 909 798 978 -159 -211 -112 C ATOM 2330 O LYS A 175 13.721 -1.895 30.738 1.00 7.18 O ANISOU 2330 O LYS A 175 910 745 1072 -122 -259 -43 O ATOM 2331 CB LYS A 175 16.619 -2.009 30.034 1.00 7.38 C ANISOU 2331 CB LYS A 175 993 859 954 -177 -204 -234 C ATOM 2332 CG LYS A 175 17.824 -1.150 29.726 1.00 10.63 C ANISOU 2332 CG LYS A 175 1337 1343 1357 -119 -228 -205 C ATOM 2333 CD LYS A 175 18.501 -1.528 28.432 1.00 14.19 C ANISOU 2333 CD LYS A 175 1783 1808 1800 -114 -218 -104 C ATOM 2334 CE LYS A 175 19.635 -0.555 28.121 1.00 15.81 C ANISOU 2334 CE LYS A 175 2005 1954 2049 -76 -198 133 C ATOM 2335 NZ LYS A 175 19.077 0.721 27.590 1.00 19.35 N ANISOU 2335 NZ LYS A 175 2448 2385 2517 -65 -164 174 N ATOM 2336 H LYS A 175 17.385 -2.774 32.304 1.00 8.20 H ATOM 2337 HA LYS A 175 15.893 -0.695 31.419 1.00 7.58 H ATOM 2338 HB2 LYS A 175 16.899 -2.938 30.032 1.00 8.86 H ATOM 2339 HB3 LYS A 175 15.953 -1.858 29.345 1.00 8.86 H ATOM 2340 HG2 LYS A 175 17.542 -0.225 29.656 1.00 12.75 H ATOM 2341 HG3 LYS A 175 18.471 -1.247 30.442 1.00 12.75 H ATOM 2342 HD2 LYS A 175 18.874 -2.420 28.511 1.00 17.03 H ATOM 2343 HD3 LYS A 175 17.857 -1.492 27.708 1.00 17.03 H ATOM 2344 HE2 LYS A 175 20.130 -0.361 28.933 1.00 18.97 H ATOM 2345 HE3 LYS A 175 20.219 -0.940 27.450 1.00 18.97 H ATOM 2346 HZ1 LYS A 175 19.789 1.334 27.393 1.00 23.21 H ATOM 2347 HZ2 LYS A 175 18.580 0.552 26.785 1.00 23.21 H ATOM 2348 HZ3 LYS A 175 18.493 1.119 28.239 1.00 23.21 H ATOM 2349 N ILE A 176 14.497 -3.320 32.318 1.00 7.55 N ANISOU 2349 N ILE A 176 997 825 1045 -227 -157 -5 N ATOM 2350 CA ILE A 176 13.254 -4.087 32.348 1.00 7.07 C ANISOU 2350 CA ILE A 176 902 861 922 -65 -123 -14 C ATOM 2351 C ILE A 176 12.323 -3.526 33.446 1.00 7.77 C ANISOU 2351 C ILE A 176 1046 1043 864 35 -18 -38 C ATOM 2352 O ILE A 176 12.588 -3.674 34.659 1.00 8.87 O ANISOU 2352 O ILE A 176 1242 1330 797 37 -56 89 O ATOM 2353 CB ILE A 176 13.525 -5.596 32.589 1.00 7.60 C ANISOU 2353 CB ILE A 176 987 895 1005 40 -55 -46 C ATOM 2354 CG1 ILE A 176 14.462 -6.179 31.527 1.00 8.90 C ANISOU 2354 CG1 ILE A 176 1208 1015 1158 164 23 142 C ATOM 2355 CG2 ILE A 176 12.215 -6.385 32.623 1.00 8.80 C ANISOU 2355 CG2 ILE A 176 1067 1106 1169 103 0 -120 C ATOM 2356 CD1 ILE A 176 13.980 -6.012 30.084 1.00 10.31 C ANISOU 2356 CD1 ILE A 176 1364 1216 1336 144 100 205 C ATOM 2357 H ILE A 176 15.094 -3.585 32.878 1.00 9.05 H ATOM 2358 HA ILE A 176 12.799 -3.993 31.485 1.00 8.48 H ATOM 2359 HB ILE A 176 13.956 -5.690 33.453 1.00 9.12 H ATOM 2360 HG12 ILE A 176 15.324 -5.740 31.600 1.00 10.68 H ATOM 2361 HG13 ILE A 176 14.565 -7.129 31.693 1.00 10.68 H ATOM 2362 HG21 ILE A 176 12.413 -7.312 32.773 1.00 10.56 H ATOM 2363 HG22 ILE A 176 11.666 -6.047 33.334 1.00 10.56 H ATOM 2364 HG23 ILE A 176 11.765 -6.277 31.782 1.00 10.56 H ATOM 2365 HD11 ILE A 176 14.626 -6.404 29.492 1.00 12.37 H ATOM 2366 HD12 ILE A 176 13.133 -6.454 29.985 1.00 12.37 H ATOM 2367 HD13 ILE A 176 13.886 -5.076 29.893 1.00 12.37 H ATOM 2368 N THR A 177 11.250 -2.867 33.026 1.00 7.50 N ANISOU 2368 N THR A 177 934 1011 904 116 34 -133 N ATOM 2369 CA THR A 177 10.281 -2.316 33.967 1.00 7.86 C ANISOU 2369 CA THR A 177 950 1035 1002 141 -83 -141 C ATOM 2370 C THR A 177 9.208 -3.352 34.336 1.00 7.49 C ANISOU 2370 C THR A 177 919 967 960 133 -122 -136 C ATOM 2371 O THR A 177 9.174 -4.464 33.803 1.00 7.14 O ANISOU 2371 O THR A 177 932 919 862 89 -92 108 O ATOM 2372 CB THR A 177 9.552 -1.101 33.365 1.00 8.45 C ANISOU 2372 CB THR A 177 1042 1047 1122 112 -122 72 C ATOM 2373 OG1 THR A 177 8.651 -1.565 32.345 1.00 7.46 O ANISOU 2373 OG1 THR A 177 1002 874 959 -43 -163 85 O ATOM 2374 CG2 THR A 177 10.537 -0.076 32.783 1.00 11.14 C ANISOU 2374 CG2 THR A 177 1419 1369 1444 234 -66 111 C ATOM 2375 H THR A 177 11.059 -2.723 32.200 1.00 9.00 H ATOM 2376 HA THR A 177 10.740 -2.034 34.785 1.00 9.43 H ATOM 2377 HB THR A 177 9.041 -0.662 34.063 1.00 10.14 H ATOM 2378 HG1 THR A 177 8.253 -0.929 32.013 1.00 8.95 H ATOM 2379 HG21 THR A 177 10.055 0.669 32.416 1.00 13.37 H ATOM 2380 HG22 THR A 177 11.125 0.242 33.472 1.00 13.37 H ATOM 2381 HG23 THR A 177 11.060 -0.482 32.088 1.00 13.37 H ATOM 2382 N ASN A 178 8.293 -2.972 35.219 1.00 9.06 N ANISOU 2382 N ASN A 178 1123 1202 1117 65 -188 -334 N ATOM 2383 CA ASN A 178 7.227 -3.885 35.614 1.00 11.23 C ANISOU 2383 CA ASN A 178 1354 1461 1452 212 -210 -273 C ATOM 2384 C ASN A 178 6.243 -4.217 34.500 1.00 8.92 C ANISOU 2384 C ASN A 178 1095 1150 1143 264 -45 -122 C ATOM 2385 O ASN A 178 5.483 -5.165 34.643 1.00 8.70 O ANISOU 2385 O ASN A 178 1163 1073 1072 72 83 -4 O ATOM 2386 CB ASN A 178 6.464 -3.327 36.820 1.00 19.87 C ANISOU 2386 CB ASN A 178 2451 2565 2533 421 -398 -219 C ATOM 2387 CG ASN A 178 7.265 -3.414 38.106 1.00 37.39 C ANISOU 2387 CG ASN A 178 4712 4821 4672 422 -462 -210 C ATOM 2388 OD1 ASN A 178 8.173 -4.238 38.226 1.00 37.42 O ANISOU 2388 OD1 ASN A 178 4782 4816 4619 439 -502 -161 O ATOM 2389 ND2 ASN A 178 6.933 -2.565 39.075 1.00 55.10 N ANISOU 2389 ND2 ASN A 178 6952 7016 6968 417 -492 -223 N ATOM 2390 H ASN A 178 8.265 -2.202 35.600 1.00 10.87 H ATOM 2391 HA ASN A 178 7.638 -4.729 35.897 1.00 13.48 H ATOM 2392 HB2 ASN A 178 6.255 -2.393 36.658 1.00 23.84 H ATOM 2393 HB3 ASN A 178 5.646 -3.835 36.940 1.00 23.84 H ATOM 2394 HD21 ASN A 178 7.419 -2.578 39.926 1.00 66.12 H ATOM 2395 HD22 ASN A 178 6.203 -1.926 38.938 1.00 66.12 H ATOM 2396 N SER A 179 6.254 -3.458 33.399 1.00 6.96 N ANISOU 2396 N SER A 179 840 883 923 140 -32 -20 N ATOM 2397 CA SER A 179 5.370 -3.745 32.258 1.00 6.12 C ANISOU 2397 CA SER A 179 754 760 813 67 -16 -20 C ATOM 2398 C SER A 179 5.929 -4.788 31.270 1.00 6.12 C ANISOU 2398 C SER A 179 737 849 738 128 -39 7 C ATOM 2399 O SER A 179 5.253 -5.153 30.309 1.00 5.57 O ANISOU 2399 O SER A 179 700 704 712 78 -103 -191 O ATOM 2400 CB SER A 179 5.049 -2.456 31.487 1.00 6.26 C ANISOU 2400 CB SER A 179 785 766 829 21 48 116 C ATOM 2401 OG SER A 179 6.167 -2.022 30.729 1.00 6.38 O ANISOU 2401 OG SER A 179 794 729 900 19 125 163 O ATOM 2402 H SER A 179 6.762 -2.773 33.286 1.00 8.36 H ATOM 2403 HA SER A 179 4.524 -4.097 32.605 1.00 7.35 H ATOM 2404 HB2 SER A 179 4.307 -2.625 30.885 1.00 7.51 H ATOM 2405 HB3 SER A 179 4.809 -1.761 32.120 1.00 7.51 H ATOM 2406 HG SER A 179 5.981 -1.334 30.324 1.00 7.65 H ATOM 2407 N MET A 180 7.154 -5.250 31.508 1.00 6.08 N ANISOU 2407 N MET A 180 770 822 716 187 -15 76 N ATOM 2408 CA MET A 180 7.920 -6.014 30.533 1.00 6.15 C ANISOU 2408 CA MET A 180 832 743 764 18 -73 -26 C ATOM 2409 C MET A 180 8.245 -7.424 31.010 1.00 6.13 C ANISOU 2409 C MET A 180 798 718 814 46 26 -79 C ATOM 2410 O MET A 180 8.458 -7.650 32.214 1.00 7.33 O ANISOU 2410 O MET A 180 933 906 946 125 33 -148 O ATOM 2411 CB MET A 180 9.242 -5.306 30.282 1.00 5.83 C ANISOU 2411 CB MET A 180 766 724 724 -17 79 -128 C ATOM 2412 CG MET A 180 9.112 -3.904 29.689 1.00 5.97 C ANISOU 2412 CG MET A 180 844 699 725 -61 113 -46 C ATOM 2413 SD MET A 180 10.714 -3.102 29.546 1.00 5.54 S ANISOU 2413 SD MET A 180 782 571 751 -61 54 -4 S ATOM 2414 CE MET A 180 10.278 -1.418 29.199 1.00 6.21 C ANISOU 2414 CE MET A 180 863 708 787 -225 295 124 C ATOM 2415 H MET A 180 7.573 -5.128 32.249 1.00 7.29 H ATOM 2416 HA MET A 180 7.425 -6.059 29.689 1.00 7.38 H ATOM 2417 HB2 MET A 180 9.715 -5.225 31.125 1.00 6.99 H ATOM 2418 HB3 MET A 180 9.766 -5.839 29.664 1.00 6.99 H ATOM 2419 HG2 MET A 180 8.722 -3.966 28.803 1.00 7.16 H ATOM 2420 HG3 MET A 180 8.551 -3.363 30.266 1.00 7.16 H ATOM 2421 HE1 MET A 180 11.081 -0.901 29.104 1.00 7.45 H ATOM 2422 HE2 MET A 180 9.770 -1.389 28.385 1.00 7.45 H ATOM 2423 HE3 MET A 180 9.752 -1.076 29.926 1.00 7.45 H ATOM 2424 N PHE A 181 8.317 -8.355 30.060 1.00 5.88 N ANISOU 2424 N PHE A 181 746 731 756 -112 149 69 N ATOM 2425 CA PHE A 181 8.878 -9.686 30.299 1.00 4.50 C ANISOU 2425 CA PHE A 181 585 535 591 44 101 90 C ATOM 2426 C PHE A 181 9.579 -10.213 29.046 1.00 4.56 C ANISOU 2426 C PHE A 181 623 563 547 12 45 -88 C ATOM 2427 O PHE A 181 9.349 -9.702 27.942 1.00 4.91 O ANISOU 2427 O PHE A 181 638 623 605 91 111 -74 O ATOM 2428 CB PHE A 181 7.821 -10.676 30.833 1.00 5.74 C ANISOU 2428 CB PHE A 181 727 711 742 24 163 22 C ATOM 2429 CG PHE A 181 6.787 -11.146 29.832 1.00 5.26 C ANISOU 2429 CG PHE A 181 636 615 746 56 91 220 C ATOM 2430 CD1 PHE A 181 5.905 -10.275 29.222 1.00 5.48 C ANISOU 2430 CD1 PHE A 181 675 649 758 106 120 225 C ATOM 2431 CD2 PHE A 181 6.673 -12.500 29.550 1.00 6.04 C ANISOU 2431 CD2 PHE A 181 800 683 811 116 -53 151 C ATOM 2432 CE1 PHE A 181 4.933 -10.737 28.341 1.00 5.26 C ANISOU 2432 CE1 PHE A 181 644 595 759 43 40 162 C ATOM 2433 CE2 PHE A 181 5.702 -12.976 28.688 1.00 6.93 C ANISOU 2433 CE2 PHE A 181 851 822 961 -28 -89 199 C ATOM 2434 CZ PHE A 181 4.838 -12.085 28.059 1.00 6.46 C ANISOU 2434 CZ PHE A 181 746 806 904 -54 -60 249 C ATOM 2435 H PHE A 181 8.041 -8.238 29.254 1.00 7.05 H ATOM 2436 HA PHE A 181 9.564 -9.602 30.994 1.00 5.40 H ATOM 2437 HB2 PHE A 181 8.280 -11.464 31.166 1.00 6.88 H ATOM 2438 HB3 PHE A 181 7.344 -10.250 31.563 1.00 6.88 H ATOM 2439 HD1 PHE A 181 5.960 -9.365 29.406 1.00 6.57 H ATOM 2440 HD2 PHE A 181 7.244 -13.103 29.970 1.00 7.24 H ATOM 2441 HE1 PHE A 181 4.357 -10.135 27.927 1.00 6.31 H ATOM 2442 HE2 PHE A 181 5.652 -13.885 28.498 1.00 8.32 H ATOM 2443 HZ PHE A 181 4.194 -12.396 27.464 1.00 7.76 H ATOM 2444 N CYS A 182 10.459 -11.198 29.224 1.00 3.60 N ANISOU 2444 N CYS A 182 502 385 479 203 -52 -55 N ATOM 2445 CA CYS A 182 11.221 -11.752 28.113 1.00 4.76 C ANISOU 2445 CA CYS A 182 683 494 633 5 53 -87 C ATOM 2446 C CYS A 182 10.690 -13.126 27.698 1.00 4.32 C ANISOU 2446 C CYS A 182 704 367 570 -52 48 46 C ATOM 2447 O CYS A 182 10.261 -13.917 28.543 1.00 5.20 O ANISOU 2447 O CYS A 182 919 395 663 78 14 125 O ATOM 2448 CB CYS A 182 12.705 -11.865 28.481 1.00 5.41 C ANISOU 2448 CB CYS A 182 764 533 758 -59 130 -25 C ATOM 2449 SG CYS A 182 13.600 -10.298 28.690 1.00 7.56 S ANISOU 2449 SG CYS A 182 1038 824 1011 -94 112 36 S ATOM 2450 H CYS A 182 10.633 -11.562 29.984 1.00 4.31 H ATOM 2451 HA CYS A 182 11.144 -11.152 27.343 1.00 5.71 H ATOM 2452 HB2 CYS A 182 12.776 -12.351 29.317 1.00 6.49 H ATOM 2453 HB3 CYS A 182 13.156 -12.363 27.781 1.00 6.49 H ATOM 2454 N VAL A 183 10.724 -13.384 26.386 1.00 4.88 N ANISOU 2454 N VAL A 183 715 527 613 -50 -28 101 N ATOM 2455 CA VAL A 183 10.359 -14.680 25.818 1.00 5.46 C ANISOU 2455 CA VAL A 183 765 587 721 -9 108 139 C ATOM 2456 C VAL A 183 11.374 -14.949 24.715 1.00 6.32 C ANISOU 2456 C VAL A 183 920 687 795 35 165 91 C ATOM 2457 O VAL A 183 11.676 -14.063 23.914 1.00 7.08 O ANISOU 2457 O VAL A 183 1140 741 807 122 255 111 O ATOM 2458 CB VAL A 183 8.929 -14.672 25.210 1.00 6.75 C ANISOU 2458 CB VAL A 183 892 779 892 17 34 216 C ATOM 2459 CG1 VAL A 183 8.481 -16.087 24.805 1.00 9.06 C ANISOU 2459 CG1 VAL A 183 1206 1090 1148 -63 -46 315 C ATOM 2460 CG2 VAL A 183 7.911 -14.058 26.194 1.00 7.03 C ANISOU 2460 CG2 VAL A 183 887 921 863 21 -22 261 C ATOM 2461 H VAL A 183 10.961 -12.808 25.793 1.00 5.86 H ATOM 2462 HA VAL A 183 10.422 -15.383 26.498 1.00 6.55 H ATOM 2463 HB VAL A 183 8.934 -14.118 24.402 1.00 8.10 H ATOM 2464 HG11 VAL A 183 7.597 -16.041 24.436 1.00 10.88 H ATOM 2465 HG12 VAL A 183 9.093 -16.432 24.150 1.00 10.88 H ATOM 2466 HG13 VAL A 183 8.483 -16.650 25.583 1.00 10.88 H ATOM 2467 HG21 VAL A 183 7.041 -14.068 25.789 1.00 8.44 H ATOM 2468 HG22 VAL A 183 7.904 -14.578 27.001 1.00 8.44 H ATOM 2469 HG23 VAL A 183 8.172 -13.154 26.389 1.00 8.44 H ATOM 2470 N GLY A 184 11.923 -16.154 24.676 1.00 5.71 N ANISOU 2470 N GLY A 184 818 521 830 153 209 173 N ATOM 2471 CA GLY A 184 12.874 -16.495 23.634 1.00 6.86 C ANISOU 2471 CA GLY A 184 877 792 937 342 126 165 C ATOM 2472 C GLY A 184 14.038 -17.334 24.100 1.00 8.21 C ANISOU 2472 C GLY A 184 1124 949 1047 379 181 67 C ATOM 2473 O GLY A 184 13.874 -18.212 24.935 1.00 7.52 O ANISOU 2473 O GLY A 184 1084 779 994 186 257 114 O ATOM 2474 H GLY A 184 11.763 -16.786 25.236 1.00 6.85 H ATOM 2475 HA2 GLY A 184 12.414 -16.983 22.933 1.00 8.23 H ATOM 2476 HA3 GLY A 184 13.229 -15.678 23.250 1.00 8.23 H ATOM 2477 N PHE A 184A 15.211 -17.059 23.534 1.00 9.09 N ANISOU 2477 N PHE A 184A 1082 1114 1258 404 -4 69 N ATOM 2478 CA PHE A 184A 16.374 -17.920 23.701 1.00 11.17 C ANISOU 2478 CA PHE A 184A 1395 1355 1495 232 -18 133 C ATOM 2479 C PHE A 184A 17.596 -17.047 23.917 1.00 13.70 C ANISOU 2479 C PHE A 184A 1758 1652 1796 -47 -112 421 C ATOM 2480 O PHE A 184A 17.680 -15.959 23.363 1.00 16.56 O ANISOU 2480 O PHE A 184A 2082 2208 2003 -603 -161 740 O ATOM 2481 CB PHE A 184A 16.546 -18.780 22.441 1.00 11.90 C ANISOU 2481 CB PHE A 184A 1464 1481 1576 477 136 -55 C ATOM 2482 CG PHE A 184A 15.336 -19.620 22.110 1.00 12.67 C ANISOU 2482 CG PHE A 184A 1652 1512 1649 422 286 -291 C ATOM 2483 CD1 PHE A 184A 14.298 -19.105 21.341 1.00 12.05 C ANISOU 2483 CD1 PHE A 184A 1630 1415 1533 424 438 -340 C ATOM 2484 CD2 PHE A 184A 15.228 -20.917 22.582 1.00 14.90 C ANISOU 2484 CD2 PHE A 184A 1941 1797 1922 401 318 -365 C ATOM 2485 CE1 PHE A 184A 13.179 -19.877 21.047 1.00 12.69 C ANISOU 2485 CE1 PHE A 184A 1608 1615 1599 495 369 -312 C ATOM 2486 CE2 PHE A 184A 14.115 -21.686 22.291 1.00 15.06 C ANISOU 2486 CE2 PHE A 184A 1962 1814 1946 401 393 -402 C ATOM 2487 CZ PHE A 184A 13.097 -21.175 21.517 1.00 13.39 C ANISOU 2487 CZ PHE A 184A 1699 1671 1718 402 359 -385 C ATOM 2488 H PHE A 184A 15.358 -16.369 23.042 1.00 10.91 H ATOM 2489 HA PHE A 184A 16.254 -18.505 24.478 1.00 13.41 H ATOM 2490 HB2 PHE A 184A 16.718 -18.197 21.685 1.00 14.28 H ATOM 2491 HB3 PHE A 184A 17.297 -19.380 22.572 1.00 14.28 H ATOM 2492 HD1 PHE A 184A 14.352 -18.234 21.019 1.00 14.46 H ATOM 2493 HD2 PHE A 184A 15.911 -21.276 23.101 1.00 17.88 H ATOM 2494 HE1 PHE A 184A 12.493 -19.526 20.526 1.00 15.23 H ATOM 2495 HE2 PHE A 184A 14.060 -22.559 22.609 1.00 18.07 H ATOM 2496 HZ PHE A 184A 12.350 -21.695 21.325 1.00 16.07 H ATOM 2497 N LEU A 185 18.524 -17.497 24.750 1.00 13.50 N ANISOU 2497 N LEU A 185 1736 1549 1844 240 -251 308 N ATOM 2498 CA LEU A 185 19.781 -16.785 24.932 1.00 15.61 C ANISOU 2498 CA LEU A 185 1986 1817 2129 239 -321 238 C ATOM 2499 C LEU A 185 20.846 -17.215 23.903 1.00 13.43 C ANISOU 2499 C LEU A 185 1627 1468 2007 150 -255 183 C ATOM 2500 O LEU A 185 21.811 -16.500 23.664 1.00 11.94 O ANISOU 2500 O LEU A 185 1324 1177 2035 124 -304 201 O ATOM 2501 CB LEU A 185 20.296 -16.998 26.361 1.00 21.62 C ANISOU 2501 CB LEU A 185 2769 2645 2801 237 -416 199 C ATOM 2502 CG LEU A 185 19.388 -16.533 27.508 1.00 24.86 C ANISOU 2502 CG LEU A 185 3149 3129 3168 271 -441 277 C ATOM 2503 CD1 LEU A 185 20.084 -16.769 28.845 1.00 32.03 C ANISOU 2503 CD1 LEU A 185 4060 4024 4086 327 -443 296 C ATOM 2504 CD2 LEU A 185 18.999 -15.065 27.389 1.00 21.32 C ANISOU 2504 CD2 LEU A 185 2695 2670 2737 382 -488 281 C ATOM 2505 H LEU A 185 18.451 -18.213 25.221 1.00 16.20 H ATOM 2506 HA LEU A 185 19.619 -15.826 24.812 1.00 18.73 H ATOM 2507 HB2 LEU A 185 20.451 -17.947 26.486 1.00 25.95 H ATOM 2508 HB3 LEU A 185 21.136 -16.522 26.452 1.00 25.95 H ATOM 2509 HG LEU A 185 18.573 -17.060 27.498 1.00 29.83 H ATOM 2510 HD11 LEU A 185 19.506 -16.475 29.553 1.00 38.43 H ATOM 2511 HD12 LEU A 185 20.268 -17.706 28.940 1.00 38.43 H ATOM 2512 HD13 LEU A 185 20.904 -16.270 28.862 1.00 38.43 H ATOM 2513 HD21 LEU A 185 18.434 -14.831 28.129 1.00 25.59 H ATOM 2514 HD22 LEU A 185 19.796 -14.529 27.402 1.00 25.59 H ATOM 2515 HD23 LEU A 185 18.529 -14.933 26.563 1.00 25.59 H ATOM 2516 N GLU A 186 20.670 -18.372 23.277 1.00 13.65 N ANISOU 2516 N GLU A 186 1658 1565 1964 95 -143 125 N ATOM 2517 CA GLU A 186 21.676 -18.878 22.347 1.00 16.82 C ANISOU 2517 CA GLU A 186 2056 2065 2271 103 -242 49 C ATOM 2518 C GLU A 186 21.690 -18.141 21.009 1.00 17.90 C ANISOU 2518 C GLU A 186 2160 2315 2324 213 -363 65 C ATOM 2519 O GLU A 186 22.621 -18.312 20.219 1.00 18.83 O ANISOU 2519 O GLU A 186 2143 2657 2354 233 -222 377 O ATOM 2520 CB GLU A 186 21.468 -20.374 22.093 1.00 22.62 C ANISOU 2520 CB GLU A 186 2816 2767 3013 -31 7 -54 C ATOM 2521 CG GLU A 186 20.120 -20.728 21.498 1.00 31.32 C ANISOU 2521 CG GLU A 186 3926 3857 4119 -343 219 -149 C ATOM 2522 CD GLU A 186 19.136 -21.282 22.532 1.00 29.96 C ANISOU 2522 CD GLU A 186 3641 3553 4191 -663 253 -306 C ATOM 2523 OE1 GLU A 186 18.447 -22.280 22.188 1.00 30.63 O ANISOU 2523 OE1 GLU A 186 3705 3571 4362 -842 376 -456 O ATOM 2524 OE2 GLU A 186 19.066 -20.739 23.671 1.00 26.81 O ANISOU 2524 OE2 GLU A 186 3168 2910 4110 -772 96 -380 O ATOM 2525 H GLU A 186 19.983 -18.881 23.371 1.00 16.38 H ATOM 2526 HA GLU A 186 22.560 -18.766 22.754 1.00 20.19 H ATOM 2527 HB2 GLU A 186 22.151 -20.682 21.477 1.00 27.15 H ATOM 2528 HB3 GLU A 186 21.550 -20.846 22.936 1.00 27.15 H ATOM 2529 HG2 GLU A 186 19.727 -19.930 21.109 1.00 37.59 H ATOM 2530 HG3 GLU A 186 20.245 -21.403 20.812 1.00 37.59 H ATOM 2531 N GLY A 187 20.665 -17.335 20.750 1.00 18.23 N ANISOU 2531 N GLY A 187 2336 2203 2387 159 -766 -152 N ATOM 2532 CA GLY A 187 20.579 -16.597 19.502 1.00 20.17 C ANISOU 2532 CA GLY A 187 2588 2435 2641 186 -915 -234 C ATOM 2533 C GLY A 187 19.857 -17.357 18.394 1.00 17.38 C ANISOU 2533 C GLY A 187 2209 1977 2418 236 -979 -300 C ATOM 2534 O GLY A 187 19.641 -18.577 18.493 1.00 18.48 O ANISOU 2534 O GLY A 187 2272 2058 2692 251 -1147 -291 O ATOM 2535 H GLY A 187 20.005 -17.200 21.285 1.00 21.87 H ATOM 2536 HA2 GLY A 187 20.108 -15.763 19.656 1.00 24.21 H ATOM 2537 HA3 GLY A 187 21.475 -16.387 19.193 1.00 24.21 H ATOM 2538 N GLY A 188 19.461 -16.627 17.355 1.00 13.49 N ANISOU 2538 N GLY A 188 1586 1622 1916 383 -854 -314 N ATOM 2539 CA GLY A 188 18.921 -17.205 16.140 1.00 13.22 C ANISOU 2539 CA GLY A 188 1607 1597 1819 406 -586 -293 C ATOM 2540 C GLY A 188 17.410 -17.329 16.054 1.00 9.58 C ANISOU 2540 C GLY A 188 1177 1060 1405 325 -420 -248 C ATOM 2541 O GLY A 188 16.881 -17.647 14.989 1.00 9.53 O ANISOU 2541 O GLY A 188 1225 969 1429 258 -131 -258 O ATOM 2542 H GLY A 188 19.500 -15.768 17.335 1.00 16.18 H ATOM 2543 HA2 GLY A 188 19.212 -16.667 15.387 1.00 15.86 H ATOM 2544 HA3 GLY A 188 19.293 -18.094 16.029 1.00 15.86 H ATOM 2545 N LYS A 188A 16.716 -17.108 17.170 1.00 7.76 N ANISOU 2545 N LYS A 188A 966 894 1089 87 -252 -287 N ATOM 2546 CA LYS A 188A 15.249 -17.254 17.229 1.00 9.17 C ANISOU 2546 CA LYS A 188A 1229 1083 1174 211 -108 -192 C ATOM 2547 C LYS A 188A 14.628 -16.093 18.001 1.00 7.50 C ANISOU 2547 C LYS A 188A 1028 835 985 219 -55 -151 C ATOM 2548 O LYS A 188A 14.872 -15.959 19.188 1.00 7.20 O ANISOU 2548 O LYS A 188A 1043 806 888 289 -216 -132 O ATOM 2549 CB LYS A 188A 14.869 -18.566 17.907 1.00 10.39 C ANISOU 2549 CB LYS A 188A 1395 1204 1349 80 -131 -199 C ATOM 2550 CG LYS A 188A 15.160 -19.789 17.048 1.00 12.68 C ANISOU 2550 CG LYS A 188A 1655 1534 1628 138 132 -142 C ATOM 2551 CD LYS A 188A 14.363 -21.011 17.509 1.00 20.76 C ANISOU 2551 CD LYS A 188A 2616 2549 2722 149 266 -223 C ATOM 2552 CE LYS A 188A 15.173 -22.020 18.275 1.00 39.59 C ANISOU 2552 CE LYS A 188A 5037 5022 4985 210 288 -261 C ATOM 2553 NZ LYS A 188A 14.419 -23.327 18.303 1.00 32.46 N ANISOU 2553 NZ LYS A 188A 4083 4029 4221 302 294 -287 N ATOM 2554 H LYS A 188A 17.070 -16.871 17.917 1.00 9.31 H ATOM 2555 HA LYS A 188A 14.883 -17.255 16.320 1.00 11.01 H ATOM 2556 HB2 LYS A 188A 15.374 -18.653 18.731 1.00 12.47 H ATOM 2557 HB3 LYS A 188A 13.918 -18.557 18.101 1.00 12.47 H ATOM 2558 HG2 LYS A 188A 14.918 -19.598 16.129 1.00 15.21 H ATOM 2559 HG3 LYS A 188A 16.105 -20.003 17.108 1.00 15.21 H ATOM 2560 HD2 LYS A 188A 13.642 -20.712 18.085 1.00 24.91 H ATOM 2561 HD3 LYS A 188A 13.997 -21.456 16.729 1.00 24.91 H ATOM 2562 HE2 LYS A 188A 16.026 -22.161 17.833 1.00 47.51 H ATOM 2563 HE3 LYS A 188A 15.303 -21.715 19.186 1.00 47.51 H ATOM 2564 HZ1 LYS A 188A 14.921 -23.985 18.788 1.00 38.95 H ATOM 2565 HZ2 LYS A 188A 13.568 -23.205 18.731 1.00 38.95 H ATOM 2566 HZ3 LYS A 188A 14.275 -23.642 17.407 1.00 38.95 H ATOM 2567 N ASP A 189 13.851 -15.240 17.336 1.00 7.39 N ANISOU 2567 N ASP A 189 972 943 893 -111 9 -224 N ATOM 2568 CA ASP A 189 13.341 -14.016 17.971 1.00 6.07 C ANISOU 2568 CA ASP A 189 815 672 818 -55 171 -71 C ATOM 2569 C ASP A 189 12.314 -13.346 17.069 1.00 5.34 C ANISOU 2569 C ASP A 189 822 606 602 11 83 18 C ATOM 2570 O ASP A 189 12.188 -13.700 15.900 1.00 5.98 O ANISOU 2570 O ASP A 189 950 757 563 187 72 -61 O ATOM 2571 CB ASP A 189 14.523 -13.060 18.201 1.00 6.60 C ANISOU 2571 CB ASP A 189 753 885 869 -131 246 -22 C ATOM 2572 CG ASP A 189 14.261 -11.970 19.244 1.00 6.24 C ANISOU 2572 CG ASP A 189 735 798 837 -117 240 57 C ATOM 2573 OD1 ASP A 189 13.156 -11.876 19.853 1.00 6.30 O ANISOU 2573 OD1 ASP A 189 734 753 906 50 347 -53 O ATOM 2574 OD2 ASP A 189 15.213 -11.184 19.463 1.00 6.30 O ANISOU 2574 OD2 ASP A 189 846 871 677 -174 213 -23 O ATOM 2575 H ASP A 189 13.604 -15.343 16.519 1.00 8.87 H ATOM 2576 HA ASP A 189 12.925 -14.229 18.833 1.00 7.28 H ATOM 2577 HB2 ASP A 189 15.287 -13.577 18.501 1.00 7.92 H ATOM 2578 HB3 ASP A 189 14.734 -12.620 17.363 1.00 7.92 H ATOM 2579 N SER A 190 11.601 -12.360 17.602 1.00 5.17 N ANISOU 2579 N SER A 190 716 708 541 128 76 176 N ATOM 2580 CA SER A 190 10.833 -11.420 16.769 1.00 4.72 C ANISOU 2580 CA SER A 190 605 527 661 87 -64 14 C ATOM 2581 C SER A 190 11.779 -10.302 16.290 1.00 4.59 C ANISOU 2581 C SER A 190 534 514 697 137 -47 -122 C ATOM 2582 O SER A 190 12.948 -10.240 16.726 1.00 5.36 O ANISOU 2582 O SER A 190 601 664 770 174 -3 -44 O ATOM 2583 CB SER A 190 9.628 -10.882 17.528 1.00 5.71 C ANISOU 2583 CB SER A 190 809 602 757 48 -132 -8 C ATOM 2584 OG SER A 190 9.997 -10.312 18.774 1.00 6.34 O ANISOU 2584 OG SER A 190 872 637 902 93 -185 -64 O ATOM 2585 H SER A 190 11.541 -12.207 18.446 1.00 6.20 H ATOM 2586 HA SER A 190 10.502 -11.894 15.978 1.00 5.66 H ATOM 2587 HB2 SER A 190 9.198 -10.200 16.988 1.00 6.85 H ATOM 2588 HB3 SER A 190 9.009 -11.611 17.689 1.00 6.85 H ATOM 2589 HG SER A 190 9.331 -10.030 19.161 1.00 7.61 H ATOM 2590 N CYS A 191 11.303 -9.446 15.387 1.00 4.47 N ANISOU 2590 N CYS A 191 409 539 752 176 -50 -192 N ATOM 2591 CA CYS A 191 12.138 -8.444 14.735 1.00 5.44 C ANISOU 2591 CA CYS A 191 620 635 810 73 27 -57 C ATOM 2592 C CYS A 191 11.294 -7.270 14.200 1.00 5.73 C ANISOU 2592 C CYS A 191 702 704 772 -185 -67 8 C ATOM 2593 O CYS A 191 10.082 -7.206 14.435 1.00 6.30 O ANISOU 2593 O CYS A 191 738 771 884 -64 -78 77 O ATOM 2594 CB CYS A 191 12.973 -9.108 13.614 1.00 7.85 C ANISOU 2594 CB CYS A 191 1026 907 1048 -40 95 -11 C ATOM 2595 SG CYS A 191 14.500 -8.214 13.141 1.00 8.17 S ANISOU 2595 SG CYS A 191 1027 954 1124 107 122 57 S ATOM 2596 H CYS A 191 10.482 -9.428 15.131 1.00 5.37 H ATOM 2597 HA CYS A 191 12.764 -8.081 15.395 1.00 6.52 H ATOM 2598 HB2 CYS A 191 13.234 -9.994 13.909 1.00 9.42 H ATOM 2599 HB3 CYS A 191 12.420 -9.180 12.820 1.00 9.42 H ATOM 2600 N GLN A 192 11.934 -6.314 13.538 1.00 5.40 N ANISOU 2600 N GLN A 192 658 670 725 -233 -34 77 N ATOM 2601 CA GLN A 192 11.217 -5.150 12.987 1.00 5.85 C ANISOU 2601 CA GLN A 192 691 760 771 -116 88 -50 C ATOM 2602 C GLN A 192 10.041 -5.561 12.088 1.00 5.34 C ANISOU 2602 C GLN A 192 736 588 706 -142 137 -117 C ATOM 2603 O GLN A 192 10.164 -6.441 11.232 1.00 5.57 O ANISOU 2603 O GLN A 192 759 566 792 -123 124 -138 O ATOM 2604 CB GLN A 192 12.184 -4.198 12.258 1.00 6.05 C ANISOU 2604 CB GLN A 192 803 659 838 -59 6 59 C ATOM 2605 CG GLN A 192 12.985 -3.270 13.205 1.00 6.98 C ANISOU 2605 CG GLN A 192 833 875 945 34 -80 69 C ATOM 2606 CD GLN A 192 13.992 -4.025 14.071 1.00 7.21 C ANISOU 2606 CD GLN A 192 804 943 992 41 -7 -28 C ATOM 2607 OE1 GLN A 192 14.737 -4.867 13.577 1.00 7.54 O ANISOU 2607 OE1 GLN A 192 864 941 1060 165 122 -73 O ATOM 2608 NE2 GLN A 192 14.017 -3.725 15.358 1.00 7.42 N ANISOU 2608 NE2 GLN A 192 883 939 997 -98 -126 -49 N ATOM 2609 H GLN A 192 12.781 -6.309 13.389 1.00 6.48 H ATOM 2610 HA GLN A 192 10.837 -4.648 13.738 1.00 7.02 H ATOM 2611 HB2 GLN A 192 12.821 -4.727 11.753 1.00 7.26 H ATOM 2612 HB3 GLN A 192 11.673 -3.636 11.655 1.00 7.26 H ATOM 2613 HG2 GLN A 192 13.474 -2.623 12.673 1.00 8.38 H ATOM 2614 HG3 GLN A 192 12.367 -2.812 13.796 1.00 8.38 H ATOM 2615 HE21 GLN A 192 14.568 -4.126 15.882 1.00 8.91 H ATOM 2616 HE22 GLN A 192 13.482 -3.129 15.671 1.00 8.91 H ATOM 2617 N ARG A 193 8.930 -4.855 12.289 1.00 4.27 N ANISOU 2617 N ARG A 193 575 411 634 -162 119 -35 N ATOM 2618 CA ARG A 193 7.611 -5.103 11.689 1.00 4.93 C ANISOU 2618 CA ARG A 193 628 607 640 -119 186 -9 C ATOM 2619 C ARG A 193 6.827 -6.243 12.353 1.00 4.96 C ANISOU 2619 C ARG A 193 722 558 604 -143 6 99 C ATOM 2620 O ARG A 193 5.709 -6.547 11.922 1.00 6.15 O ANISOU 2620 O ARG A 193 799 889 648 -99 27 132 O ATOM 2621 CB ARG A 193 7.650 -5.205 10.150 1.00 6.23 C ANISOU 2621 CB ARG A 193 824 742 800 -171 206 252 C ATOM 2622 CG ARG A 193 8.156 -3.906 9.490 1.00 8.66 C ANISOU 2622 CG ARG A 193 1184 1037 1069 -28 351 407 C ATOM 2623 CD ARG A 193 7.858 -3.893 7.993 1.00 9.53 C ANISOU 2623 CD ARG A 193 1321 1066 1234 -28 432 656 C ATOM 2624 NE ARG A 193 8.127 -2.602 7.357 1.00 11.99 N ANISOU 2624 NE ARG A 193 1662 1303 1589 -294 586 631 N ATOM 2625 CZ ARG A 193 9.065 -2.381 6.433 1.00 15.19 C ANISOU 2625 CZ ARG A 193 2075 1734 1963 -321 597 747 C ATOM 2626 NH1 ARG A 193 9.891 -3.335 6.058 1.00 16.36 N ANISOU 2626 NH1 ARG A 193 2139 1967 2109 -247 609 906 N ATOM 2627 NH2 ARG A 193 9.209 -1.177 5.902 1.00 17.92 N ANISOU 2627 NH2 ARG A 193 2371 2154 2285 -340 524 763 N ATOM 2628 H ARG A 193 8.916 -4.172 12.812 1.00 5.12 H ATOM 2629 HA ARG A 193 7.082 -4.298 11.872 1.00 5.92 H ATOM 2630 HB2 ARG A 193 8.248 -5.925 9.894 1.00 7.47 H ATOM 2631 HB3 ARG A 193 6.755 -5.382 9.820 1.00 7.47 H ATOM 2632 HG2 ARG A 193 7.711 -3.146 9.895 1.00 10.39 H ATOM 2633 HG3 ARG A 193 9.116 -3.838 9.610 1.00 10.39 H ATOM 2634 HD2 ARG A 193 8.411 -4.560 7.557 1.00 11.43 H ATOM 2635 HD3 ARG A 193 6.920 -4.102 7.857 1.00 11.43 H ATOM 2636 HE ARG A 193 7.582 -1.847 7.630 1.00 14.38 H ATOM 2637 HH11 ARG A 193 9.813 -4.126 6.386 1.00 19.63 H ATOM 2638 HH12 ARG A 193 10.496 -3.172 5.468 1.00 19.63 H ATOM 2639 HH21 ARG A 193 8.690 -0.536 6.143 1.00 21.51 H ATOM 2640 HH22 ARG A 193 9.828 -1.034 5.322 1.00 21.51 H ATOM 2641 N ASP A 194 7.373 -6.835 13.423 1.00 4.57 N ANISOU 2641 N ASP A 194 607 552 578 -150 113 -15 N ATOM 2642 CA ASP A 194 6.585 -7.723 14.303 1.00 4.14 C ANISOU 2642 CA ASP A 194 539 401 632 4 172 -32 C ATOM 2643 C ASP A 194 5.914 -6.982 15.482 1.00 4.15 C ANISOU 2643 C ASP A 194 588 389 600 -51 236 37 C ATOM 2644 O ASP A 194 4.962 -7.519 16.095 1.00 4.61 O ANISOU 2644 O ASP A 194 652 509 590 -69 330 12 O ATOM 2645 CB ASP A 194 7.440 -8.856 14.899 1.00 4.50 C ANISOU 2645 CB ASP A 194 636 463 610 74 117 17 C ATOM 2646 CG ASP A 194 7.844 -9.918 13.866 1.00 4.32 C ANISOU 2646 CG ASP A 194 665 352 626 81 96 -82 C ATOM 2647 OD1 ASP A 194 7.002 -10.281 13.023 1.00 4.77 O ANISOU 2647 OD1 ASP A 194 719 485 608 -3 153 -134 O ATOM 2648 OD2 ASP A 194 8.990 -10.409 13.920 1.00 4.46 O ANISOU 2648 OD2 ASP A 194 586 465 642 -153 -65 -1 O ATOM 2649 H ASP A 194 8.194 -6.742 13.663 1.00 5.49 H ATOM 2650 HA ASP A 194 5.874 -8.137 13.770 1.00 4.97 H ATOM 2651 HB2 ASP A 194 8.252 -8.476 15.270 1.00 5.40 H ATOM 2652 HB3 ASP A 194 6.933 -9.298 15.599 1.00 5.40 H ATOM 2653 N ALA A 195 6.387 -5.763 15.803 1.00 4.70 N ANISOU 2653 N ALA A 195 610 503 672 16 150 -3 N ATOM 2654 CA ALA A 195 5.884 -5.052 16.986 1.00 4.17 C ANISOU 2654 CA ALA A 195 564 385 634 -77 54 127 C ATOM 2655 C ALA A 195 4.386 -4.932 16.975 1.00 3.88 C ANISOU 2655 C ALA A 195 571 315 587 -107 133 34 C ATOM 2656 O ALA A 195 3.786 -4.732 15.926 1.00 4.92 O ANISOU 2656 O ALA A 195 684 638 547 6 147 -69 O ATOM 2657 CB ALA A 195 6.483 -3.668 17.109 1.00 5.64 C ANISOU 2657 CB ALA A 195 691 681 770 -90 13 271 C ATOM 2658 H ALA A 195 6.987 -5.337 15.359 1.00 5.64 H ATOM 2659 HA ALA A 195 6.136 -5.558 17.786 1.00 5.00 H ATOM 2660 HB1 ALA A 195 6.127 -3.242 17.893 1.00 6.76 H ATOM 2661 HB2 ALA A 195 7.437 -3.746 17.183 1.00 6.76 H ATOM 2662 HB3 ALA A 195 6.255 -3.158 16.328 1.00 6.76 H ATOM 2663 N GLY A 196 3.798 -5.010 18.169 1.00 4.07 N ANISOU 2663 N GLY A 196 644 373 530 12 224 -16 N ATOM 2664 CA GLY A 196 2.360 -4.907 18.337 1.00 4.27 C ANISOU 2664 CA GLY A 196 627 452 543 -42 196 23 C ATOM 2665 C GLY A 196 1.642 -6.244 18.235 1.00 3.94 C ANISOU 2665 C GLY A 196 609 387 502 -52 195 91 C ATOM 2666 O GLY A 196 0.503 -6.367 18.674 1.00 4.71 O ANISOU 2666 O GLY A 196 699 487 605 -128 191 -26 O ATOM 2667 H GLY A 196 4.224 -5.126 18.907 1.00 4.89 H ATOM 2668 HA2 GLY A 196 2.167 -4.524 19.207 1.00 5.12 H ATOM 2669 HA3 GLY A 196 2.000 -4.316 17.658 1.00 5.12 H ATOM 2670 N GLY A 197 2.307 -7.251 17.662 1.00 4.31 N ANISOU 2670 N GLY A 197 603 496 538 -121 238 122 N ATOM 2671 CA GLY A 197 1.703 -8.554 17.477 1.00 4.03 C ANISOU 2671 CA GLY A 197 558 460 512 -128 273 92 C ATOM 2672 C GLY A 197 1.707 -9.428 18.721 1.00 4.32 C ANISOU 2672 C GLY A 197 588 606 448 -121 232 -97 C ATOM 2673 O GLY A 197 2.227 -9.054 19.786 1.00 4.78 O ANISOU 2673 O GLY A 197 628 632 555 -166 121 -311 O ATOM 2674 H GLY A 197 3.115 -7.196 17.373 1.00 5.17 H ATOM 2675 HA2 GLY A 197 0.782 -8.439 17.194 1.00 4.83 H ATOM 2676 HA3 GLY A 197 2.178 -9.027 16.776 1.00 4.83 H ATOM 2677 N PRO A 198 1.125 -10.624 18.596 1.00 4.32 N ANISOU 2677 N PRO A 198 575 523 541 -42 214 83 N ATOM 2678 CA PRO A 198 0.802 -11.466 19.756 1.00 5.64 C ANISOU 2678 CA PRO A 198 746 680 716 -92 162 66 C ATOM 2679 C PRO A 198 1.914 -12.384 20.232 1.00 5.09 C ANISOU 2679 C PRO A 198 660 633 642 -157 107 150 C ATOM 2680 O PRO A 198 2.680 -12.928 19.414 1.00 5.82 O ANISOU 2680 O PRO A 198 778 750 685 -78 31 220 O ATOM 2681 CB PRO A 198 -0.347 -12.334 19.227 1.00 6.82 C ANISOU 2681 CB PRO A 198 845 824 921 -16 262 43 C ATOM 2682 CG PRO A 198 -0.073 -12.435 17.732 1.00 5.71 C ANISOU 2682 CG PRO A 198 758 613 799 0 242 -29 C ATOM 2683 CD PRO A 198 0.533 -11.128 17.339 1.00 5.70 C ANISOU 2683 CD PRO A 198 745 665 755 -71 234 -85 C ATOM 2684 HA PRO A 198 0.483 -10.918 20.503 1.00 6.76 H ATOM 2685 HB2 PRO A 198 -0.319 -13.209 19.644 1.00 8.18 H ATOM 2686 HB3 PRO A 198 -1.196 -11.897 19.395 1.00 8.18 H ATOM 2687 HG2 PRO A 198 0.547 -13.162 17.563 1.00 6.85 H ATOM 2688 HG3 PRO A 198 -0.906 -12.580 17.258 1.00 6.85 H ATOM 2689 HD2 PRO A 198 1.223 -11.263 16.671 1.00 6.84 H ATOM 2690 HD3 PRO A 198 -0.153 -10.520 17.022 1.00 6.84 H ATOM 2691 N VAL A 199 1.954 -12.571 21.554 1.00 4.37 N ANISOU 2691 N VAL A 199 554 583 522 -73 -10 -39 N ATOM 2692 CA VAL A 199 2.536 -13.753 22.193 1.00 4.94 C ANISOU 2692 CA VAL A 199 581 668 629 -35 145 -33 C ATOM 2693 C VAL A 199 1.384 -14.480 22.889 1.00 4.35 C ANISOU 2693 C VAL A 199 571 574 508 77 216 39 C ATOM 2694 O VAL A 199 0.769 -13.925 23.795 1.00 4.98 O ANISOU 2694 O VAL A 199 733 564 595 173 403 136 O ATOM 2695 CB VAL A 199 3.591 -13.372 23.264 1.00 5.62 C ANISOU 2695 CB VAL A 199 700 677 758 -9 145 -84 C ATOM 2696 CG1 VAL A 199 4.160 -14.616 23.955 1.00 6.70 C ANISOU 2696 CG1 VAL A 199 856 801 891 58 162 47 C ATOM 2697 CG2 VAL A 199 4.701 -12.539 22.658 1.00 7.61 C ANISOU 2697 CG2 VAL A 199 967 899 1026 -89 110 -101 C ATOM 2698 H VAL A 199 1.638 -12.006 22.120 1.00 5.24 H ATOM 2699 HA VAL A 199 2.942 -14.343 21.524 1.00 5.93 H ATOM 2700 HB VAL A 199 3.154 -12.827 23.951 1.00 6.74 H ATOM 2701 HG11 VAL A 199 4.807 -14.341 24.609 1.00 8.04 H ATOM 2702 HG12 VAL A 199 3.443 -15.091 24.382 1.00 8.04 H ATOM 2703 HG13 VAL A 199 4.577 -15.176 23.296 1.00 8.04 H ATOM 2704 HG21 VAL A 199 5.336 -12.320 23.344 1.00 9.13 H ATOM 2705 HG22 VAL A 199 5.129 -13.047 21.965 1.00 9.13 H ATOM 2706 HG23 VAL A 199 4.324 -11.736 22.292 1.00 9.13 H ATOM 2707 N VAL A 200 1.063 -15.685 22.425 1.00 3.40 N ANISOU 2707 N VAL A 200 422 367 504 23 91 -44 N ATOM 2708 CA VAL A 200 -0.051 -16.470 22.940 1.00 5.49 C ANISOU 2708 CA VAL A 200 722 627 735 -4 47 79 C ATOM 2709 C VAL A 200 0.470 -17.693 23.699 1.00 5.47 C ANISOU 2709 C VAL A 200 737 573 769 -36 106 99 C ATOM 2710 O VAL A 200 1.321 -18.424 23.197 1.00 5.88 O ANISOU 2710 O VAL A 200 728 731 776 108 229 161 O ATOM 2711 CB VAL A 200 -1.009 -16.898 21.801 1.00 7.75 C ANISOU 2711 CB VAL A 200 988 933 1023 -131 -28 207 C ATOM 2712 CG1 VAL A 200 -2.046 -17.930 22.292 1.00 9.20 C ANISOU 2712 CG1 VAL A 200 1165 1119 1211 -231 -53 235 C ATOM 2713 CG2 VAL A 200 -1.705 -15.675 21.207 1.00 8.89 C ANISOU 2713 CG2 VAL A 200 1158 1040 1179 -118 -37 83 C ATOM 2714 H VAL A 200 1.492 -16.079 21.792 1.00 4.08 H ATOM 2715 HA VAL A 200 -0.561 -15.919 23.570 1.00 6.58 H ATOM 2716 HB VAL A 200 -0.484 -17.318 21.089 1.00 9.30 H ATOM 2717 HG11 VAL A 200 -2.619 -18.170 21.560 1.00 11.04 H ATOM 2718 HG12 VAL A 200 -1.583 -18.707 22.615 1.00 11.04 H ATOM 2719 HG13 VAL A 200 -2.564 -17.540 23.000 1.00 11.04 H ATOM 2720 HG21 VAL A 200 -2.294 -15.961 20.504 1.00 10.66 H ATOM 2721 HG22 VAL A 200 -2.208 -15.236 21.897 1.00 10.66 H ATOM 2722 HG23 VAL A 200 -1.041 -15.078 20.855 1.00 10.66 H ATOM 2723 N CYS A 201 -0.036 -17.901 24.912 1.00 6.11 N ANISOU 2723 N CYS A 201 741 727 853 16 180 121 N ATOM 2724 CA CYS A 201 0.385 -19.024 25.749 1.00 7.23 C ANISOU 2724 CA CYS A 201 809 907 1029 -74 104 239 C ATOM 2725 C CYS A 201 -0.861 -19.647 26.374 1.00 7.92 C ANISOU 2725 C CYS A 201 888 988 1134 -10 2 378 C ATOM 2726 O CYS A 201 -1.659 -18.942 26.975 1.00 7.43 O ANISOU 2726 O CYS A 201 883 857 1084 175 -77 334 O ATOM 2727 CB CYS A 201 1.339 -18.577 26.878 1.00 9.44 C ANISOU 2727 CB CYS A 201 1173 1171 1243 -4 246 195 C ATOM 2728 SG CYS A 201 2.541 -17.253 26.528 1.00 8.58 S ANISOU 2728 SG CYS A 201 1055 955 1252 147 136 56 S ATOM 2729 H CYS A 201 -0.632 -17.400 25.279 1.00 7.33 H ATOM 2730 HA CYS A 201 0.836 -19.699 25.199 1.00 8.67 H ATOM 2731 HB2 CYS A 201 0.796 -18.272 27.622 1.00 11.33 H ATOM 2732 HB3 CYS A 201 1.851 -19.352 27.158 1.00 11.33 H ATOM 2733 N ASN A 202 -1.028 -20.959 26.243 1.00 9.85 N ANISOU 2733 N ASN A 202 1195 1185 1363 122 70 496 N ATOM 2734 CA ASN A 202 -2.173 -21.643 26.856 1.00 12.57 C ANISOU 2734 CA ASN A 202 1600 1472 1702 93 122 467 C ATOM 2735 C ASN A 202 -3.498 -20.954 26.482 1.00 10.41 C ANISOU 2735 C ASN A 202 1354 1093 1510 -112 186 285 C ATOM 2736 O ASN A 202 -4.363 -20.753 27.336 1.00 10.84 O ANISOU 2736 O ASN A 202 1420 1123 1577 -50 391 339 O ATOM 2737 CB ASN A 202 -2.043 -21.709 28.396 1.00 15.21 C ANISOU 2737 CB ASN A 202 1882 1908 1987 90 -38 665 C ATOM 2738 CG ASN A 202 -0.706 -22.260 28.871 1.00 19.96 C ANISOU 2738 CG ASN A 202 2405 2702 2476 -95 133 613 C ATOM 2739 OD1 ASN A 202 0.039 -21.588 29.604 1.00 20.88 O ANISOU 2739 OD1 ASN A 202 2388 3100 2447 -115 67 561 O ATOM 2740 ND2 ASN A 202 -0.394 -23.471 28.468 1.00 22.54 N ANISOU 2740 ND2 ASN A 202 2797 2784 2985 153 35 757 N ATOM 2741 H ASN A 202 -0.497 -21.477 25.808 1.00 11.82 H ATOM 2742 HA ASN A 202 -2.208 -22.562 26.518 1.00 15.08 H ATOM 2743 HB2 ASN A 202 -2.141 -20.814 28.757 1.00 18.25 H ATOM 2744 HB3 ASN A 202 -2.743 -22.283 28.745 1.00 18.25 H ATOM 2745 HD21 ASN A 202 0.455 -23.875 28.744 1.00 27.05 H ATOM 2746 HD22 ASN A 202 -1.011 -23.969 27.893 1.00 27.05 H ATOM 2747 N GLY A 203 -3.646 -20.568 25.215 1.00 8.61 N ANISOU 2747 N GLY A 203 1152 880 1238 -107 48 238 N ATOM 2748 CA GLY A 203 -4.908 -20.025 24.732 1.00 9.91 C ANISOU 2748 CA GLY A 203 1322 1117 1326 -114 115 131 C ATOM 2749 C GLY A 203 -5.238 -18.601 25.160 1.00 7.80 C ANISOU 2749 C GLY A 203 991 857 1115 138 120 60 C ATOM 2750 O GLY A 203 -6.384 -18.161 25.004 1.00 8.72 O ANISOU 2750 O GLY A 203 1122 938 1253 -57 -50 -50 O ATOM 2751 H GLY A 203 -3.029 -20.610 24.618 1.00 10.33 H ATOM 2752 HA2 GLY A 203 -4.903 -20.046 23.762 1.00 11.89 H ATOM 2753 HA3 GLY A 203 -5.629 -20.598 25.037 1.00 11.89 H ATOM 2754 N GLN A 204 -4.237 -17.882 25.667 1.00 6.44 N ANISOU 2754 N GLN A 204 842 743 862 94 226 33 N ATOM 2755 CA GLN A 204 -4.416 -16.514 26.155 1.00 6.67 C ANISOU 2755 CA GLN A 204 869 823 842 -17 187 144 C ATOM 2756 C GLN A 204 -3.388 -15.578 25.571 1.00 5.56 C ANISOU 2756 C GLN A 204 705 652 757 -50 105 -8 C ATOM 2757 O GLN A 204 -2.227 -15.952 25.372 1.00 5.73 O ANISOU 2757 O GLN A 204 803 540 835 14 129 5 O ATOM 2758 CB GLN A 204 -4.233 -16.460 27.677 1.00 7.29 C ANISOU 2758 CB GLN A 204 963 904 902 101 270 108 C ATOM 2759 CG GLN A 204 -5.132 -17.387 28.460 1.00 8.14 C ANISOU 2759 CG GLN A 204 1087 975 1031 73 174 217 C ATOM 2760 CD GLN A 204 -4.619 -17.588 29.873 1.00 9.27 C ANISOU 2760 CD GLN A 204 1316 1067 1137 383 311 343 C ATOM 2761 OE1 GLN A 204 -3.702 -18.392 30.143 1.00 12.03 O ANISOU 2761 OE1 GLN A 204 1764 1521 1286 503 210 273 O ATOM 2762 NE2 GLN A 204 -5.207 -16.893 30.774 1.00 8.49 N ANISOU 2762 NE2 GLN A 204 1233 871 1122 635 387 333 N ATOM 2763 H GLN A 204 -3.430 -18.169 25.739 1.00 7.73 H ATOM 2764 HA GLN A 204 -5.312 -16.189 25.928 1.00 8.00 H ATOM 2765 HB2 GLN A 204 -3.316 -16.696 27.886 1.00 8.74 H ATOM 2766 HB3 GLN A 204 -4.413 -15.555 27.977 1.00 8.74 H ATOM 2767 HG2 GLN A 204 -6.022 -17.005 28.511 1.00 9.77 H ATOM 2768 HG3 GLN A 204 -5.162 -18.252 28.021 1.00 9.77 H ATOM 2769 HE21 GLN A 204 -4.963 -16.960 31.596 1.00 10.19 H ATOM 2770 HE22 GLN A 204 -5.845 -16.359 30.557 1.00 10.19 H ATOM 2771 N LEU A 209 -3.798 -14.344 25.313 1.00 5.15 N ANISOU 2771 N LEU A 209 555 684 720 -80 -24 17 N ATOM 2772 CA LEU A 209 -2.864 -13.322 24.838 1.00 6.03 C ANISOU 2772 CA LEU A 209 726 776 790 -41 12 -27 C ATOM 2773 C LEU A 209 -2.048 -12.801 26.032 1.00 5.42 C ANISOU 2773 C LEU A 209 566 733 760 -45 -61 -23 C ATOM 2774 O LEU A 209 -2.573 -12.070 26.876 1.00 5.70 O ANISOU 2774 O LEU A 209 445 944 777 114 -105 -83 O ATOM 2775 CB LEU A 209 -3.620 -12.171 24.162 1.00 6.01 C ANISOU 2775 CB LEU A 209 740 737 807 9 53 -20 C ATOM 2776 CG LEU A 209 -2.742 -11.020 23.670 1.00 5.91 C ANISOU 2776 CG LEU A 209 749 667 831 186 171 -19 C ATOM 2777 CD1 LEU A 209 -1.902 -11.469 22.450 1.00 7.01 C ANISOU 2777 CD1 LEU A 209 921 847 897 234 167 -114 C ATOM 2778 CD2 LEU A 209 -3.599 -9.770 23.341 1.00 6.76 C ANISOU 2778 CD2 LEU A 209 916 783 868 97 135 15 C ATOM 2779 H LEU A 209 -4.608 -14.069 25.403 1.00 6.18 H ATOM 2780 HA LEU A 209 -2.248 -13.717 24.187 1.00 7.24 H ATOM 2781 HB2 LEU A 209 -4.096 -12.525 23.394 1.00 7.21 H ATOM 2782 HB3 LEU A 209 -4.254 -11.804 24.797 1.00 7.21 H ATOM 2783 HG LEU A 209 -2.125 -10.776 24.378 1.00 7.09 H ATOM 2784 HD11 LEU A 209 -1.359 -10.733 22.158 1.00 8.41 H ATOM 2785 HD12 LEU A 209 -1.343 -12.205 22.710 1.00 8.41 H ATOM 2786 HD13 LEU A 209 -2.495 -11.740 21.746 1.00 8.41 H ATOM 2787 HD21 LEU A 209 -3.021 -9.067 23.036 1.00 8.11 H ATOM 2788 HD22 LEU A 209 -4.230 -9.997 22.654 1.00 8.11 H ATOM 2789 HD23 LEU A 209 -4.063 -9.492 24.134 1.00 8.11 H ATOM 2790 N GLN A 210 -0.776 -13.185 26.100 1.00 4.91 N ANISOU 2790 N GLN A 210 647 518 702 -50 0 191 N ATOM 2791 CA GLN A 210 0.073 -12.834 27.231 1.00 4.88 C ANISOU 2791 CA GLN A 210 653 544 658 10 174 150 C ATOM 2792 C GLN A 210 1.037 -11.688 26.946 1.00 4.71 C ANISOU 2792 C GLN A 210 752 421 618 42 200 102 C ATOM 2793 O GLN A 210 1.456 -10.971 27.865 1.00 5.22 O ANISOU 2793 O GLN A 210 902 394 689 175 261 36 O ATOM 2794 CB GLN A 210 0.866 -14.064 27.706 1.00 5.10 C ANISOU 2794 CB GLN A 210 645 572 719 -67 366 57 C ATOM 2795 CG GLN A 210 -0.006 -15.176 28.269 1.00 6.66 C ANISOU 2795 CG GLN A 210 890 799 843 -97 397 114 C ATOM 2796 CD GLN A 210 -0.559 -14.857 29.658 1.00 6.81 C ANISOU 2796 CD GLN A 210 1021 768 796 19 404 205 C ATOM 2797 OE1 GLN A 210 -0.642 -13.702 30.065 1.00 6.23 O ANISOU 2797 OE1 GLN A 210 998 693 676 48 501 214 O ATOM 2798 NE2 GLN A 210 -0.968 -15.895 30.378 1.00 7.90 N ANISOU 2798 NE2 GLN A 210 1133 896 971 90 509 311 N ATOM 2799 H GLN A 210 -0.379 -13.655 25.498 1.00 5.90 H ATOM 2800 HA GLN A 210 -0.503 -12.553 27.972 1.00 5.86 H ATOM 2801 HB2 GLN A 210 1.360 -14.426 26.954 1.00 6.11 H ATOM 2802 HB3 GLN A 210 1.482 -13.788 28.402 1.00 6.11 H ATOM 2803 HG2 GLN A 210 -0.758 -15.319 27.673 1.00 8.00 H ATOM 2804 HG3 GLN A 210 0.522 -15.987 28.336 1.00 8.00 H ATOM 2805 HE21 GLN A 210 -1.288 -15.772 31.167 1.00 9.47 H ATOM 2806 HE22 GLN A 210 -0.913 -16.690 30.055 1.00 9.47 H ATOM 2807 N GLY A 211 1.421 -11.523 25.681 1.00 5.10 N ANISOU 2807 N GLY A 211 707 580 652 -168 127 49 N ATOM 2808 CA GLY A 211 2.390 -10.497 25.342 1.00 5.61 C ANISOU 2808 CA GLY A 211 716 654 764 -22 201 70 C ATOM 2809 C GLY A 211 2.097 -9.695 24.098 1.00 5.29 C ANISOU 2809 C GLY A 211 675 598 736 -16 238 8 C ATOM 2810 O GLY A 211 1.385 -10.157 23.189 1.00 5.50 O ANISOU 2810 O GLY A 211 723 571 795 -1 86 62 O ATOM 2811 H GLY A 211 1.137 -11.987 25.014 1.00 6.12 H ATOM 2812 HA2 GLY A 211 2.458 -9.876 26.084 1.00 6.74 H ATOM 2813 HA3 GLY A 211 3.257 -10.915 25.225 1.00 6.74 H ATOM 2814 N VAL A 212 2.657 -8.480 24.068 1.00 5.04 N ANISOU 2814 N VAL A 212 700 576 640 -20 410 -47 N ATOM 2815 CA VAL A 212 2.727 -7.656 22.859 1.00 4.78 C ANISOU 2815 CA VAL A 212 708 533 576 122 156 158 C ATOM 2816 C VAL A 212 4.211 -7.510 22.460 1.00 4.31 C ANISOU 2816 C VAL A 212 581 554 504 119 69 99 C ATOM 2817 O VAL A 212 5.042 -7.110 23.289 1.00 3.79 O ANISOU 2817 O VAL A 212 459 529 452 -22 -25 67 O ATOM 2818 CB VAL A 212 2.135 -6.241 23.105 1.00 5.44 C ANISOU 2818 CB VAL A 212 697 711 660 367 184 152 C ATOM 2819 CG1 VAL A 212 2.213 -5.389 21.846 1.00 5.74 C ANISOU 2819 CG1 VAL A 212 758 716 706 443 167 304 C ATOM 2820 CG2 VAL A 212 0.698 -6.327 23.616 1.00 6.91 C ANISOU 2820 CG2 VAL A 212 925 836 864 271 407 -13 C ATOM 2821 H VAL A 212 3.013 -8.104 24.755 1.00 6.05 H ATOM 2822 HA VAL A 212 2.238 -8.087 22.127 1.00 5.74 H ATOM 2823 HB VAL A 212 2.668 -5.796 23.796 1.00 6.53 H ATOM 2824 HG11 VAL A 212 1.840 -4.524 22.032 1.00 6.89 H ATOM 2825 HG12 VAL A 212 3.133 -5.301 21.586 1.00 6.89 H ATOM 2826 HG13 VAL A 212 1.714 -5.818 21.148 1.00 6.89 H ATOM 2827 HG21 VAL A 212 0.364 -5.439 23.757 1.00 8.29 H ATOM 2828 HG22 VAL A 212 0.161 -6.780 22.962 1.00 8.29 H ATOM 2829 HG23 VAL A 212 0.690 -6.816 24.442 1.00 8.29 H ATOM 2830 N VAL A 213 4.563 -7.858 21.219 1.00 4.45 N ANISOU 2830 N VAL A 213 527 583 579 -37 101 144 N ATOM 2831 CA VAL A 213 5.934 -7.648 20.709 1.00 4.18 C ANISOU 2831 CA VAL A 213 545 477 566 28 182 24 C ATOM 2832 C VAL A 213 6.327 -6.173 20.893 1.00 4.22 C ANISOU 2832 C VAL A 213 536 494 572 20 103 0 C ATOM 2833 O VAL A 213 5.606 -5.266 20.450 1.00 5.18 O ANISOU 2833 O VAL A 213 759 584 623 108 116 68 O ATOM 2834 CB VAL A 213 6.032 -8.009 19.216 1.00 4.48 C ANISOU 2834 CB VAL A 213 558 535 609 45 167 -86 C ATOM 2835 CG1 VAL A 213 7.472 -7.850 18.706 1.00 6.08 C ANISOU 2835 CG1 VAL A 213 721 825 763 -7 164 -13 C ATOM 2836 CG2 VAL A 213 5.556 -9.434 18.963 1.00 5.98 C ANISOU 2836 CG2 VAL A 213 781 732 758 196 238 -25 C ATOM 2837 H VAL A 213 4.030 -8.217 20.648 1.00 5.34 H ATOM 2838 HA VAL A 213 6.563 -8.207 21.211 1.00 5.01 H ATOM 2839 HB VAL A 213 5.460 -7.402 18.702 1.00 5.38 H ATOM 2840 HG11 VAL A 213 7.501 -8.082 17.775 1.00 7.29 H ATOM 2841 HG12 VAL A 213 7.747 -6.938 18.825 1.00 7.29 H ATOM 2842 HG13 VAL A 213 8.047 -8.433 19.207 1.00 7.29 H ATOM 2843 HG21 VAL A 213 5.630 -9.626 18.026 1.00 7.17 H ATOM 2844 HG22 VAL A 213 6.104 -10.040 19.467 1.00 7.17 H ATOM 2845 HG23 VAL A 213 4.640 -9.511 19.242 1.00 7.17 H ATOM 2846 N SER A 214 7.449 -5.932 21.572 1.00 4.07 N ANISOU 2846 N SER A 214 466 416 665 67 93 14 N ATOM 2847 CA SER A 214 7.887 -4.561 21.891 1.00 4.59 C ANISOU 2847 CA SER A 214 558 516 669 23 21 -32 C ATOM 2848 C SER A 214 9.298 -4.238 21.370 1.00 4.43 C ANISOU 2848 C SER A 214 614 453 615 -37 26 128 C ATOM 2849 O SER A 214 9.438 -3.517 20.368 1.00 4.64 O ANISOU 2849 O SER A 214 569 614 579 -131 212 174 O ATOM 2850 CB SER A 214 7.744 -4.297 23.405 1.00 4.93 C ANISOU 2850 CB SER A 214 645 518 711 -97 24 -149 C ATOM 2851 OG SER A 214 7.988 -2.938 23.745 1.00 6.01 O ANISOU 2851 OG SER A 214 793 727 764 -169 56 -342 O ATOM 2852 H SER A 214 7.979 -6.544 21.863 1.00 4.88 H ATOM 2853 HA SER A 214 7.275 -3.943 21.440 1.00 5.50 H ATOM 2854 HB2 SER A 214 6.842 -4.528 23.677 1.00 5.92 H ATOM 2855 HB3 SER A 214 8.381 -4.854 23.879 1.00 5.92 H ATOM 2856 HG SER A 214 8.167 -2.508 23.071 1.00 7.21 H ATOM 2857 N TRP A 215 10.341 -4.729 22.036 1.00 3.94 N ANISOU 2857 N TRP A 215 525 414 558 -115 -43 73 N ATOM 2858 CA TRP A 215 11.698 -4.336 21.671 1.00 4.87 C ANISOU 2858 CA TRP A 215 626 602 623 14 29 66 C ATOM 2859 C TRP A 215 12.745 -5.405 21.950 1.00 4.37 C ANISOU 2859 C TRP A 215 542 517 600 80 96 116 C ATOM 2860 O TRP A 215 12.441 -6.454 22.524 1.00 4.94 O ANISOU 2860 O TRP A 215 711 583 583 56 225 250 O ATOM 2861 CB TRP A 215 12.095 -3.028 22.367 1.00 3.97 C ANISOU 2861 CB TRP A 215 481 450 579 169 64 -57 C ATOM 2862 CG TRP A 215 12.175 -3.092 23.900 1.00 4.37 C ANISOU 2862 CG TRP A 215 607 423 629 74 67 -172 C ATOM 2863 CD1 TRP A 215 11.144 -2.934 24.771 1.00 4.45 C ANISOU 2863 CD1 TRP A 215 500 552 640 78 -57 -57 C ATOM 2864 CD2 TRP A 215 13.352 -3.290 24.708 1.00 4.66 C ANISOU 2864 CD2 TRP A 215 588 490 691 -115 144 -213 C ATOM 2865 NE1 TRP A 215 11.594 -3.024 26.077 1.00 5.20 N ANISOU 2865 NE1 TRP A 215 634 689 651 -49 47 -231 N ATOM 2866 CE2 TRP A 215 12.947 -3.252 26.057 1.00 4.90 C ANISOU 2866 CE2 TRP A 215 683 521 660 -150 -7 -179 C ATOM 2867 CE3 TRP A 215 14.704 -3.513 24.419 1.00 6.51 C ANISOU 2867 CE3 TRP A 215 793 779 902 -176 165 -79 C ATOM 2868 CZ2 TRP A 215 13.844 -3.399 27.104 1.00 5.90 C ANISOU 2868 CZ2 TRP A 215 762 710 768 -147 -58 -171 C ATOM 2869 CZ3 TRP A 215 15.584 -3.673 25.458 1.00 7.78 C ANISOU 2869 CZ3 TRP A 215 901 1065 989 -144 138 -112 C ATOM 2870 CH2 TRP A 215 15.151 -3.628 26.786 1.00 7.31 C ANISOU 2870 CH2 TRP A 215 908 1011 860 -240 -65 -146 C ATOM 2871 H TRP A 215 10.291 -5.282 22.693 1.00 4.73 H ATOM 2872 HA TRP A 215 11.713 -4.165 20.706 1.00 5.85 H ATOM 2873 HB2 TRP A 215 12.969 -2.760 22.041 1.00 4.77 H ATOM 2874 HB3 TRP A 215 11.442 -2.348 22.138 1.00 4.77 H ATOM 2875 HD1 TRP A 215 10.261 -2.777 24.524 1.00 5.34 H ATOM 2876 HE1 TRP A 215 11.106 -2.957 26.782 1.00 6.23 H ATOM 2877 HE3 TRP A 215 15.001 -3.542 23.538 1.00 7.81 H ATOM 2878 HZ2 TRP A 215 13.572 -3.310 27.989 1.00 7.08 H ATOM 2879 HZ3 TRP A 215 16.484 -3.817 25.276 1.00 9.33 H ATOM 2880 HH2 TRP A 215 15.772 -3.739 27.469 1.00 8.78 H ATOM 2881 N GLY A 216 13.973 -5.134 21.523 1.00 4.48 N ANISOU 2881 N GLY A 216 605 486 613 13 228 179 N ATOM 2882 CA GLY A 216 15.128 -5.946 21.879 1.00 4.39 C ANISOU 2882 CA GLY A 216 528 564 575 11 73 52 C ATOM 2883 C GLY A 216 16.379 -5.258 21.360 1.00 4.99 C ANISOU 2883 C GLY A 216 442 770 684 133 101 99 C ATOM 2884 O GLY A 216 16.293 -4.277 20.632 1.00 5.81 O ANISOU 2884 O GLY A 216 390 949 867 190 -4 201 O ATOM 2885 H GLY A 216 14.165 -4.468 21.014 1.00 5.38 H ATOM 2886 HA2 GLY A 216 15.190 -6.038 22.843 1.00 5.26 H ATOM 2887 HA3 GLY A 216 15.057 -6.826 21.477 1.00 5.26 H ATOM 2888 N HIS A 217 17.557 -5.735 21.743 1.00 6.69 N ANISOU 2888 N HIS A 217 689 958 893 -130 173 8 N ATOM 2889 CA AHIS A 217 18.800 -5.214 21.170 0.51 8.58 C ANISOU 2889 CA AHIS A 217 1006 1124 1130 -154 89 -33 C ATOM 2890 CA BHIS A 217 18.791 -5.209 21.172 0.49 7.58 C ANISOU 2890 CA BHIS A 217 848 1065 965 -140 112 -65 C ATOM 2891 C HIS A 217 19.177 -6.088 19.994 1.00 7.78 C ANISOU 2891 C HIS A 217 839 1018 1098 -164 118 -107 C ATOM 2892 O HIS A 217 19.573 -7.249 20.163 1.00 7.04 O ANISOU 2892 O HIS A 217 690 832 1152 -46 303 -189 O ATOM 2893 CB AHIS A 217 19.928 -5.195 22.196 0.51 8.94 C ANISOU 2893 CB AHIS A 217 1098 1096 1202 -294 23 -160 C ATOM 2894 CB BHIS A 217 19.873 -5.130 22.248 0.49 7.43 C ANISOU 2894 CB BHIS A 217 884 1073 864 -279 52 -272 C ATOM 2895 CG AHIS A 217 21.155 -4.490 21.713 0.51 10.01 C ANISOU 2895 CG AHIS A 217 1229 1172 1403 -413 123 -198 C ATOM 2896 CG BHIS A 217 19.636 -4.035 23.243 0.49 8.05 C ANISOU 2896 CG BHIS A 217 1040 1222 798 -369 124 -360 C ATOM 2897 ND1AHIS A 217 21.505 -3.227 22.143 0.51 11.43 N ANISOU 2897 ND1AHIS A 217 1374 1361 1607 -405 251 -176 N ATOM 2898 ND1BHIS A 217 20.497 -3.773 24.285 0.49 8.74 N ANISOU 2898 ND1BHIS A 217 1213 1279 830 -393 214 -345 N ATOM 2899 CD2AHIS A 217 22.099 -4.857 20.817 0.51 10.73 C ANISOU 2899 CD2AHIS A 217 1375 1233 1469 -593 260 -168 C ATOM 2900 CD2BHIS A 217 18.645 -3.115 23.333 0.49 8.36 C ANISOU 2900 CD2BHIS A 217 1169 1278 731 -434 168 -445 C ATOM 2901 CE1AHIS A 217 22.627 -2.860 21.552 0.51 12.30 C ANISOU 2901 CE1AHIS A 217 1515 1460 1698 -522 277 -161 C ATOM 2902 CE1BHIS A 217 20.038 -2.752 24.987 0.49 8.46 C ANISOU 2902 CE1BHIS A 217 1191 1279 745 -300 255 -528 C ATOM 2903 NE2AHIS A 217 23.008 -3.829 20.739 0.51 11.48 N ANISOU 2903 NE2AHIS A 217 1422 1345 1597 -570 216 -185 N ATOM 2904 NE2BHIS A 217 18.915 -2.332 24.428 0.49 8.32 N ANISOU 2904 NE2BHIS A 217 1179 1284 698 -408 182 -554 N ATOM 2905 H AHIS A 217 17.668 -6.355 22.328 1.00 8.02 H ATOM 2906 HA AHIS A 217 18.655 -4.300 20.848 0.51 10.30 H ATOM 2907 HB2AHIS A 217 19.618 -4.742 22.995 0.51 10.73 H ATOM 2908 HB3AHIS A 217 20.174 -6.109 22.409 0.51 10.73 H ATOM 2909 HD2AHIS A 217 22.134 -5.661 20.352 0.51 12.88 H ATOM 2910 HE1AHIS A 217 23.069 -2.051 21.678 0.51 14.76 H ATOM 2911 N GLY A 219 19.029 -5.542 18.792 1.00 8.31 N ANISOU 2911 N GLY A 219 972 1029 1157 -95 52 -197 N ATOM 2912 CA GLY A 219 19.126 -6.356 17.584 1.00 9.50 C ANISOU 2912 CA GLY A 219 1133 1203 1274 -198 -125 -268 C ATOM 2913 C GLY A 219 17.911 -7.279 17.503 1.00 8.69 C ANISOU 2913 C GLY A 219 992 1102 1208 -140 -74 -182 C ATOM 2914 O GLY A 219 16.919 -7.052 18.186 1.00 7.72 O ANISOU 2914 O GLY A 219 836 853 1245 92 52 -108 O ATOM 2915 H GLY A 219 18.873 -4.709 18.648 1.00 9.98 H ATOM 2916 HA2 GLY A 219 19.146 -5.787 16.799 1.00 11.40 H ATOM 2917 HA3 GLY A 219 19.932 -6.894 17.608 1.00 11.40 H ATOM 2918 N CYS A 220 18.003 -8.306 16.667 1.00 8.45 N ANISOU 2918 N CYS A 220 1020 1067 1122 -194 -161 -188 N ATOM 2919 CA CYS A 220 16.996 -9.378 16.571 1.00 8.37 C ANISOU 2919 CA CYS A 220 1023 1067 1090 -77 -87 -67 C ATOM 2920 C CYS A 220 17.753 -10.682 16.597 1.00 8.18 C ANISOU 2920 C CYS A 220 937 1122 1049 14 -37 42 C ATOM 2921 O CYS A 220 18.650 -10.893 15.772 1.00 8.56 O ANISOU 2921 O CYS A 220 841 1272 1138 -109 2 79 O ATOM 2922 CB CYS A 220 16.195 -9.311 15.248 1.00 10.78 C ANISOU 2922 CB CYS A 220 1317 1297 1481 101 -46 23 C ATOM 2923 SG CYS A 220 15.414 -7.765 14.939 1.00 10.31 S ANISOU 2923 SG CYS A 220 1147 1251 1520 62 79 72 S ATOM 2924 H CYS A 220 18.661 -8.414 16.124 1.00 10.14 H ATOM 2925 HA CYS A 220 16.379 -9.341 17.331 1.00 10.04 H ATOM 2926 HB2 CYS A 220 16.801 -9.487 14.510 1.00 12.93 H ATOM 2927 HB3 CYS A 220 15.503 -9.991 15.270 1.00 12.93 H ATOM 2928 N ALA A 221 17.406 -11.560 17.535 1.00 7.34 N ANISOU 2928 N ALA A 221 787 1021 979 21 27 197 N ATOM 2929 CA ALA A 221 18.002 -12.900 17.605 1.00 8.86 C ANISOU 2929 CA ALA A 221 971 1205 1190 119 -22 55 C ATOM 2930 C ALA A 221 19.516 -12.914 17.916 1.00 8.95 C ANISOU 2930 C ALA A 221 869 1286 1244 63 51 38 C ATOM 2931 O ALA A 221 20.210 -13.897 17.612 1.00 9.26 O ANISOU 2931 O ALA A 221 855 1345 1319 33 24 83 O ATOM 2932 CB ALA A 221 17.710 -13.674 16.319 1.00 11.64 C ANISOU 2932 CB ALA A 221 1391 1536 1497 422 -89 -114 C ATOM 2933 H ALA A 221 16.823 -11.406 18.148 1.00 8.80 H ATOM 2934 HA ALA A 221 17.561 -13.384 18.334 1.00 10.63 H ATOM 2935 HB1 ALA A 221 18.107 -14.546 16.383 1.00 13.97 H ATOM 2936 HB2 ALA A 221 16.759 -13.753 16.211 1.00 13.97 H ATOM 2937 HB3 ALA A 221 18.086 -13.197 15.576 1.00 13.97 H ATOM 2938 N TRP A 221A 20.029 -11.835 18.509 1.00 9.11 N ANISOU 2938 N TRP A 221A 972 1217 1274 147 89 156 N ATOM 2939 CA TRP A 221A 21.415 -11.804 18.973 1.00 8.82 C ANISOU 2939 CA TRP A 221A 1010 1103 1237 31 106 73 C ATOM 2940 C TRP A 221A 21.600 -12.678 20.228 1.00 7.65 C ANISOU 2940 C TRP A 221A 756 1062 1088 134 -112 63 C ATOM 2941 O TRP A 221A 20.697 -12.795 21.058 1.00 7.89 O ANISOU 2941 O TRP A 221A 846 1189 963 221 -54 -50 O ATOM 2942 CB TRP A 221A 21.843 -10.365 19.292 1.00 10.23 C ANISOU 2942 CB TRP A 221A 1246 1246 1395 -192 335 208 C ATOM 2943 CG TRP A 221A 21.995 -9.445 18.108 1.00 14.72 C ANISOU 2943 CG TRP A 221A 1740 1846 2009 148 453 417 C ATOM 2944 CD1 TRP A 221A 21.468 -9.589 16.854 1.00 19.50 C ANISOU 2944 CD1 TRP A 221A 2353 2477 2578 151 489 552 C ATOM 2945 CD2 TRP A 221A 22.683 -8.196 18.114 1.00 16.40 C ANISOU 2945 CD2 TRP A 221A 1920 2009 2303 325 587 459 C ATOM 2946 NE1 TRP A 221A 21.831 -8.504 16.061 1.00 18.33 N ANISOU 2946 NE1 TRP A 221A 2163 2343 2457 74 556 654 N ATOM 2947 CE2 TRP A 221A 22.573 -7.638 16.821 1.00 17.08 C ANISOU 2947 CE2 TRP A 221A 2004 2100 2385 249 644 515 C ATOM 2948 CE3 TRP A 221A 23.408 -7.505 19.086 1.00 20.01 C ANISOU 2948 CE3 TRP A 221A 2495 2456 2652 331 693 437 C ATOM 2949 CZ2 TRP A 221A 23.142 -6.412 16.486 1.00 18.31 C ANISOU 2949 CZ2 TRP A 221A 2228 2270 2457 211 685 490 C ATOM 2950 CZ3 TRP A 221A 23.989 -6.289 18.745 1.00 23.05 C ANISOU 2950 CZ3 TRP A 221A 2903 2831 3023 133 719 359 C ATOM 2951 CH2 TRP A 221A 23.845 -5.755 17.463 1.00 20.46 C ANISOU 2951 CH2 TRP A 221A 2591 2467 2717 143 742 397 C ATOM 2952 H TRP A 221A 19.594 -11.107 18.654 1.00 10.93 H ATOM 2953 HA TRP A 221A 22.001 -12.150 18.268 1.00 10.58 H ATOM 2954 HB2 TRP A 221A 21.178 -9.972 19.879 1.00 12.28 H ATOM 2955 HB3 TRP A 221A 22.699 -10.394 19.747 1.00 12.28 H ATOM 2956 HD1 TRP A 221A 20.966 -10.317 16.566 1.00 23.39 H ATOM 2957 HE1 TRP A 221A 21.612 -8.388 15.237 1.00 21.99 H ATOM 2958 HE3 TRP A 221A 23.499 -7.850 19.945 1.00 24.01 H ATOM 2959 HZ2 TRP A 221A 23.001 -6.027 15.651 1.00 21.97 H ATOM 2960 HZ3 TRP A 221A 24.465 -5.813 19.387 1.00 27.66 H ATOM 2961 HH2 TRP A 221A 24.246 -4.941 17.263 1.00 24.56 H ATOM 2962 N LYS A 222 22.786 -13.266 20.388 1.00 7.95 N ANISOU 2962 N LYS A 222 849 994 1178 385 -232 88 N ATOM 2963 CA LYS A 222 23.101 -14.033 21.587 1.00 10.62 C ANISOU 2963 CA LYS A 222 1130 1395 1509 466 -444 121 C ATOM 2964 C LYS A 222 22.918 -13.181 22.843 1.00 10.19 C ANISOU 2964 C LYS A 222 1086 1320 1467 256 -445 208 C ATOM 2965 O LYS A 222 23.294 -12.007 22.874 1.00 9.95 O ANISOU 2965 O LYS A 222 1004 1332 1442 149 -343 66 O ATOM 2966 CB LYS A 222 24.542 -14.577 21.518 1.00 17.61 C ANISOU 2966 CB LYS A 222 2132 2232 2328 433 -536 78 C ATOM 2967 CG LYS A 222 24.887 -15.582 22.609 1.00 26.27 C ANISOU 2967 CG LYS A 222 3306 3357 3317 333 -459 10 C ATOM 2968 CD LYS A 222 26.327 -16.057 22.500 0.00 25.87 C ANISOU 2968 CD LYS A 222 3264 3274 3290 279 -432 -15 C ATOM 2969 CE LYS A 222 27.309 -14.926 22.758 0.00 24.99 C ANISOU 2969 CE LYS A 222 3160 3155 3181 214 -413 -50 C ATOM 2970 NZ LYS A 222 28.722 -15.395 22.734 0.00 24.84 N ANISOU 2970 NZ LYS A 222 3130 3126 3182 168 -388 -77 N ATOM 2971 H LYS A 222 23.425 -13.234 19.813 1.00 9.54 H ATOM 2972 HA LYS A 222 22.490 -14.798 21.648 1.00 12.74 H ATOM 2973 HB2 LYS A 222 24.667 -15.016 20.662 1.00 21.14 H ATOM 2974 HB3 LYS A 222 25.159 -13.833 21.597 1.00 21.14 H ATOM 2975 HG2 LYS A 222 24.770 -15.165 23.477 1.00 31.52 H ATOM 2976 HG3 LYS A 222 24.306 -16.354 22.527 1.00 31.52 H ATOM 2977 HD2 LYS A 222 26.485 -16.752 23.157 0.00 31.04 H ATOM 2978 HD3 LYS A 222 26.485 -16.398 21.606 0.00 31.04 H ATOM 2979 HE2 LYS A 222 27.204 -14.249 22.071 0.00 29.99 H ATOM 2980 HE3 LYS A 222 27.133 -14.544 23.632 0.00 29.99 H ATOM 2981 HZ1 LYS A 222 29.315 -14.659 22.900 0.00 29.81 H ATOM 2982 HZ2 LYS A 222 28.857 -16.063 23.409 0.00 29.81 H ATOM 2983 HZ3 LYS A 222 28.926 -15.774 21.875 0.00 29.81 H ATOM 2984 N ASN A 223 22.300 -13.789 23.857 1.00 11.23 N ANISOU 2984 N ASN A 223 1308 1490 1467 39 -447 285 N ATOM 2985 CA ASN A 223 22.095 -13.184 25.179 1.00 11.59 C ANISOU 2985 CA ASN A 223 1377 1512 1515 169 -456 313 C ATOM 2986 C ASN A 223 21.190 -11.962 25.203 1.00 10.03 C ANISOU 2986 C ASN A 223 1118 1370 1325 24 -210 281 C ATOM 2987 O ASN A 223 21.136 -11.242 26.202 1.00 10.24 O ANISOU 2987 O ASN A 223 1093 1484 1315 316 -137 209 O ATOM 2988 CB ASN A 223 23.443 -12.839 25.831 1.00 14.20 C ANISOU 2988 CB ASN A 223 1717 1820 1859 306 -781 352 C ATOM 2989 CG ASN A 223 24.275 -14.069 26.125 1.00 21.35 C ANISOU 2989 CG ASN A 223 2634 2747 2729 520 -1023 394 C ATOM 2990 OD1 ASN A 223 23.749 -15.115 26.498 1.00 22.49 O ANISOU 2990 OD1 ASN A 223 2751 2972 2824 675 -1138 526 O ATOM 2991 ND2 ASN A 223 25.580 -13.948 25.963 1.00 28.98 N ANISOU 2991 ND2 ASN A 223 3647 3684 3679 694 -1067 372 N ATOM 2992 H ASN A 223 21.977 -14.584 23.801 1.00 13.47 H ATOM 2993 HA ASN A 223 21.670 -13.858 25.750 1.00 13.91 H ATOM 2994 HB2 ASN A 223 23.949 -12.270 25.231 1.00 17.04 H ATOM 2995 HB3 ASN A 223 23.281 -12.378 26.669 1.00 17.04 H ATOM 2996 HD21 ASN A 223 26.169 -14.712 26.139 1.00 34.77 H ATOM 2997 HD22 ASN A 223 25.960 -13.095 25.667 1.00 34.77 H ATOM 2998 N ARG A 224 20.461 -11.738 24.117 1.00 7.81 N ANISOU 2998 N ARG A 224 890 979 1099 19 -105 373 N ATOM 2999 CA AARG A 224 19.566 -10.587 24.018 0.51 8.54 C ANISOU 2999 CA AARG A 224 1021 1081 1142 -67 -28 259 C ATOM 3000 CA BARG A 224 19.575 -10.585 24.017 0.49 7.71 C ANISOU 3000 CA BARG A 224 859 946 1124 -8 26 309 C ATOM 3001 C ARG A 224 18.195 -11.040 23.521 1.00 7.58 C ANISOU 3001 C ARG A 224 900 927 1051 -121 51 136 C ATOM 3002 O ARG A 224 17.848 -10.869 22.353 1.00 7.78 O ANISOU 3002 O ARG A 224 998 948 1009 -186 126 -59 O ATOM 3003 CB AARG A 224 20.142 -9.530 23.078 0.51 9.99 C ANISOU 3003 CB AARG A 224 1240 1244 1310 -246 -160 168 C ATOM 3004 CB BARG A 224 20.186 -9.520 23.095 0.49 8.79 C ANISOU 3004 CB BARG A 224 1040 1043 1258 -92 33 302 C ATOM 3005 CG AARG A 224 21.545 -9.069 23.457 0.51 15.07 C ANISOU 3005 CG AARG A 224 1898 1888 1939 -443 -337 24 C ATOM 3006 CG BARG A 224 21.573 -9.006 23.554 0.49 9.95 C ANISOU 3006 CG BARG A 224 1161 1202 1417 -202 144 244 C ATOM 3007 CD AARG A 224 21.594 -8.244 24.737 0.51 15.29 C ANISOU 3007 CD AARG A 224 1896 1922 1994 -475 -453 -100 C ATOM 3008 CD BARG A 224 22.192 -8.036 22.531 0.49 12.98 C ANISOU 3008 CD BARG A 224 1569 1694 1670 16 268 217 C ATOM 3009 NE AARG A 224 22.989 -7.969 25.080 0.51 17.73 N ANISOU 3009 NE AARG A 224 2198 2262 2276 -585 -529 -286 N ATOM 3010 NE BARG A 224 23.650 -8.143 22.418 0.49 15.42 N ANISOU 3010 NE BARG A 224 1953 2024 1883 -7 228 141 N ATOM 3011 CZ AARG A 224 23.638 -8.461 26.137 0.51 18.53 C ANISOU 3011 CZ AARG A 224 2314 2352 2376 -631 -671 -453 C ATOM 3012 CZ BARG A 224 24.516 -7.170 22.696 0.49 16.21 C ANISOU 3012 CZ BARG A 224 2038 2125 1996 184 222 133 C ATOM 3013 NH1AARG A 224 23.022 -9.227 27.039 0.51 16.69 N ANISOU 3013 NH1AARG A 224 2085 2088 2168 -672 -750 -563 N ATOM 3014 NH1BARG A 224 24.092 -5.988 23.121 0.49 16.68 N ANISOU 3014 NH1BARG A 224 2136 2193 2011 248 262 161 N ATOM 3015 NH2AARG A 224 24.917 -8.158 26.303 0.51 21.78 N ANISOU 3015 NH2AARG A 224 2711 2777 2788 -568 -705 -489 N ATOM 3016 NH2BARG A 224 25.813 -7.376 22.535 0.49 16.49 N ANISOU 3016 NH2BARG A 224 2098 2137 2031 328 201 127 N ATOM 3017 H AARG A 224 20.465 -12.239 23.418 1.00 9.37 H ATOM 3018 HA AARG A 224 19.455 -10.184 24.904 0.51 10.25 H ATOM 3019 HB2AARG A 224 20.183 -9.899 22.181 0.51 11.98 H ATOM 3020 HB3AARG A 224 19.562 -8.753 23.087 0.51 11.98 H ATOM 3021 HG2AARG A 224 22.106 -9.849 23.585 0.51 18.08 H ATOM 3022 HG3AARG A 224 21.899 -8.523 22.738 0.51 18.08 H ATOM 3023 HD2AARG A 224 21.135 -7.400 24.600 0.51 18.35 H ATOM 3024 HD3AARG A 224 21.187 -8.741 25.464 0.51 18.35 H ATOM 3025 HE AARG A 224 23.484 -7.380 24.490 0.51 21.27 H ATOM 3026 HH11AARG A 224 22.195 -9.435 26.934 0.51 20.03 H ATOM 3027 HH12AARG A 224 23.458 -9.525 27.718 0.51 20.03 H ATOM 3028 HH21AARG A 224 25.317 -7.654 25.733 0.51 26.14 H ATOM 3029 HH22AARG A 224 25.342 -8.449 26.992 0.51 26.14 H ATOM 3030 N PRO A 225 17.393 -11.617 24.418 1.00 7.41 N ANISOU 3030 N PRO A 225 875 965 976 -110 86 155 N ATOM 3031 CA PRO A 225 16.062 -12.127 24.065 1.00 6.40 C ANISOU 3031 CA PRO A 225 758 812 862 -129 143 95 C ATOM 3032 C PRO A 225 15.056 -11.015 23.759 1.00 5.08 C ANISOU 3032 C PRO A 225 628 560 741 -100 64 3 C ATOM 3033 O PRO A 225 15.321 -9.837 24.028 1.00 5.54 O ANISOU 3033 O PRO A 225 602 683 818 10 55 -177 O ATOM 3034 CB PRO A 225 15.656 -12.899 25.328 1.00 8.12 C ANISOU 3034 CB PRO A 225 971 1063 1052 -99 59 149 C ATOM 3035 CG PRO A 225 16.345 -12.177 26.455 1.00 10.22 C ANISOU 3035 CG PRO A 225 1234 1318 1332 -40 105 194 C ATOM 3036 CD PRO A 225 17.664 -11.705 25.867 1.00 9.04 C ANISOU 3036 CD PRO A 225 1047 1224 1162 46 138 220 C ATOM 3037 HA PRO A 225 16.118 -12.743 23.305 1.00 7.68 H ATOM 3038 HB2 PRO A 225 14.693 -12.868 25.437 1.00 9.74 H ATOM 3039 HB3 PRO A 225 15.967 -13.816 25.266 1.00 9.74 H ATOM 3040 HG2 PRO A 225 15.805 -11.422 26.738 1.00 12.26 H ATOM 3041 HG3 PRO A 225 16.496 -12.788 27.193 1.00 12.26 H ATOM 3042 HD2 PRO A 225 17.897 -10.832 26.219 1.00 10.84 H ATOM 3043 HD3 PRO A 225 18.362 -12.356 26.040 1.00 10.84 H ATOM 3044 N GLY A 226 13.907 -11.386 23.195 1.00 5.39 N ANISOU 3044 N GLY A 226 653 640 755 -27 132 -3 N ATOM 3045 CA GLY A 226 12.843 -10.426 22.930 1.00 4.80 C ANISOU 3045 CA GLY A 226 607 622 596 154 100 46 C ATOM 3046 C GLY A 226 12.201 -9.938 24.217 1.00 3.96 C ANISOU 3046 C GLY A 226 462 572 472 162 73 138 C ATOM 3047 O GLY A 226 12.032 -10.725 25.159 1.00 4.28 O ANISOU 3047 O GLY A 226 648 579 399 141 99 136 O ATOM 3048 H GLY A 226 13.720 -12.191 22.956 1.00 6.47 H ATOM 3049 HA2 GLY A 226 13.205 -9.662 22.455 1.00 5.76 H ATOM 3050 HA3 GLY A 226 12.160 -10.839 22.380 1.00 5.76 H ATOM 3051 N VAL A 227 11.824 -8.656 24.233 1.00 4.43 N ANISOU 3051 N VAL A 227 548 614 522 54 202 146 N ATOM 3052 CA VAL A 227 11.127 -8.034 25.350 1.00 3.94 C ANISOU 3052 CA VAL A 227 521 399 577 66 86 102 C ATOM 3053 C VAL A 227 9.694 -7.693 24.913 1.00 3.97 C ANISOU 3053 C VAL A 227 522 421 566 64 25 66 C ATOM 3054 O VAL A 227 9.467 -7.117 23.835 1.00 4.54 O ANISOU 3054 O VAL A 227 568 485 672 40 24 79 O ATOM 3055 CB VAL A 227 11.872 -6.776 25.882 1.00 5.00 C ANISOU 3055 CB VAL A 227 605 593 701 47 -2 170 C ATOM 3056 CG1 VAL A 227 11.218 -6.270 27.161 1.00 5.52 C ANISOU 3056 CG1 VAL A 227 739 627 732 78 -10 176 C ATOM 3057 CG2 VAL A 227 13.346 -7.087 26.144 1.00 6.05 C ANISOU 3057 CG2 VAL A 227 709 762 827 124 -5 285 C ATOM 3058 H VAL A 227 11.969 -8.112 23.583 1.00 5.32 H ATOM 3059 HA VAL A 227 11.070 -8.680 26.085 1.00 4.73 H ATOM 3060 HB VAL A 227 11.823 -6.064 25.210 1.00 6.00 H ATOM 3061 HG11 VAL A 227 11.694 -5.495 27.469 1.00 6.63 H ATOM 3062 HG12 VAL A 227 10.305 -6.041 26.975 1.00 6.63 H ATOM 3063 HG13 VAL A 227 11.254 -6.962 27.825 1.00 6.63 H ATOM 3064 HG21 VAL A 227 13.778 -6.294 26.471 1.00 7.25 H ATOM 3065 HG22 VAL A 227 13.405 -7.786 26.799 1.00 7.25 H ATOM 3066 HG23 VAL A 227 13.756 -7.370 25.324 1.00 7.25 H ATOM 3067 N TYR A 228 8.746 -8.035 25.778 1.00 4.48 N ANISOU 3067 N TYR A 228 581 586 536 76 160 89 N ATOM 3068 CA TYR A 228 7.310 -8.027 25.485 1.00 3.44 C ANISOU 3068 CA TYR A 228 384 473 451 153 38 32 C ATOM 3069 C TYR A 228 6.528 -7.307 26.586 1.00 3.35 C ANISOU 3069 C TYR A 228 333 518 422 51 115 6 C ATOM 3070 O TYR A 228 6.897 -7.355 27.770 1.00 3.55 O ANISOU 3070 O TYR A 228 418 560 370 206 43 -34 O ATOM 3071 CB TYR A 228 6.794 -9.472 25.322 1.00 3.88 C ANISOU 3071 CB TYR A 228 481 508 484 48 78 46 C ATOM 3072 CG TYR A 228 7.485 -10.187 24.166 1.00 3.90 C ANISOU 3072 CG TYR A 228 471 473 538 168 93 -38 C ATOM 3073 CD1 TYR A 228 8.714 -10.831 24.343 1.00 5.29 C ANISOU 3073 CD1 TYR A 228 660 658 693 134 185 -154 C ATOM 3074 CD2 TYR A 228 6.940 -10.167 22.902 1.00 4.50 C ANISOU 3074 CD2 TYR A 228 553 520 638 203 88 49 C ATOM 3075 CE1 TYR A 228 9.371 -11.430 23.287 1.00 5.12 C ANISOU 3075 CE1 TYR A 228 651 637 659 19 117 -61 C ATOM 3076 CE2 TYR A 228 7.565 -10.776 21.844 1.00 4.77 C ANISOU 3076 CE2 TYR A 228 595 600 618 223 45 8 C ATOM 3077 CZ TYR A 228 8.787 -11.399 22.035 1.00 5.28 C ANISOU 3077 CZ TYR A 228 704 620 682 50 48 -31 C ATOM 3078 OH TYR A 228 9.419 -11.978 20.971 1.00 5.91 O ANISOU 3078 OH TYR A 228 799 685 763 -19 36 18 O ATOM 3079 H TYR A 228 8.917 -8.289 26.582 1.00 5.38 H ATOM 3080 HA TYR A 228 7.158 -7.552 24.642 1.00 4.13 H ATOM 3081 HB2 TYR A 228 6.971 -9.968 26.136 1.00 4.65 H ATOM 3082 HB3 TYR A 228 5.841 -9.452 25.140 1.00 4.65 H ATOM 3083 HD1 TYR A 228 9.109 -10.834 25.185 1.00 6.35 H ATOM 3084 HD2 TYR A 228 6.126 -9.739 22.765 1.00 5.40 H ATOM 3085 HE1 TYR A 228 10.188 -11.855 23.418 1.00 6.15 H ATOM 3086 HE2 TYR A 228 7.183 -10.748 20.997 1.00 5.72 H ATOM 3087 HH TYR A 228 9.530 -12.778 21.112 1.00 7.09 H ATOM 3088 N THR A 229 5.438 -6.650 26.211 1.00 3.68 N ANISOU 3088 N THR A 229 371 519 509 25 172 4 N ATOM 3089 CA THR A 229 4.537 -6.045 27.212 1.00 4.69 C ANISOU 3089 CA THR A 229 602 483 697 -78 113 -93 C ATOM 3090 C THR A 229 3.641 -7.116 27.840 1.00 5.52 C ANISOU 3090 C THR A 229 655 668 773 32 27 -12 C ATOM 3091 O THR A 229 3.052 -7.925 27.120 1.00 4.83 O ANISOU 3091 O THR A 229 605 466 766 -50 -49 -101 O ATOM 3092 CB THR A 229 3.682 -4.945 26.587 1.00 5.82 C ANISOU 3092 CB THR A 229 713 668 830 48 90 -88 C ATOM 3093 OG1 THR A 229 4.556 -3.982 26.003 1.00 5.99 O ANISOU 3093 OG1 THR A 229 700 633 944 189 23 29 O ATOM 3094 CG2 THR A 229 2.800 -4.273 27.639 1.00 6.33 C ANISOU 3094 CG2 THR A 229 840 687 878 137 141 -268 C ATOM 3095 H THR A 229 5.191 -6.537 25.395 1.00 4.42 H ATOM 3096 HA THR A 229 5.075 -5.642 27.925 1.00 5.63 H ATOM 3097 HB THR A 229 3.111 -5.326 25.901 1.00 6.98 H ATOM 3098 HG1 THR A 229 4.120 -3.379 25.659 1.00 7.19 H ATOM 3099 HG21 THR A 229 2.269 -3.585 27.231 1.00 7.60 H ATOM 3100 HG22 THR A 229 2.217 -4.921 28.041 1.00 7.60 H ATOM 3101 HG23 THR A 229 3.348 -3.880 28.323 1.00 7.60 H ATOM 3102 N LYS A 230 3.576 -7.111 29.171 1.00 5.48 N ANISOU 3102 N LYS A 230 711 628 744 115 -14 88 N ATOM 3103 CA LYS A 230 2.775 -8.053 29.949 1.00 5.55 C ANISOU 3103 CA LYS A 230 663 644 802 -114 -154 -2 C ATOM 3104 C LYS A 230 1.291 -7.656 29.901 1.00 5.19 C ANISOU 3104 C LYS A 230 618 609 745 -157 -25 -112 C ATOM 3105 O LYS A 230 0.849 -6.786 30.657 1.00 6.21 O ANISOU 3105 O LYS A 230 665 728 967 -23 -34 -15 O ATOM 3106 CB LYS A 230 3.266 -8.089 31.395 1.00 9.07 C ANISOU 3106 CB LYS A 230 1186 1050 1208 -247 -224 -5 C ATOM 3107 CG LYS A 230 2.694 -9.241 32.212 1.00 15.51 C ANISOU 3107 CG LYS A 230 1949 1980 1964 -89 -388 201 C ATOM 3108 CD LYS A 230 3.351 -9.327 33.592 1.00 21.50 C ANISOU 3108 CD LYS A 230 2694 2742 2734 159 -578 412 C ATOM 3109 CE LYS A 230 4.607 -10.182 33.569 1.00 27.50 C ANISOU 3109 CE LYS A 230 3461 3501 3487 152 -648 570 C ATOM 3110 NZ LYS A 230 5.291 -10.148 34.900 1.00 31.35 N ANISOU 3110 NZ LYS A 230 3950 3955 4006 160 -705 681 N ATOM 3111 H LYS A 230 4.004 -6.549 29.662 1.00 6.58 H ATOM 3112 HA LYS A 230 2.868 -8.951 29.568 1.00 6.66 H ATOM 3113 HB2 LYS A 230 4.232 -8.178 31.394 1.00 10.88 H ATOM 3114 HB3 LYS A 230 3.012 -7.261 31.831 1.00 10.88 H ATOM 3115 HG2 LYS A 230 1.742 -9.103 32.336 1.00 18.61 H ATOM 3116 HG3 LYS A 230 2.855 -10.076 31.745 1.00 18.61 H ATOM 3117 HD2 LYS A 230 3.597 -8.436 33.884 1.00 25.80 H ATOM 3118 HD3 LYS A 230 2.726 -9.725 34.218 1.00 25.80 H ATOM 3119 HE2 LYS A 230 4.369 -11.101 33.370 1.00 33.00 H ATOM 3120 HE3 LYS A 230 5.219 -9.837 32.900 1.00 33.00 H ATOM 3121 HZ1 LYS A 230 6.083 -10.690 34.876 1.00 37.62 H ATOM 3122 HZ2 LYS A 230 5.537 -9.246 35.119 1.00 37.62 H ATOM 3123 HZ3 LYS A 230 4.702 -10.485 35.580 1.00 37.62 H ATOM 3124 N VAL A 231 0.532 -8.319 29.027 1.00 4.60 N ANISOU 3124 N VAL A 231 666 524 560 -198 51 -122 N ATOM 3125 CA VAL A 231 -0.867 -7.988 28.794 1.00 3.71 C ANISOU 3125 CA VAL A 231 559 405 445 -157 82 -107 C ATOM 3126 C VAL A 231 -1.728 -8.151 30.058 1.00 4.74 C ANISOU 3126 C VAL A 231 661 613 525 52 93 13 C ATOM 3127 O VAL A 231 -2.670 -7.363 30.293 1.00 5.01 O ANISOU 3127 O VAL A 231 852 516 534 132 123 -1 O ATOM 3128 CB VAL A 231 -1.429 -8.818 27.601 1.00 4.78 C ANISOU 3128 CB VAL A 231 681 524 610 20 143 -75 C ATOM 3129 CG1 VAL A 231 -2.959 -8.666 27.454 1.00 6.83 C ANISOU 3129 CG1 VAL A 231 944 811 841 -16 171 -172 C ATOM 3130 CG2 VAL A 231 -0.712 -8.410 26.324 1.00 5.95 C ANISOU 3130 CG2 VAL A 231 813 676 773 160 125 -22 C ATOM 3131 H VAL A 231 0.813 -8.978 28.550 1.00 5.52 H ATOM 3132 HA VAL A 231 -0.915 -7.044 28.534 1.00 4.45 H ATOM 3133 HB VAL A 231 -1.238 -9.766 27.760 1.00 5.73 H ATOM 3134 HG11 VAL A 231 -3.255 -9.194 26.709 1.00 8.20 H ATOM 3135 HG12 VAL A 231 -3.381 -8.971 28.261 1.00 8.20 H ATOM 3136 HG13 VAL A 231 -3.168 -7.741 27.305 1.00 8.20 H ATOM 3137 HG21 VAL A 231 -1.061 -8.924 25.592 1.00 7.14 H ATOM 3138 HG22 VAL A 231 -0.860 -7.475 26.168 1.00 7.14 H ATOM 3139 HG23 VAL A 231 0.227 -8.581 26.425 1.00 7.14 H ATOM 3140 N TYR A 232 -1.376 -9.125 30.894 1.00 5.71 N ANISOU 3140 N TYR A 232 755 682 731 47 322 73 N ATOM 3141 CA TYR A 232 -2.104 -9.347 32.142 1.00 5.70 C ANISOU 3141 CA TYR A 232 797 652 716 158 302 223 C ATOM 3142 C TYR A 232 -2.213 -8.058 32.982 1.00 4.87 C ANISOU 3142 C TYR A 232 659 565 625 211 271 190 C ATOM 3143 O TYR A 232 -3.237 -7.792 33.597 1.00 5.52 O ANISOU 3143 O TYR A 232 839 650 607 237 295 236 O ATOM 3144 CB TYR A 232 -1.462 -10.489 32.955 1.00 6.32 C ANISOU 3144 CB TYR A 232 929 636 836 298 370 214 C ATOM 3145 CG TYR A 232 -2.126 -10.665 34.304 1.00 6.63 C ANISOU 3145 CG TYR A 232 979 651 889 393 387 117 C ATOM 3146 CD1 TYR A 232 -3.323 -11.363 34.438 1.00 6.49 C ANISOU 3146 CD1 TYR A 232 912 678 876 249 505 45 C ATOM 3147 CD2 TYR A 232 -1.562 -10.122 35.434 1.00 7.74 C ANISOU 3147 CD2 TYR A 232 1180 740 1019 349 467 145 C ATOM 3148 CE1 TYR A 232 -3.956 -11.480 35.657 1.00 8.65 C ANISOU 3148 CE1 TYR A 232 1225 888 1172 293 577 109 C ATOM 3149 CE2 TYR A 232 -2.165 -10.253 36.665 1.00 8.71 C ANISOU 3149 CE2 TYR A 232 1308 898 1101 388 659 164 C ATOM 3150 CZ TYR A 232 -3.363 -10.940 36.776 1.00 10.28 C ANISOU 3150 CZ TYR A 232 1404 1226 1277 546 781 131 C ATOM 3151 OH TYR A 232 -3.997 -11.075 37.995 1.00 14.63 O ANISOU 3151 OH TYR A 232 2020 1783 1755 698 1020 22 O ATOM 3152 H TYR A 232 -0.723 -9.668 30.763 1.00 6.85 H ATOM 3153 HA TYR A 232 -3.016 -9.627 31.919 1.00 6.84 H ATOM 3154 HB2 TYR A 232 -1.551 -11.320 32.463 1.00 7.58 H ATOM 3155 HB3 TYR A 232 -0.525 -10.287 33.103 1.00 7.58 H ATOM 3156 HD1 TYR A 232 -3.729 -11.719 33.680 1.00 7.79 H ATOM 3157 HD2 TYR A 232 -0.761 -9.655 35.365 1.00 9.28 H ATOM 3158 HE1 TYR A 232 -4.755 -11.951 35.729 1.00 10.38 H ATOM 3159 HE2 TYR A 232 -1.772 -9.877 37.419 1.00 10.45 H ATOM 3160 HH TYR A 232 -4.164 -10.336 38.308 1.00 17.55 H ATOM 3161 N ASN A 233 -1.172 -7.234 32.986 1.00 4.92 N ANISOU 3161 N ASN A 233 649 571 649 34 276 -22 N ATOM 3162 CA ASN A 233 -1.182 -6.011 33.792 1.00 5.83 C ANISOU 3162 CA ASN A 233 829 686 699 -62 241 52 C ATOM 3163 C ASN A 233 -2.206 -4.959 33.329 1.00 5.96 C ANISOU 3163 C ASN A 233 868 715 682 -60 277 -62 C ATOM 3164 O ASN A 233 -2.525 -4.005 34.068 1.00 6.80 O ANISOU 3164 O ASN A 233 1038 871 675 39 233 -97 O ATOM 3165 CB ASN A 233 0.221 -5.407 33.822 1.00 5.65 C ANISOU 3165 CB ASN A 233 669 741 737 24 203 125 C ATOM 3166 CG ASN A 233 1.204 -6.209 34.657 1.00 8.17 C ANISOU 3166 CG ASN A 233 1065 1036 1002 116 194 87 C ATOM 3167 OD1 ASN A 233 0.900 -7.286 35.185 1.00 10.53 O ANISOU 3167 OD1 ASN A 233 1374 1451 1175 172 -177 253 O ATOM 3168 ND2 ASN A 233 2.393 -5.673 34.798 1.00 10.41 N ANISOU 3168 ND2 ASN A 233 1347 1335 1273 144 128 -47 N ATOM 3169 H ASN A 233 -0.450 -7.355 32.535 1.00 5.90 H ATOM 3170 HA ASN A 233 -1.414 -6.254 34.713 1.00 6.99 H ATOM 3171 HB2 ASN A 233 0.564 -5.366 32.915 1.00 6.78 H ATOM 3172 HB3 ASN A 233 0.171 -4.514 34.197 1.00 6.78 H ATOM 3173 HD21 ASN A 233 3.080 -6.134 35.323 1.00 12.49 H ATOM 3174 HD22 ASN A 233 2.595 -4.811 34.377 1.00 12.49 H ATOM 3175 N TYR A 234 -2.732 -5.144 32.120 1.00 5.46 N ANISOU 3175 N TYR A 234 849 563 664 61 290 105 N ATOM 3176 CA TYR A 234 -3.626 -4.174 31.474 1.00 5.23 C ANISOU 3176 CA TYR A 234 692 609 685 11 262 244 C ATOM 3177 C TYR A 234 -5.051 -4.707 31.264 1.00 5.79 C ANISOU 3177 C TYR A 234 741 719 740 -17 187 282 C ATOM 3178 O TYR A 234 -5.818 -4.095 30.549 1.00 6.11 O ANISOU 3178 O TYR A 234 771 785 767 -79 45 200 O ATOM 3179 CB TYR A 234 -3.008 -3.700 30.122 1.00 5.88 C ANISOU 3179 CB TYR A 234 710 737 788 -26 308 338 C ATOM 3180 CG TYR A 234 -1.649 -3.108 30.364 1.00 6.42 C ANISOU 3180 CG TYR A 234 872 769 799 18 293 256 C ATOM 3181 CD1 TYR A 234 -1.518 -1.776 30.792 1.00 7.07 C ANISOU 3181 CD1 TYR A 234 933 832 922 67 333 273 C ATOM 3182 CD2 TYR A 234 -0.499 -3.893 30.266 1.00 6.14 C ANISOU 3182 CD2 TYR A 234 815 729 789 -62 398 178 C ATOM 3183 CE1 TYR A 234 -0.286 -1.245 31.089 1.00 5.79 C ANISOU 3183 CE1 TYR A 234 676 638 886 69 273 305 C ATOM 3184 CE2 TYR A 234 0.732 -3.377 30.550 1.00 6.51 C ANISOU 3184 CE2 TYR A 234 844 743 885 -2 322 177 C ATOM 3185 CZ TYR A 234 0.844 -2.067 30.973 1.00 7.21 C ANISOU 3185 CZ TYR A 234 897 797 1044 33 366 244 C ATOM 3186 OH TYR A 234 2.088 -1.604 31.281 1.00 9.12 O ANISOU 3186 OH TYR A 234 1117 1115 1235 68 296 223 O ATOM 3187 H TYR A 234 -2.584 -5.842 31.639 1.00 6.55 H ATOM 3188 HA TYR A 234 -3.694 -3.387 32.054 1.00 6.27 H ATOM 3189 HB2 TYR A 234 -2.913 -4.458 29.524 1.00 7.06 H ATOM 3190 HB3 TYR A 234 -3.575 -3.021 29.725 1.00 7.06 H ATOM 3191 HD1 TYR A 234 -2.279 -1.250 30.887 1.00 8.49 H ATOM 3192 HD2 TYR A 234 -0.574 -4.783 30.004 1.00 7.37 H ATOM 3193 HE1 TYR A 234 -0.205 -0.363 31.374 1.00 6.95 H ATOM 3194 HE2 TYR A 234 1.490 -3.913 30.485 1.00 7.81 H ATOM 3195 HH TYR A 234 2.113 -1.366 32.065 1.00 10.95 H ATOM 3196 N VAL A 235 -5.423 -5.829 31.893 1.00 5.87 N ANISOU 3196 N VAL A 235 772 664 794 11 101 214 N ATOM 3197 CA VAL A 235 -6.776 -6.367 31.693 1.00 5.90 C ANISOU 3197 CA VAL A 235 752 684 805 220 92 89 C ATOM 3198 C VAL A 235 -7.855 -5.341 32.048 1.00 5.77 C ANISOU 3198 C VAL A 235 714 739 741 198 157 33 C ATOM 3199 O VAL A 235 -8.779 -5.099 31.255 1.00 5.71 O ANISOU 3199 O VAL A 235 649 786 735 285 193 -115 O ATOM 3200 CB VAL A 235 -6.983 -7.708 32.444 1.00 7.33 C ANISOU 3200 CB VAL A 235 890 884 1012 101 -24 -152 C ATOM 3201 CG1 VAL A 235 -8.449 -8.100 32.454 1.00 10.99 C ANISOU 3201 CG1 VAL A 235 1399 1314 1464 139 -140 -208 C ATOM 3202 CG2 VAL A 235 -6.152 -8.782 31.769 1.00 7.42 C ANISOU 3202 CG2 VAL A 235 959 866 993 148 -95 -95 C ATOM 3203 H VAL A 235 -4.926 -6.286 32.425 1.00 7.04 H ATOM 3204 HA VAL A 235 -6.880 -6.562 30.739 1.00 7.08 H ATOM 3205 HB VAL A 235 -6.678 -7.616 33.371 1.00 8.80 H ATOM 3206 HG11 VAL A 235 -8.546 -8.931 32.924 1.00 13.19 H ATOM 3207 HG12 VAL A 235 -8.952 -7.412 32.897 1.00 13.19 H ATOM 3208 HG13 VAL A 235 -8.752 -8.197 31.549 1.00 13.19 H ATOM 3209 HG21 VAL A 235 -6.279 -9.613 32.233 1.00 8.90 H ATOM 3210 HG22 VAL A 235 -6.436 -8.869 30.856 1.00 8.90 H ATOM 3211 HG23 VAL A 235 -5.227 -8.527 31.801 1.00 8.90 H ATOM 3212 N ASP A 236 -7.733 -4.707 33.208 1.00 5.41 N ANISOU 3212 N ASP A 236 739 613 704 102 79 21 N ATOM 3213 CA ASP A 236 -8.740 -3.727 33.611 1.00 6.61 C ANISOU 3213 CA ASP A 236 930 717 863 94 107 6 C ATOM 3214 C ASP A 236 -8.718 -2.483 32.685 1.00 6.22 C ANISOU 3214 C ASP A 236 893 682 789 71 101 -23 C ATOM 3215 O ASP A 236 -9.771 -1.963 32.291 1.00 6.09 O ANISOU 3215 O ASP A 236 902 672 741 16 98 82 O ATOM 3216 CB ASP A 236 -8.552 -3.325 35.076 1.00 9.67 C ANISOU 3216 CB ASP A 236 1368 1111 1195 177 179 19 C ATOM 3217 CG ASP A 236 -8.868 -4.452 36.059 1.00 10.95 C ANISOU 3217 CG ASP A 236 1722 1162 1275 -30 327 65 C ATOM 3218 OD1 ASP A 236 -9.645 -5.380 35.731 1.00 11.06 O ANISOU 3218 OD1 ASP A 236 1810 1041 1352 -276 442 19 O ATOM 3219 OD2 ASP A 236 -8.342 -4.395 37.195 1.00 11.75 O ANISOU 3219 OD2 ASP A 236 2033 1201 1230 42 359 264 O ATOM 3220 H ASP A 236 -7.092 -4.821 33.771 1.00 6.49 H ATOM 3221 HA ASP A 236 -9.625 -4.139 33.530 1.00 7.93 H ATOM 3222 HB2 ASP A 236 -7.629 -3.060 35.212 1.00 11.60 H ATOM 3223 HB3 ASP A 236 -9.142 -2.581 35.275 1.00 11.60 H ATOM 3224 N TRP A 237 -7.530 -1.996 32.350 1.00 5.42 N ANISOU 3224 N TRP A 237 764 511 784 -265 146 -64 N ATOM 3225 CA TRP A 237 -7.409 -0.840 31.461 1.00 5.92 C ANISOU 3225 CA TRP A 237 736 689 826 -56 49 -84 C ATOM 3226 C TRP A 237 -8.082 -1.138 30.111 1.00 6.21 C ANISOU 3226 C TRP A 237 775 802 781 -27 191 48 C ATOM 3227 O TRP A 237 -8.803 -0.304 29.548 1.00 6.68 O ANISOU 3227 O TRP A 237 783 948 807 -56 220 21 O ATOM 3228 CB TRP A 237 -5.944 -0.461 31.262 1.00 5.75 C ANISOU 3228 CB TRP A 237 661 686 836 -50 26 -218 C ATOM 3229 CG TRP A 237 -5.796 0.706 30.322 1.00 4.95 C ANISOU 3229 CG TRP A 237 550 521 808 -95 -5 -34 C ATOM 3230 CD1 TRP A 237 -6.077 2.024 30.601 1.00 6.58 C ANISOU 3230 CD1 TRP A 237 805 807 888 -58 13 -111 C ATOM 3231 CD2 TRP A 237 -5.391 0.673 28.933 1.00 5.64 C ANISOU 3231 CD2 TRP A 237 689 622 833 -232 8 -139 C ATOM 3232 NE1 TRP A 237 -5.845 2.800 29.490 1.00 6.59 N ANISOU 3232 NE1 TRP A 237 761 778 966 -61 -19 10 N ATOM 3233 CE2 TRP A 237 -5.429 2.002 28.455 1.00 6.29 C ANISOU 3233 CE2 TRP A 237 741 752 898 -131 -36 55 C ATOM 3234 CE3 TRP A 237 -4.961 -0.342 28.068 1.00 6.46 C ANISOU 3234 CE3 TRP A 237 865 736 852 -225 85 -95 C ATOM 3235 CZ2 TRP A 237 -5.072 2.340 27.134 1.00 8.27 C ANISOU 3235 CZ2 TRP A 237 1011 1058 1072 -173 -69 130 C ATOM 3236 CZ3 TRP A 237 -4.613 -0.006 26.758 1.00 7.58 C ANISOU 3236 CZ3 TRP A 237 971 950 958 -112 1 -79 C ATOM 3237 CH2 TRP A 237 -4.661 1.322 26.312 1.00 7.61 C ANISOU 3237 CH2 TRP A 237 1021 913 956 -233 -40 51 C ATOM 3238 H TRP A 237 -6.778 -2.314 32.622 1.00 6.50 H ATOM 3239 HA TRP A 237 -7.868 -0.075 31.867 1.00 7.11 H ATOM 3240 HB2 TRP A 237 -5.559 -0.213 32.117 1.00 6.89 H ATOM 3241 HB3 TRP A 237 -5.467 -1.217 30.885 1.00 6.89 H ATOM 3242 HD1 TRP A 237 -6.379 2.343 31.420 1.00 7.89 H ATOM 3243 HE1 TRP A 237 -5.958 3.651 29.446 1.00 7.91 H ATOM 3244 HE3 TRP A 237 -4.932 -1.227 28.353 1.00 7.75 H ATOM 3245 HZ2 TRP A 237 -5.161 3.210 26.818 1.00 9.92 H ATOM 3246 HZ3 TRP A 237 -4.341 -0.674 26.172 1.00 9.09 H ATOM 3247 HH2 TRP A 237 -4.424 1.515 25.434 1.00 9.13 H ATOM 3248 N ILE A 238 -7.866 -2.342 29.599 1.00 5.65 N ANISOU 3248 N ILE A 238 830 584 732 -71 71 -33 N ATOM 3249 CA ILE A 238 -8.481 -2.739 28.324 1.00 6.80 C ANISOU 3249 CA ILE A 238 900 824 859 55 -27 -58 C ATOM 3250 C ILE A 238 -10.010 -2.793 28.438 1.00 6.89 C ANISOU 3250 C ILE A 238 932 838 849 54 71 0 C ATOM 3251 O ILE A 238 -10.706 -2.181 27.638 1.00 7.28 O ANISOU 3251 O ILE A 238 1022 843 901 18 193 -70 O ATOM 3252 CB ILE A 238 -7.907 -4.086 27.817 1.00 7.16 C ANISOU 3252 CB ILE A 238 928 803 991 40 -127 -85 C ATOM 3253 CG1 ILE A 238 -6.436 -3.907 27.403 1.00 7.13 C ANISOU 3253 CG1 ILE A 238 892 865 953 241 15 -123 C ATOM 3254 CG2 ILE A 238 -8.704 -4.624 26.623 1.00 8.29 C ANISOU 3254 CG2 ILE A 238 1036 990 1123 118 -196 -110 C ATOM 3255 CD1 ILE A 238 -5.677 -5.231 27.154 1.00 7.86 C ANISOU 3255 CD1 ILE A 238 1001 976 1010 376 -37 -294 C ATOM 3256 H ILE A 238 -7.374 -2.948 29.960 1.00 6.78 H ATOM 3257 HA ILE A 238 -8.263 -2.058 27.653 1.00 8.16 H ATOM 3258 HB ILE A 238 -7.951 -4.733 28.538 1.00 8.60 H ATOM 3259 HG12 ILE A 238 -6.404 -3.390 26.582 1.00 8.56 H ATOM 3260 HG13 ILE A 238 -5.971 -3.429 28.108 1.00 8.56 H ATOM 3261 HG21 ILE A 238 -8.318 -5.457 26.340 1.00 9.94 H ATOM 3262 HG22 ILE A 238 -9.615 -4.760 26.893 1.00 9.94 H ATOM 3263 HG23 ILE A 238 -8.665 -3.985 25.908 1.00 9.94 H ATOM 3264 HD11 ILE A 238 -4.773 -5.030 26.902 1.00 9.43 H ATOM 3265 HD12 ILE A 238 -5.685 -5.751 27.960 1.00 9.43 H ATOM 3266 HD13 ILE A 238 -6.115 -5.713 26.448 1.00 9.43 H ATOM 3267 N LYS A 239 -10.545 -3.519 29.428 1.00 7.13 N ANISOU 3267 N LYS A 239 890 835 983 129 -72 2 N ATOM 3268 CA LYS A 239 -11.988 -3.633 29.532 1.00 7.52 C ANISOU 3268 CA LYS A 239 994 846 1019 121 -24 -14 C ATOM 3269 C LYS A 239 -12.654 -2.273 29.772 1.00 6.66 C ANISOU 3269 C LYS A 239 846 722 962 34 36 25 C ATOM 3270 O LYS A 239 -13.694 -1.981 29.171 1.00 7.40 O ANISOU 3270 O LYS A 239 898 868 1045 100 82 117 O ATOM 3271 CB LYS A 239 -12.358 -4.634 30.607 1.00 9.62 C ANISOU 3271 CB LYS A 239 1233 1112 1310 339 -171 151 C ATOM 3272 CG LYS A 239 -11.945 -6.068 30.266 1.00 13.14 C ANISOU 3272 CG LYS A 239 1628 1604 1759 590 -350 284 C ATOM 3273 CD LYS A 239 -12.168 -6.942 31.488 1.00 23.29 C ANISOU 3273 CD LYS A 239 2926 2874 3048 486 -351 379 C ATOM 3274 CE LYS A 239 -12.068 -8.410 31.174 1.00 42.51 C ANISOU 3274 CE LYS A 239 5375 5365 5410 363 -305 356 C ATOM 3275 NZ LYS A 239 -12.614 -9.186 32.314 1.00 57.85 N ANISOU 3275 NZ LYS A 239 7308 7306 7365 268 -257 333 N ATOM 3276 H LYS A 239 -10.102 -3.942 30.032 1.00 8.55 H ATOM 3277 HA LYS A 239 -12.332 -3.979 28.681 1.00 9.03 H ATOM 3278 HB2 LYS A 239 -11.915 -4.384 31.434 1.00 11.54 H ATOM 3279 HB3 LYS A 239 -13.320 -4.622 30.731 1.00 11.54 H ATOM 3280 HG2 LYS A 239 -12.491 -6.404 29.538 1.00 15.76 H ATOM 3281 HG3 LYS A 239 -11.004 -6.093 30.032 1.00 15.76 H ATOM 3282 HD2 LYS A 239 -11.497 -6.731 32.155 1.00 27.95 H ATOM 3283 HD3 LYS A 239 -13.055 -6.770 31.842 1.00 27.95 H ATOM 3284 HE2 LYS A 239 -12.589 -8.613 30.381 1.00 51.01 H ATOM 3285 HE3 LYS A 239 -11.138 -8.656 31.047 1.00 51.01 H ATOM 3286 HZ1 LYS A 239 -12.556 -10.126 32.128 1.00 69.42 H ATOM 3287 HZ2 LYS A 239 -12.113 -8.994 33.110 1.00 69.42 H ATOM 3288 HZ3 LYS A 239 -13.533 -8.952 32.459 1.00 69.42 H ATOM 3289 N ASP A 240 -12.065 -1.443 30.637 1.00 6.73 N ANISOU 3289 N ASP A 240 756 821 981 -120 83 -18 N ATOM 3290 CA ASP A 240 -12.639 -0.119 30.904 1.00 6.19 C ANISOU 3290 CA ASP A 240 793 699 861 -185 118 1 C ATOM 3291 C ASP A 240 -12.542 0.831 29.705 1.00 6.29 C ANISOU 3291 C ASP A 240 766 788 838 4 84 88 C ATOM 3292 O ASP A 240 -13.452 1.617 29.461 1.00 6.60 O ANISOU 3292 O ASP A 240 771 850 887 146 45 167 O ATOM 3293 CB ASP A 240 -12.003 0.523 32.147 1.00 6.60 C ANISOU 3293 CB ASP A 240 881 787 840 -11 233 -136 C ATOM 3294 CG ASP A 240 -12.517 -0.082 33.448 1.00 8.74 C ANISOU 3294 CG ASP A 240 1279 1021 1021 -44 192 -5 C ATOM 3295 OD1 ASP A 240 -13.640 -0.666 33.465 1.00 10.46 O ANISOU 3295 OD1 ASP A 240 1583 1141 1251 -185 201 -22 O ATOM 3296 OD2 ASP A 240 -11.827 0.074 34.489 1.00 9.73 O ANISOU 3296 OD2 ASP A 240 1431 1309 958 7 272 63 O ATOM 3297 H ASP A 240 -11.346 -1.618 31.075 1.00 8.08 H ATOM 3298 HA ASP A 240 -13.592 -0.237 31.099 1.00 7.43 H ATOM 3299 HB2 ASP A 240 -11.043 0.392 32.114 1.00 7.92 H ATOM 3300 HB3 ASP A 240 -12.209 1.470 32.154 1.00 7.92 H ATOM 3301 N THR A 241 -11.454 0.758 28.954 1.00 6.88 N ANISOU 3301 N THR A 241 941 782 891 -1 183 -54 N ATOM 3302 CA THR A 241 -11.305 1.611 27.767 1.00 6.61 C ANISOU 3302 CA THR A 241 867 736 908 250 153 113 C ATOM 3303 C THR A 241 -12.332 1.214 26.692 1.00 6.93 C ANISOU 3303 C THR A 241 873 813 949 216 96 118 C ATOM 3304 O THR A 241 -12.972 2.080 26.066 1.00 7.17 O ANISOU 3304 O THR A 241 819 972 934 226 93 98 O ATOM 3305 CB THR A 241 -9.858 1.552 27.214 1.00 6.95 C ANISOU 3305 CB THR A 241 867 807 966 312 133 110 C ATOM 3306 OG1 THR A 241 -8.941 2.076 28.196 1.00 8.32 O ANISOU 3306 OG1 THR A 241 973 1066 1122 303 303 291 O ATOM 3307 CG2 THR A 241 -9.718 2.366 25.934 1.00 8.41 C ANISOU 3307 CG2 THR A 241 1094 1020 1083 376 -86 98 C ATOM 3308 H THR A 241 -10.790 0.231 29.101 1.00 8.26 H ATOM 3309 HA THR A 241 -11.487 2.540 28.024 1.00 7.93 H ATOM 3310 HB THR A 241 -9.627 0.631 27.018 1.00 8.34 H ATOM 3311 HG1 THR A 241 -8.984 1.633 28.884 1.00 9.98 H ATOM 3312 HG21 THR A 241 -8.815 2.315 25.611 1.00 10.09 H ATOM 3313 HG22 THR A 241 -10.310 2.024 25.261 1.00 10.09 H ATOM 3314 HG23 THR A 241 -9.937 3.285 26.104 1.00 10.09 H ATOM 3315 N ILE A 242 -12.519 -0.085 26.482 1.00 7.57 N ANISOU 3315 N ILE A 242 1002 839 1036 120 -14 90 N ATOM 3316 CA ILE A 242 -13.560 -0.556 25.566 1.00 9.08 C ANISOU 3316 CA ILE A 242 1150 1115 1186 145 -81 -14 C ATOM 3317 C ILE A 242 -14.941 -0.032 25.993 1.00 8.51 C ANISOU 3317 C ILE A 242 953 1196 1086 149 -180 3 C ATOM 3318 O ILE A 242 -15.687 0.533 25.190 1.00 8.83 O ANISOU 3318 O ILE A 242 745 1485 1126 227 -180 29 O ATOM 3319 CB ILE A 242 -13.559 -2.099 25.490 1.00 10.30 C ANISOU 3319 CB ILE A 242 1287 1251 1374 242 -182 -175 C ATOM 3320 CG1 ILE A 242 -12.327 -2.556 24.711 1.00 10.95 C ANISOU 3320 CG1 ILE A 242 1342 1359 1457 288 -264 -351 C ATOM 3321 CG2 ILE A 242 -14.845 -2.635 24.839 1.00 12.54 C ANISOU 3321 CG2 ILE A 242 1633 1565 1565 225 -55 -45 C ATOM 3322 CD1 ILE A 242 -12.151 -4.084 24.683 1.00 14.00 C ANISOU 3322 CD1 ILE A 242 1749 1733 1839 364 -295 -397 C ATOM 3323 H ILE A 242 -12.063 -0.712 26.854 1.00 9.08 H ATOM 3324 HA ILE A 242 -13.372 -0.210 24.669 1.00 10.90 H ATOM 3325 HB ILE A 242 -13.501 -2.451 26.391 1.00 12.36 H ATOM 3326 HG12 ILE A 242 -12.404 -2.249 23.794 1.00 13.13 H ATOM 3327 HG13 ILE A 242 -11.536 -2.173 25.122 1.00 13.13 H ATOM 3328 HG21 ILE A 242 -14.804 -3.594 24.811 1.00 15.04 H ATOM 3329 HG22 ILE A 242 -15.600 -2.355 25.361 1.00 15.04 H ATOM 3330 HG23 ILE A 242 -14.915 -2.284 23.948 1.00 15.04 H ATOM 3331 HD11 ILE A 242 -11.362 -4.298 24.180 1.00 16.80 H ATOM 3332 HD12 ILE A 242 -12.062 -4.405 25.583 1.00 16.80 H ATOM 3333 HD13 ILE A 242 -12.921 -4.480 24.268 1.00 16.80 H ATOM 3334 N ALA A 243 -15.267 -0.176 27.271 1.00 7.40 N ANISOU 3334 N ALA A 243 783 1075 953 144 -90 -78 N ATOM 3335 CA ALA A 243 -16.573 0.277 27.765 1.00 9.14 C ANISOU 3335 CA ALA A 243 1067 1290 1115 321 -186 20 C ATOM 3336 C ALA A 243 -16.789 1.792 27.586 1.00 9.67 C ANISOU 3336 C ALA A 243 1129 1493 1053 508 46 116 C ATOM 3337 O ALA A 243 -17.900 2.238 27.283 1.00 10.76 O ANISOU 3337 O ALA A 243 1175 1783 1132 396 47 104 O ATOM 3338 CB ALA A 243 -16.732 -0.112 29.233 1.00 9.90 C ANISOU 3338 CB ALA A 243 1186 1337 1239 297 -317 21 C ATOM 3339 H ALA A 243 -14.761 -0.529 27.870 1.00 8.88 H ATOM 3340 HA ALA A 243 -17.275 -0.184 27.259 1.00 10.97 H ATOM 3341 HB1 ALA A 243 -17.589 0.190 29.544 1.00 11.88 H ATOM 3342 HB2 ALA A 243 -16.672 -1.067 29.311 1.00 11.88 H ATOM 3343 HB3 ALA A 243 -16.033 0.303 29.743 1.00 11.88 H ATOM 3344 N ALA A 244 -15.723 2.572 27.774 1.00 8.97 N ANISOU 3344 N ALA A 244 1070 1267 1071 503 32 141 N ATOM 3345 CA ALA A 244 -15.801 4.030 27.715 1.00 10.07 C ANISOU 3345 CA ALA A 244 1326 1263 1239 576 20 322 C ATOM 3346 C ALA A 244 -15.902 4.566 26.295 1.00 10.25 C ANISOU 3346 C ALA A 244 1538 1136 1219 700 37 432 C ATOM 3347 O ALA A 244 -16.242 5.743 26.080 1.00 11.61 O ANISOU 3347 O ALA A 244 1999 1197 1217 840 231 536 O ATOM 3348 CB ALA A 244 -14.591 4.647 28.411 1.00 11.51 C ANISOU 3348 CB ALA A 244 1441 1473 1458 606 -58 344 C ATOM 3349 H ALA A 244 -14.933 2.274 27.938 1.00 10.76 H ATOM 3350 HA ALA A 244 -16.602 4.320 28.200 1.00 12.09 H ATOM 3351 HB1 ALA A 244 -14.658 5.603 28.363 1.00 13.81 H ATOM 3352 HB2 ALA A 244 -14.580 4.364 29.328 1.00 13.81 H ATOM 3353 HB3 ALA A 244 -13.792 4.352 27.967 1.00 13.81 H ATOM 3354 N ASN A 245 -15.619 3.705 25.332 1.00 10.30 N ANISOU 3354 N ASN A 245 1368 1285 1261 506 -61 326 N ATOM 3355 CA ASN A 245 -15.588 4.101 23.929 1.00 12.82 C ANISOU 3355 CA ASN A 245 1568 1657 1647 490 -16 231 C ATOM 3356 C ASN A 245 -16.525 3.266 23.075 1.00 16.54 C ANISOU 3356 C ASN A 245 1916 2255 2111 292 -20 -24 C ATOM 3357 O ASN A 245 -16.315 3.115 21.879 1.00 15.23 O ANISOU 3357 O ASN A 245 1565 2231 1989 275 34 -81 O ATOM 3358 CB ASN A 245 -14.150 4.007 23.420 1.00 11.10 C ANISOU 3358 CB ASN A 245 1440 1359 1417 468 -51 260 C ATOM 3359 CG ASN A 245 -13.274 5.094 23.999 1.00 10.99 C ANISOU 3359 CG ASN A 245 1617 1146 1414 468 52 268 C ATOM 3360 OD1 ASN A 245 -13.304 6.242 23.538 1.00 12.84 O ANISOU 3360 OD1 ASN A 245 2136 1232 1510 566 142 373 O ATOM 3361 ND2 ASN A 245 -12.513 4.757 25.032 1.00 9.39 N ANISOU 3361 ND2 ASN A 245 1317 929 1324 403 -44 70 N ATOM 3362 H ASN A 245 -15.439 2.875 25.464 1.00 12.36 H ATOM 3363 HA ASN A 245 -15.871 5.036 23.858 1.00 15.38 H ATOM 3364 HB2 ASN A 245 -13.777 3.149 23.677 1.00 13.32 H ATOM 3365 HB3 ASN A 245 -14.147 4.097 22.455 1.00 13.32 H ATOM 3366 HD21 ASN A 245 -11.926 5.423 25.446 1.00 11.27 H ATOM 3367 HD22 ASN A 245 -12.539 3.841 25.381 1.00 11.27 H ATOM 3368 N SER A 246 -17.594 2.775 23.689 1.00 22.33 N ANISOU 3368 N SER A 246 2699 2924 2860 126 35 -181 N ATOM 3369 CA SER A 246 -18.474 1.804 23.054 1.00 30.81 C ANISOU 3369 CA SER A 246 3799 4003 3904 141 49 -251 C ATOM 3370 C SER A 246 -19.905 2.034 23.503 1.00 31.95 C ANISOU 3370 C SER A 246 3836 4319 3983 149 167 -272 C ATOM 3371 O SER A 246 -20.252 3.145 23.918 1.00 33.20 O ANISOU 3371 O SER A 246 3930 4601 4082 247 222 -221 O ATOM 3372 CB SER A 246 -18.033 0.373 23.398 1.00 36.59 C ANISOU 3372 CB SER A 246 4609 4624 4670 23 -70 -328 C ATOM 3373 OG SER A 246 -16.813 0.041 22.745 1.00 35.43 O ANISOU 3373 OG SER A 246 4491 4418 4555 84 -120 -344 O ATOM 3374 OXT SER A 246 -20.746 1.136 23.462 0.00 31.46 O ANISOU 3374 OXT SER A 246 3720 4285 3950 131 102 -268 O ATOM 3375 H SER A 246 -17.835 2.992 24.486 1.00 26.79 H ATOM 3376 HA SER A 246 -18.434 1.916 22.081 1.00 36.97 H ATOM 3377 HB2 SER A 246 -17.905 0.305 24.357 1.00 43.91 H ATOM 3378 HB3 SER A 246 -18.722 -0.246 23.111 1.00 43.91 H ATOM 3379 HG SER A 246 -16.591 -0.724 22.939 1.00 42.52 H TER 3380 SER A 246 ATOM 3381 N ARG E 1 26.871 21.202 6.763 1.00 30.84 N ANISOU 3381 N ARG E 1 3926 3847 3944 -872 260 -392 N ATOM 3382 CA ARG E 1 25.946 20.186 7.374 1.00 33.41 C ANISOU 3382 CA ARG E 1 4290 4201 4205 -779 402 -366 C ATOM 3383 C ARG E 1 26.423 19.799 8.784 1.00 29.88 C ANISOU 3383 C ARG E 1 3880 3705 3767 -867 399 -226 C ATOM 3384 O ARG E 1 27.624 19.694 9.026 1.00 29.32 O ANISOU 3384 O ARG E 1 3831 3664 3645 -1104 409 -246 O ATOM 3385 CB ARG E 1 25.806 18.946 6.466 1.00 34.30 C ANISOU 3385 CB ARG E 1 4331 4339 4363 -545 386 -439 C ATOM 3386 CG ARG E 1 27.063 18.083 6.285 1.00 33.07 C ANISOU 3386 CG ARG E 1 4148 4192 4225 -368 318 -502 C ATOM 3387 CD ARG E 1 26.947 17.120 5.066 1.00 33.34 C ANISOU 3387 CD ARG E 1 4178 4104 4388 -217 494 -605 C ATOM 3388 NE ARG E 1 27.822 17.503 3.950 1.00 51.69 N ANISOU 3388 NE ARG E 1 6616 6451 6574 -189 699 -592 N ATOM 3389 CZ ARG E 1 27.427 17.810 2.712 1.00 53.60 C ANISOU 3389 CZ ARG E 1 6844 6682 6841 -200 834 -567 C ATOM 3390 NH1 ARG E 1 26.148 17.788 2.364 1.00 42.53 N ANISOU 3390 NH1 ARG E 1 5372 5267 5521 -176 936 -577 N ATOM 3391 NH2 ARG E 1 28.334 18.136 1.800 1.00 67.94 N ANISOU 3391 NH2 ARG E 1 8619 8518 8678 -213 835 -554 N ATOM 3392 H1 ARG E 1 26.732 21.230 5.813 1.00 37.00 H ATOM 3393 H2 ARG E 1 26.691 22.066 7.139 1.00 37.00 H ATOM 3394 H3 ARG E 1 27.781 20.957 6.946 1.00 37.00 H ATOM 3395 HA ARG E 1 25.056 20.588 7.464 1.00 40.10 H ATOM 3396 HB2 ARG E 1 25.116 18.374 6.837 1.00 41.16 H ATOM 3397 HB3 ARG E 1 25.534 19.245 5.584 1.00 41.16 H ATOM 3398 HG2 ARG E 1 27.828 18.662 6.139 1.00 39.68 H ATOM 3399 HG3 ARG E 1 27.198 17.547 7.082 1.00 39.68 H ATOM 3400 HD2 ARG E 1 27.194 16.224 5.347 1.00 40.01 H ATOM 3401 HD3 ARG E 1 26.032 17.126 4.745 1.00 40.01 H ATOM 3402 HE ARG E 1 28.775 17.535 4.129 1.00 62.03 H ATOM 3403 HH11 ARG E 1 25.548 17.578 2.943 1.00 51.04 H ATOM 3404 HH12 ARG E 1 25.917 17.989 1.560 1.00 51.04 H ATOM 3405 HH21 ARG E 1 29.168 18.154 2.010 1.00 81.53 H ATOM 3406 HH22 ARG E 1 28.088 18.335 1.000 1.00 81.53 H ATOM 3407 N PRO E 2 25.481 19.606 9.721 1.00 27.68 N ANISOU 3407 N PRO E 2 3509 3408 3601 -833 492 -147 N ATOM 3408 CA PRO E 2 25.837 19.249 11.100 1.00 24.08 C ANISOU 3408 CA PRO E 2 2946 3001 3201 -784 609 -52 C ATOM 3409 C PRO E 2 26.564 17.910 11.221 1.00 25.39 C ANISOU 3409 C PRO E 2 2978 3324 3347 -697 599 -44 C ATOM 3410 O PRO E 2 26.416 17.047 10.359 1.00 23.51 O ANISOU 3410 O PRO E 2 2638 3094 3200 -798 507 -170 O ATOM 3411 CB PRO E 2 24.476 19.138 11.801 1.00 26.58 C ANISOU 3411 CB PRO E 2 3297 3330 3471 -715 737 -7 C ATOM 3412 CG PRO E 2 23.534 19.928 10.965 1.00 35.68 C ANISOU 3412 CG PRO E 2 4510 4522 4524 -679 647 -38 C ATOM 3413 CD PRO E 2 24.033 19.825 9.557 1.00 31.64 C ANISOU 3413 CD PRO E 2 3997 3958 4069 -745 587 -79 C ATOM 3414 HA PRO E 2 26.370 19.957 11.518 1.00 28.89 H ATOM 3415 HB2 PRO E 2 24.203 18.208 11.838 1.00 31.89 H ATOM 3416 HB3 PRO E 2 24.538 19.512 12.694 1.00 31.89 H ATOM 3417 HG2 PRO E 2 22.643 19.552 11.038 1.00 42.81 H ATOM 3418 HG3 PRO E 2 23.537 20.853 11.259 1.00 42.81 H ATOM 3419 HD2 PRO E 2 23.626 19.067 9.108 1.00 37.97 H ATOM 3420 HD3 PRO E 2 23.869 20.652 9.078 1.00 37.97 H ATOM 3421 N ASP E 3 27.312 17.747 12.307 1.00 28.49 N ANISOU 3421 N ASP E 3 3450 3685 3689 -579 391 -39 N ATOM 3422 CA ASP E 3 28.069 16.524 12.581 1.00 32.38 C ANISOU 3422 CA ASP E 3 3984 4199 4120 -460 320 -54 C ATOM 3423 C ASP E 3 27.228 15.238 12.564 1.00 26.55 C ANISOU 3423 C ASP E 3 3064 3621 3405 -459 60 71 C ATOM 3424 O ASP E 3 27.687 14.189 12.109 1.00 24.70 O ANISOU 3424 O ASP E 3 2526 3619 3240 -397 13 170 O ATOM 3425 CB ASP E 3 28.793 16.655 13.931 1.00 36.11 C ANISOU 3425 CB ASP E 3 4519 4642 4561 -340 266 -162 C ATOM 3426 CG ASP E 3 27.861 17.102 15.079 1.00 36.81 C ANISOU 3426 CG ASP E 3 4674 4856 4455 -271 239 -283 C ATOM 3427 OD1 ASP E 3 26.623 17.219 14.887 1.00 36.01 O ANISOU 3427 OD1 ASP E 3 4506 4691 4485 -315 92 -368 O ATOM 3428 OD2 ASP E 3 28.379 17.342 16.195 1.00 37.87 O ANISOU 3428 OD2 ASP E 3 4868 5071 4448 -221 354 -292 O ATOM 3429 H ASP E 3 27.400 18.346 12.918 1.00 34.18 H ATOM 3430 HA ASP E 3 28.757 16.429 11.889 1.00 38.85 H ATOM 3431 HB2 ASP E 3 29.170 15.794 14.170 1.00 43.34 H ATOM 3432 HB3 ASP E 3 29.500 17.314 13.846 1.00 43.34 H ATOM 3433 N PHE E 4 25.996 15.309 13.061 1.00 24.08 N ANISOU 3433 N PHE E 4 2948 3100 3103 -457 184 50 N ATOM 3434 CA PHE E 4 25.185 14.102 13.180 1.00 20.55 C ANISOU 3434 CA PHE E 4 2491 2612 2705 -495 265 67 C ATOM 3435 C PHE E 4 24.762 13.574 11.812 1.00 17.38 C ANISOU 3435 C PHE E 4 1971 2197 2436 -233 205 75 C ATOM 3436 O PHE E 4 24.343 12.433 11.691 1.00 16.06 O ANISOU 3436 O PHE E 4 1676 2033 2392 -124 317 100 O ATOM 3437 CB PHE E 4 23.980 14.323 14.101 1.00 18.84 C ANISOU 3437 CB PHE E 4 2324 2370 2463 -693 329 79 C ATOM 3438 CG PHE E 4 23.007 15.352 13.612 1.00 19.18 C ANISOU 3438 CG PHE E 4 2360 2398 2528 -912 523 86 C ATOM 3439 CD1 PHE E 4 22.130 15.058 12.587 1.00 17.66 C ANISOU 3439 CD1 PHE E 4 2215 2175 2318 -1007 534 34 C ATOM 3440 CD2 PHE E 4 22.946 16.599 14.206 1.00 23.15 C ANISOU 3440 CD2 PHE E 4 2911 2933 2950 -843 545 99 C ATOM 3441 CE1 PHE E 4 21.210 15.989 12.153 1.00 19.25 C ANISOU 3441 CE1 PHE E 4 2436 2368 2512 -1016 477 25 C ATOM 3442 CE2 PHE E 4 22.030 17.542 13.779 1.00 25.40 C ANISOU 3442 CE2 PHE E 4 3214 3196 3241 -836 527 120 C ATOM 3443 CZ PHE E 4 21.160 17.235 12.743 1.00 24.13 C ANISOU 3443 CZ PHE E 4 3041 3038 3088 -887 486 74 C ATOM 3444 H PHE E 4 25.613 16.030 13.331 1.00 28.90 H ATOM 3445 HA PHE E 4 25.738 13.407 13.595 1.00 24.66 H ATOM 3446 HB2 PHE E 4 23.501 13.485 14.192 1.00 22.61 H ATOM 3447 HB3 PHE E 4 24.302 14.612 14.969 1.00 22.61 H ATOM 3448 HD1 PHE E 4 22.156 14.218 12.189 1.00 21.19 H ATOM 3449 HD2 PHE E 4 23.526 16.804 14.903 1.00 27.77 H ATOM 3450 HE1 PHE E 4 20.631 15.781 11.456 1.00 23.11 H ATOM 3451 HE2 PHE E 4 22.003 18.381 14.179 1.00 30.48 H ATOM 3452 HZ PHE E 4 20.547 17.868 12.446 1.00 28.95 H ATOM 3453 N CYS E 5 24.919 14.387 10.773 1.00 16.45 N ANISOU 3453 N CYS E 5 2019 1968 2263 -172 209 42 N ATOM 3454 CA CYS E 5 24.638 13.933 9.413 1.00 15.60 C ANISOU 3454 CA CYS E 5 1929 1841 2159 -29 192 120 C ATOM 3455 C CYS E 5 25.585 12.824 8.973 1.00 16.15 C ANISOU 3455 C CYS E 5 1981 1823 2332 -13 155 340 C ATOM 3456 O CYS E 5 25.297 12.096 8.020 1.00 13.90 O ANISOU 3456 O CYS E 5 1630 1378 2274 65 199 460 O ATOM 3457 CB CYS E 5 24.737 15.094 8.422 1.00 14.47 C ANISOU 3457 CB CYS E 5 1846 1642 2010 56 425 -39 C ATOM 3458 SG CYS E 5 23.502 16.384 8.669 1.00 15.17 S ANISOU 3458 SG CYS E 5 2110 1421 2235 56 363 -188 S ATOM 3459 H CYS E 5 25.185 15.202 10.827 1.00 19.74 H ATOM 3460 HA CYS E 5 23.724 13.581 9.377 1.00 18.72 H ATOM 3461 HB2 CYS E 5 25.613 15.503 8.509 1.00 17.36 H ATOM 3462 HB3 CYS E 5 24.626 14.747 7.523 1.00 17.36 H ATOM 3463 N LEU E 6 26.715 12.705 9.663 1.00 19.38 N ANISOU 3463 N LEU E 6 2390 2341 2631 -94 50 332 N ATOM 3464 CA LEU E 6 27.747 11.739 9.297 1.00 22.80 C ANISOU 3464 CA LEU E 6 2852 2794 3019 -206 129 477 C ATOM 3465 C LEU E 6 27.619 10.419 10.054 1.00 21.99 C ANISOU 3465 C LEU E 6 2679 2631 3047 2 219 662 C ATOM 3466 O LEU E 6 28.378 9.476 9.809 1.00 21.38 O ANISOU 3466 O LEU E 6 2440 2535 3150 133 168 823 O ATOM 3467 CB LEU E 6 29.132 12.341 9.556 1.00 26.12 C ANISOU 3467 CB LEU E 6 3258 3278 3389 -497 169 368 C ATOM 3468 CG LEU E 6 29.311 13.725 8.935 1.00 32.22 C ANISOU 3468 CG LEU E 6 4065 4074 4104 -832 210 247 C ATOM 3469 CD1 LEU E 6 30.646 14.328 9.329 1.00 41.69 C ANISOU 3469 CD1 LEU E 6 5256 5266 5318 -856 187 229 C ATOM 3470 CD2 LEU E 6 29.183 13.620 7.428 1.00 27.34 C ANISOU 3470 CD2 LEU E 6 3443 3416 3527 -1002 210 199 C ATOM 3471 H LEU E 6 26.909 13.176 10.356 1.00 23.25 H ATOM 3472 HA LEU E 6 27.676 11.545 8.339 1.00 27.36 H ATOM 3473 HB2 LEU E 6 29.265 12.424 10.513 1.00 31.35 H ATOM 3474 HB3 LEU E 6 29.806 11.755 9.177 1.00 31.35 H ATOM 3475 HG LEU E 6 28.608 14.311 9.257 1.00 38.66 H ATOM 3476 HD11 LEU E 6 30.728 15.195 8.925 1.00 50.03 H ATOM 3477 HD12 LEU E 6 30.682 14.408 10.285 1.00 50.03 H ATOM 3478 HD13 LEU E 6 31.351 13.754 9.022 1.00 50.03 H ATOM 3479 HD21 LEU E 6 29.297 14.492 7.043 1.00 32.80 H ATOM 3480 HD22 LEU E 6 29.861 13.025 7.098 1.00 32.80 H ATOM 3481 HD23 LEU E 6 28.313 13.277 7.211 1.00 32.80 H ATOM 3482 N GLU E 7 26.665 10.347 10.968 1.00 22.32 N ANISOU 3482 N GLU E 7 2774 2657 3051 164 370 747 N ATOM 3483 CA GLU E 7 26.514 9.153 11.778 1.00 23.75 C ANISOU 3483 CA GLU E 7 2922 2855 3247 203 508 775 C ATOM 3484 C GLU E 7 25.705 8.114 10.992 1.00 21.65 C ANISOU 3484 C GLU E 7 2663 2395 3167 314 860 862 C ATOM 3485 O GLU E 7 24.845 8.461 10.173 1.00 18.49 O ANISOU 3485 O GLU E 7 2299 1690 3036 293 948 798 O ATOM 3486 CB GLU E 7 25.869 9.490 13.127 1.00 31.58 C ANISOU 3486 CB GLU E 7 4014 3898 4086 74 453 717 C ATOM 3487 CG GLU E 7 24.378 9.649 13.067 1.00 33.76 C ANISOU 3487 CG GLU E 7 4304 4215 4308 10 512 556 C ATOM 3488 CD GLU E 7 23.773 10.185 14.367 1.00 33.10 C ANISOU 3488 CD GLU E 7 4286 4164 4126 -120 386 441 C ATOM 3489 OE1 GLU E 7 24.442 10.160 15.436 1.00 35.13 O ANISOU 3489 OE1 GLU E 7 4696 4494 4157 -239 493 339 O ATOM 3490 OE2 GLU E 7 22.616 10.620 14.314 1.00 29.31 O ANISOU 3490 OE2 GLU E 7 3476 3598 4061 -78 89 480 O ATOM 3491 H GLU E 7 26.097 10.970 11.138 1.00 26.79 H ATOM 3492 HA GLU E 7 27.400 8.775 11.955 1.00 28.50 H ATOM 3493 HB2 GLU E 7 26.065 8.775 13.753 1.00 37.89 H ATOM 3494 HB3 GLU E 7 26.242 10.323 13.452 1.00 37.89 H ATOM 3495 HG2 GLU E 7 24.157 10.271 12.357 1.00 40.51 H ATOM 3496 HG3 GLU E 7 23.977 8.784 12.886 1.00 40.51 H ATOM 3497 N PRO E 8 26.011 6.828 11.209 1.00 23.61 N ANISOU 3497 N PRO E 8 2910 2767 3295 487 876 902 N ATOM 3498 CA PRO E 8 25.261 5.743 10.570 1.00 21.04 C ANISOU 3498 CA PRO E 8 2593 2490 2912 499 828 980 C ATOM 3499 C PRO E 8 23.778 5.788 10.972 1.00 18.89 C ANISOU 3499 C PRO E 8 2293 2116 2769 357 743 1072 C ATOM 3500 O PRO E 8 23.452 6.249 12.066 1.00 18.44 O ANISOU 3500 O PRO E 8 2259 2007 2739 232 552 933 O ATOM 3501 CB PRO E 8 25.909 4.470 11.147 1.00 24.36 C ANISOU 3501 CB PRO E 8 3039 2989 3226 629 867 980 C ATOM 3502 CG PRO E 8 27.204 4.896 11.738 1.00 29.37 C ANISOU 3502 CG PRO E 8 3707 3647 3803 661 964 987 C ATOM 3503 CD PRO E 8 27.065 6.336 12.114 1.00 30.04 C ANISOU 3503 CD PRO E 8 3786 3709 3919 634 907 947 C ATOM 3504 HA PRO E 8 25.356 5.765 9.595 1.00 25.25 H ATOM 3505 HB2 PRO E 8 25.331 4.094 11.829 1.00 29.23 H ATOM 3506 HB3 PRO E 8 26.055 3.830 10.433 1.00 29.23 H ATOM 3507 HG2 PRO E 8 27.389 4.359 12.524 1.00 35.24 H ATOM 3508 HG3 PRO E 8 27.908 4.786 11.080 1.00 35.24 H ATOM 3509 HD2 PRO E 8 26.783 6.418 13.038 1.00 36.05 H ATOM 3510 HD3 PRO E 8 27.897 6.809 11.952 1.00 36.05 H ATOM 3511 N PRO E 9 22.888 5.301 10.103 1.00 19.68 N ANISOU 3511 N PRO E 9 2459 2244 2773 249 796 1148 N ATOM 3512 CA PRO E 9 21.457 5.244 10.434 1.00 19.95 C ANISOU 3512 CA PRO E 9 2547 2357 2677 16 754 1000 C ATOM 3513 C PRO E 9 21.203 4.252 11.569 1.00 16.68 C ANISOU 3513 C PRO E 9 2181 1814 2344 -75 704 751 C ATOM 3514 O PRO E 9 21.916 3.261 11.694 1.00 16.95 O ANISOU 3514 O PRO E 9 2278 1667 2496 -79 962 713 O ATOM 3515 CB PRO E 9 20.819 4.767 9.127 1.00 21.40 C ANISOU 3515 CB PRO E 9 2718 2630 2782 64 722 1176 C ATOM 3516 CG PRO E 9 21.932 4.069 8.413 1.00 22.77 C ANISOU 3516 CG PRO E 9 2898 2817 2938 83 822 1236 C ATOM 3517 CD PRO E 9 23.136 4.884 8.716 1.00 23.58 C ANISOU 3517 CD PRO E 9 3004 2881 3075 181 800 1199 C ATOM 3518 HA PRO E 9 21.114 6.130 10.674 1.00 23.94 H ATOM 3519 HB2 PRO E 9 20.092 4.153 9.319 1.00 25.67 H ATOM 3520 HB3 PRO E 9 20.504 5.529 8.616 1.00 25.67 H ATOM 3521 HG2 PRO E 9 22.030 3.168 8.757 1.00 27.33 H ATOM 3522 HG3 PRO E 9 21.755 4.058 7.459 1.00 27.33 H ATOM 3523 HD2 PRO E 9 23.939 4.342 8.661 1.00 28.30 H ATOM 3524 HD3 PRO E 9 23.183 5.656 8.131 1.00 28.30 H ATOM 3525 N TYR E 10 20.198 4.540 12.385 1.00 13.26 N ANISOU 3525 N TYR E 10 1677 1502 1860 -241 355 449 N ATOM 3526 CA TYR E 10 19.964 3.826 13.633 1.00 10.98 C ANISOU 3526 CA TYR E 10 1397 1213 1561 -251 65 303 C ATOM 3527 C TYR E 10 18.514 3.344 13.726 1.00 8.72 C ANISOU 3527 C TYR E 10 1065 897 1354 -30 181 150 C ATOM 3528 O TYR E 10 17.597 4.109 14.005 1.00 8.50 O ANISOU 3528 O TYR E 10 879 1010 1342 37 122 200 O ATOM 3529 CB TYR E 10 20.318 4.731 14.820 1.00 12.03 C ANISOU 3529 CB TYR E 10 1484 1466 1621 -407 -265 422 C ATOM 3530 CG TYR E 10 20.200 4.063 16.170 1.00 12.87 C ANISOU 3530 CG TYR E 10 1624 1527 1741 -552 -532 602 C ATOM 3531 CD1 TYR E 10 19.196 4.423 17.058 1.00 12.93 C ANISOU 3531 CD1 TYR E 10 1598 1556 1759 -838 -671 636 C ATOM 3532 CD2 TYR E 10 21.101 3.064 16.564 1.00 15.67 C ANISOU 3532 CD2 TYR E 10 1986 1935 2034 -498 -502 720 C ATOM 3533 CE1 TYR E 10 19.086 3.816 18.307 1.00 13.54 C ANISOU 3533 CE1 TYR E 10 1741 1619 1785 -728 -667 736 C ATOM 3534 CE2 TYR E 10 20.992 2.444 17.814 1.00 15.28 C ANISOU 3534 CE2 TYR E 10 1922 1890 1996 -575 -579 840 C ATOM 3535 CZ TYR E 10 19.980 2.835 18.683 1.00 15.64 C ANISOU 3535 CZ TYR E 10 2017 1940 1986 -747 -603 758 C ATOM 3536 OH TYR E 10 19.850 2.230 19.927 1.00 17.33 O ANISOU 3536 OH TYR E 10 2234 2204 2145 -859 -723 689 O ATOM 3537 H TYR E 10 19.623 5.162 12.234 1.00 15.91 H ATOM 3538 HA TYR E 10 20.547 3.040 13.666 1.00 13.17 H ATOM 3539 HB2 TYR E 10 21.235 5.030 14.719 1.00 14.44 H ATOM 3540 HB3 TYR E 10 19.722 5.496 14.817 1.00 14.44 H ATOM 3541 HD1 TYR E 10 18.591 5.086 16.818 1.00 15.51 H ATOM 3542 HD2 TYR E 10 21.780 2.806 15.984 1.00 18.81 H ATOM 3543 HE1 TYR E 10 18.406 4.071 18.888 1.00 16.25 H ATOM 3544 HE2 TYR E 10 21.596 1.783 18.064 1.00 18.34 H ATOM 3545 HH TYR E 10 20.528 2.352 20.372 1.00 20.79 H ATOM 3546 N THR E 11 18.315 2.052 13.482 1.00 8.85 N ANISOU 3546 N THR E 11 1173 862 1327 170 453 162 N ATOM 3547 CA THR E 11 16.992 1.452 13.542 1.00 9.42 C ANISOU 3547 CA THR E 11 1325 931 1324 110 489 68 C ATOM 3548 C THR E 11 16.470 1.514 14.983 1.00 8.62 C ANISOU 3548 C THR E 11 1285 839 1149 33 342 209 C ATOM 3549 O THR E 11 15.296 1.788 15.208 1.00 7.58 O ANISOU 3549 O THR E 11 1175 734 971 112 333 207 O ATOM 3550 CB THR E 11 17.036 -0.013 13.049 1.00 11.23 C ANISOU 3550 CB THR E 11 1503 1252 1512 20 549 -36 C ATOM 3551 OG1 THR E 11 17.252 -0.033 11.625 1.00 11.82 O ANISOU 3551 OG1 THR E 11 1573 1310 1609 66 560 -96 O ATOM 3552 CG2 THR E 11 15.730 -0.759 13.402 1.00 9.55 C ANISOU 3552 CG2 THR E 11 1244 1094 1289 -21 615 69 C ATOM 3553 H THR E 11 18.940 1.497 13.278 1.00 10.62 H ATOM 3554 HA THR E 11 16.378 1.955 12.967 1.00 11.30 H ATOM 3555 HB THR E 11 17.771 -0.471 13.486 1.00 13.48 H ATOM 3556 HG1 THR E 11 16.643 0.362 11.243 1.00 14.18 H ATOM 3557 HG21 THR E 11 15.775 -1.665 13.089 1.00 11.46 H ATOM 3558 HG22 THR E 11 15.602 -0.764 14.353 1.00 11.46 H ATOM 3559 HG23 THR E 11 14.981 -0.323 12.989 1.00 11.46 H ATOM 3560 N GLY E 12 17.361 1.299 15.953 1.00 9.65 N ANISOU 3560 N GLY E 12 1246 1115 1307 -17 187 151 N ATOM 3561 CA GLY E 12 16.986 1.286 17.358 1.00 9.76 C ANISOU 3561 CA GLY E 12 1192 1196 1319 -4 84 283 C ATOM 3562 C GLY E 12 16.318 -0.015 17.775 1.00 8.41 C ANISOU 3562 C GLY E 12 1098 937 1161 -3 79 137 C ATOM 3563 O GLY E 12 16.160 -0.928 16.968 1.00 7.49 O ANISOU 3563 O GLY E 12 992 848 1005 3 72 -78 O ATOM 3564 H GLY E 12 18.198 1.157 15.816 1.00 11.58 H ATOM 3565 HA2 GLY E 12 17.777 1.413 17.904 1.00 11.71 H ATOM 3566 HA3 GLY E 12 16.372 2.016 17.535 1.00 11.71 H ATOM 3567 N PRO E 13 15.917 -0.098 19.053 1.00 7.40 N ANISOU 3567 N PRO E 13 879 835 1097 -128 89 153 N ATOM 3568 CA PRO E 13 15.474 -1.361 19.656 1.00 7.39 C ANISOU 3568 CA PRO E 13 899 917 991 5 49 180 C ATOM 3569 C PRO E 13 14.021 -1.728 19.394 1.00 6.49 C ANISOU 3569 C PRO E 13 840 853 773 -23 87 72 C ATOM 3570 O PRO E 13 13.669 -2.900 19.503 1.00 5.99 O ANISOU 3570 O PRO E 13 682 862 733 -4 80 113 O ATOM 3571 CB PRO E 13 15.668 -1.117 21.155 1.00 8.91 C ANISOU 3571 CB PRO E 13 1134 1088 1163 -38 45 130 C ATOM 3572 CG PRO E 13 15.502 0.359 21.328 1.00 9.96 C ANISOU 3572 CG PRO E 13 1282 1207 1295 -27 120 160 C ATOM 3573 CD PRO E 13 15.989 0.998 20.036 1.00 9.89 C ANISOU 3573 CD PRO E 13 1218 1226 1311 -90 105 144 C ATOM 3574 HA PRO E 13 16.052 -2.098 19.369 1.00 8.86 H ATOM 3575 HB2 PRO E 13 14.992 -1.600 21.656 1.00 10.69 H ATOM 3576 HB3 PRO E 13 16.559 -1.396 21.420 1.00 10.69 H ATOM 3577 HG2 PRO E 13 14.566 0.564 21.476 1.00 11.95 H ATOM 3578 HG3 PRO E 13 16.039 0.659 22.078 1.00 11.95 H ATOM 3579 HD2 PRO E 13 15.400 1.723 19.776 1.00 11.86 H ATOM 3580 HD3 PRO E 13 16.905 1.302 20.135 1.00 11.86 H ATOM 3581 N CYS E 14 13.179 -0.751 19.092 1.00 5.95 N ANISOU 3581 N CYS E 14 795 689 775 75 127 -12 N ATOM 3582 CA CYS E 14 11.760 -1.051 18.933 1.00 6.27 C ANISOU 3582 CA CYS E 14 830 744 807 -46 66 -23 C ATOM 3583 C CYS E 14 11.531 -1.795 17.617 1.00 6.29 C ANISOU 3583 C CYS E 14 772 795 822 -59 146 -13 C ATOM 3584 O CYS E 14 12.354 -1.733 16.698 1.00 6.22 O ANISOU 3584 O CYS E 14 696 803 863 -158 138 83 O ATOM 3585 CB CYS E 14 10.894 0.212 19.064 1.00 7.28 C ANISOU 3585 CB CYS E 14 928 937 900 -149 157 -105 C ATOM 3586 SG CYS E 14 10.781 0.798 20.768 1.00 8.37 S ANISOU 3586 SG CYS E 14 1194 1019 967 20 282 -132 S ATOM 3587 H CYS E 14 13.393 0.073 18.976 1.00 7.13 H ATOM 3588 HA CYS E 14 11.494 -1.657 19.655 1.00 7.52 H ATOM 3589 HB2 CYS E 14 11.283 0.920 18.527 1.00 8.73 H ATOM 3590 HB3 CYS E 14 9.996 0.015 18.753 1.00 8.73 H ATOM 3591 N ARG E 15 10.413 -2.507 17.540 1.00 5.71 N ANISOU 3591 N ARG E 15 669 682 817 -94 161 -59 N ATOM 3592 CA ARG E 15 10.210 -3.502 16.492 1.00 7.10 C ANISOU 3592 CA ARG E 15 890 830 977 -176 180 39 C ATOM 3593 C ARG E 15 9.084 -3.173 15.494 1.00 6.87 C ANISOU 3593 C ARG E 15 926 728 956 -129 258 114 C ATOM 3594 O ARG E 15 8.540 -4.060 14.862 1.00 6.12 O ANISOU 3594 O ARG E 15 895 587 842 -181 473 2 O ATOM 3595 CB ARG E 15 10.091 -4.905 17.122 1.00 7.57 C ANISOU 3595 CB ARG E 15 966 868 1043 -264 229 -113 C ATOM 3596 CG ARG E 15 11.456 -5.366 17.595 1.00 7.39 C ANISOU 3596 CG ARG E 15 1020 762 1025 -203 278 -146 C ATOM 3597 CD ARG E 15 11.474 -6.697 18.348 1.00 9.51 C ANISOU 3597 CD ARG E 15 1288 1071 1254 -136 339 -51 C ATOM 3598 NE ARG E 15 12.869 -7.074 18.593 1.00 8.36 N ANISOU 3598 NE ARG E 15 1118 920 1140 100 350 -37 N ATOM 3599 CZ ARG E 15 13.275 -8.177 19.213 1.00 7.31 C ANISOU 3599 CZ ARG E 15 935 881 962 44 146 25 C ATOM 3600 NH1 ARG E 15 12.403 -9.041 19.685 1.00 6.52 N ANISOU 3600 NH1 ARG E 15 781 812 884 -18 167 104 N ATOM 3601 NH2 ARG E 15 14.572 -8.407 19.366 1.00 8.04 N ANISOU 3601 NH2 ARG E 15 955 1033 1067 -93 35 -15 N ATOM 3602 H ARG E 15 9.752 -2.434 18.085 1.00 6.85 H ATOM 3603 HA ARG E 15 11.033 -3.520 15.960 1.00 8.52 H ATOM 3604 HB2 ARG E 15 9.493 -4.870 17.886 1.00 9.08 H ATOM 3605 HB3 ARG E 15 9.763 -5.534 16.460 1.00 9.08 H ATOM 3606 HG2 ARG E 15 12.033 -5.462 16.821 1.00 8.86 H ATOM 3607 HG3 ARG E 15 11.820 -4.691 18.189 1.00 8.86 H ATOM 3608 HD2 ARG E 15 11.022 -6.599 19.200 1.00 11.41 H ATOM 3609 HD3 ARG E 15 11.054 -7.386 17.810 1.00 11.41 H ATOM 3610 HE ARG E 15 13.555 -6.466 18.276 1.00 10.03 H ATOM 3611 HH11 ARG E 15 11.561 -8.899 19.588 1.00 7.82 H ATOM 3612 HH12 ARG E 15 12.676 -9.751 20.086 1.00 7.82 H ATOM 3613 HH21 ARG E 15 15.148 -7.845 19.063 1.00 9.65 H ATOM 3614 HH22 ARG E 15 14.838 -9.118 19.772 1.00 9.65 H ATOM 3615 N ALA E 16 8.755 -1.889 15.345 1.00 6.35 N ANISOU 3615 N ALA E 16 867 560 986 50 189 51 N ATOM 3616 CA ALA E 16 7.953 -1.450 14.197 1.00 6.94 C ANISOU 3616 CA ALA E 16 962 715 960 33 116 146 C ATOM 3617 C ALA E 16 8.859 -1.371 12.967 1.00 6.85 C ANISOU 3617 C ALA E 16 962 664 978 -92 155 42 C ATOM 3618 O ALA E 16 10.067 -1.578 13.074 1.00 7.50 O ANISOU 3618 O ALA E 16 1068 779 1003 -210 113 71 O ATOM 3619 CB ALA E 16 7.317 -0.088 14.459 1.00 8.40 C ANISOU 3619 CB ALA E 16 1087 1012 1092 54 34 361 C ATOM 3620 H ALA E 16 8.979 -1.259 15.886 1.00 7.62 H ATOM 3621 HA ALA E 16 7.241 -2.101 14.022 1.00 8.33 H ATOM 3622 HB1 ALA E 16 6.801 0.169 13.691 1.00 10.08 H ATOM 3623 HB2 ALA E 16 6.748 -0.152 15.230 1.00 10.08 H ATOM 3624 HB3 ALA E 16 8.012 0.555 14.617 1.00 10.08 H ATOM 3625 N GLY E 17 8.286 -1.053 11.808 1.00 7.90 N ANISOU 3625 N GLY E 17 991 938 1074 -140 148 -54 N ATOM 3626 CA GLY E 17 9.068 -0.738 10.615 1.00 9.41 C ANISOU 3626 CA GLY E 17 1207 1177 1192 -104 157 58 C ATOM 3627 C GLY E 17 8.519 0.503 9.949 1.00 11.16 C ANISOU 3627 C GLY E 17 1512 1496 1233 -336 -24 439 C ATOM 3628 O GLY E 17 7.570 0.427 9.166 1.00 12.83 O ANISOU 3628 O GLY E 17 1891 1707 1276 -581 -265 528 O ATOM 3629 H GLY E 17 7.435 -1.013 11.686 1.00 9.48 H ATOM 3630 HA2 GLY E 17 9.994 -0.582 10.858 1.00 11.30 H ATOM 3631 HA3 GLY E 17 9.027 -1.477 9.987 1.00 11.30 H ATOM 3632 N ILE E 18 9.104 1.646 10.306 1.00 9.65 N ANISOU 3632 N ILE E 18 1320 1027 1317 -295 33 679 N ATOM 3633 CA ILE E 18 8.639 2.970 9.915 1.00 13.05 C ANISOU 3633 CA ILE E 18 1708 1502 1747 -396 87 825 C ATOM 3634 C ILE E 18 9.653 3.528 8.917 1.00 12.25 C ANISOU 3634 C ILE E 18 1688 1326 1640 -348 25 490 C ATOM 3635 O ILE E 18 10.842 3.620 9.213 1.00 11.57 O ANISOU 3635 O ILE E 18 1559 1278 1558 -228 99 405 O ATOM 3636 CB ILE E 18 8.583 3.910 11.151 1.00 19.64 C ANISOU 3636 CB ILE E 18 2516 2348 2598 -140 216 1044 C ATOM 3637 CG1 ILE E 18 7.788 3.276 12.308 1.00 29.29 C ANISOU 3637 CG1 ILE E 18 3743 3634 3750 29 221 1032 C ATOM 3638 CG2 ILE E 18 8.016 5.276 10.777 1.00 23.04 C ANISOU 3638 CG2 ILE E 18 2947 2818 2987 -131 294 1142 C ATOM 3639 CD1 ILE E 18 6.331 3.099 12.037 1.00 30.93 C ANISOU 3639 CD1 ILE E 18 3910 3857 3985 36 210 1086 C ATOM 3640 H ILE E 18 9.807 1.676 10.800 1.00 11.57 H ATOM 3641 HA ILE E 18 7.755 2.919 9.496 1.00 15.66 H ATOM 3642 HB ILE E 18 9.493 4.043 11.460 1.00 23.56 H ATOM 3643 HG12 ILE E 18 8.160 2.401 12.497 1.00 35.14 H ATOM 3644 HG13 ILE E 18 7.874 3.844 13.090 1.00 35.14 H ATOM 3645 HG21 ILE E 18 7.995 5.831 11.560 1.00 27.64 H ATOM 3646 HG22 ILE E 18 8.578 5.674 10.108 1.00 27.64 H ATOM 3647 HG23 ILE E 18 7.128 5.162 10.432 1.00 27.64 H ATOM 3648 HD11 ILE E 18 5.917 2.700 12.806 1.00 37.11 H ATOM 3649 HD12 ILE E 18 5.939 3.957 11.862 1.00 37.11 H ATOM 3650 HD13 ILE E 18 6.223 2.527 11.274 1.00 37.11 H ATOM 3651 N ILE E 19 9.201 3.907 7.731 1.00 12.63 N ANISOU 3651 N ILE E 19 1719 1384 1696 -574 -96 449 N ATOM 3652 CA ILE E 19 10.127 4.411 6.725 1.00 14.31 C ANISOU 3652 CA ILE E 19 1912 1655 1870 -669 -97 437 C ATOM 3653 C ILE E 19 10.582 5.825 7.091 1.00 10.85 C ANISOU 3653 C ILE E 19 1524 1204 1395 -478 -126 432 C ATOM 3654 O ILE E 19 9.760 6.730 7.327 1.00 11.24 O ANISOU 3654 O ILE E 19 1565 1429 1278 -423 -196 449 O ATOM 3655 CB ILE E 19 9.491 4.388 5.327 1.00 20.13 C ANISOU 3655 CB ILE E 19 2648 2434 2566 -918 -90 377 C ATOM 3656 CG1 ILE E 19 9.215 2.938 4.909 1.00 31.23 C ANISOU 3656 CG1 ILE E 19 3974 3905 3987 -1049 -128 470 C ATOM 3657 CG2 ILE E 19 10.417 5.054 4.310 1.00 16.93 C ANISOU 3657 CG2 ILE E 19 2174 2084 2176 -922 -75 328 C ATOM 3658 CD1 ILE E 19 7.941 2.762 4.158 1.00 48.62 C ANISOU 3658 CD1 ILE E 19 6163 6130 6181 -1086 -67 485 C ATOM 3659 H ILE E 19 8.377 3.883 7.484 1.00 15.16 H ATOM 3660 HA ILE E 19 10.920 3.835 6.706 1.00 17.17 H ATOM 3661 HB ILE E 19 8.652 4.874 5.355 1.00 24.16 H ATOM 3662 HG12 ILE E 19 9.939 2.633 4.341 1.00 37.47 H ATOM 3663 HG13 ILE E 19 9.168 2.386 5.706 1.00 37.47 H ATOM 3664 HG21 ILE E 19 10.000 5.029 3.446 1.00 20.32 H ATOM 3665 HG22 ILE E 19 10.568 5.965 4.575 1.00 20.32 H ATOM 3666 HG23 ILE E 19 11.250 4.577 4.288 1.00 20.32 H ATOM 3667 HD11 ILE E 19 7.838 1.834 3.932 1.00 58.35 H ATOM 3668 HD12 ILE E 19 7.211 3.048 4.711 1.00 58.35 H ATOM 3669 HD13 ILE E 19 7.974 3.292 3.359 1.00 58.35 H ATOM 3670 N ARG E 20 11.896 5.995 7.185 1.00 10.05 N ANISOU 3670 N ARG E 20 1439 1072 1306 -281 42 407 N ATOM 3671 CA ARG E 20 12.497 7.290 7.487 1.00 9.51 C ANISOU 3671 CA ARG E 20 1320 1000 1294 -198 82 330 C ATOM 3672 C ARG E 20 13.681 7.558 6.546 1.00 10.21 C ANISOU 3672 C ARG E 20 1491 989 1401 -293 282 358 C ATOM 3673 O ARG E 20 14.164 6.650 5.872 1.00 9.90 O ANISOU 3673 O ARG E 20 1691 708 1362 -417 295 448 O ATOM 3674 CB ARG E 20 12.957 7.318 8.947 1.00 9.17 C ANISOU 3674 CB ARG E 20 1247 1012 1224 -285 49 228 C ATOM 3675 CG ARG E 20 11.827 7.311 9.980 1.00 9.06 C ANISOU 3675 CG ARG E 20 1156 1069 1217 -216 39 420 C ATOM 3676 CD ARG E 20 10.975 8.617 9.993 1.00 9.93 C ANISOU 3676 CD ARG E 20 1289 1180 1305 -272 223 531 C ATOM 3677 NE ARG E 20 9.907 8.604 11.002 1.00 9.66 N ANISOU 3677 NE ARG E 20 1322 1089 1260 -74 342 480 N ATOM 3678 CZ ARG E 20 10.066 8.932 12.282 1.00 12.20 C ANISOU 3678 CZ ARG E 20 1625 1387 1625 -29 633 603 C ATOM 3679 NH1 ARG E 20 11.252 9.306 12.743 1.00 13.01 N ANISOU 3679 NH1 ARG E 20 1709 1565 1668 166 543 581 N ATOM 3680 NH2 ARG E 20 9.027 8.904 13.107 1.00 14.49 N ANISOU 3680 NH2 ARG E 20 1885 1723 1899 -103 894 565 N ATOM 3681 H ARG E 20 12.471 5.364 7.075 1.00 12.05 H ATOM 3682 HA ARG E 20 11.831 7.997 7.357 1.00 11.41 H ATOM 3683 HB2 ARG E 20 13.509 6.538 9.112 1.00 11.00 H ATOM 3684 HB3 ARG E 20 13.479 8.123 9.090 1.00 11.00 H ATOM 3685 HG2 ARG E 20 11.231 6.571 9.785 1.00 10.87 H ATOM 3686 HG3 ARG E 20 12.212 7.200 10.863 1.00 10.87 H ATOM 3687 HD2 ARG E 20 11.556 9.370 10.184 1.00 11.92 H ATOM 3688 HD3 ARG E 20 10.561 8.732 9.123 1.00 11.92 H ATOM 3689 HE ARG E 20 9.021 8.337 10.713 1.00 11.59 H ATOM 3690 HH11 ARG E 20 11.930 9.334 12.215 1.00 15.61 H ATOM 3691 HH12 ARG E 20 11.344 9.516 13.572 1.00 15.61 H ATOM 3692 HH21 ARG E 20 8.255 8.661 12.817 1.00 17.39 H ATOM 3693 HH22 ARG E 20 9.130 9.111 13.935 1.00 17.39 H ATOM 3694 N TYR E 21 14.131 8.808 6.480 1.00 11.44 N ANISOU 3694 N TYR E 21 1576 1175 1597 -222 514 146 N ATOM 3695 CA TYR E 21 15.330 9.179 5.713 1.00 13.54 C ANISOU 3695 CA TYR E 21 1828 1520 1796 -253 535 214 C ATOM 3696 C TYR E 21 16.562 9.423 6.599 1.00 11.61 C ANISOU 3696 C TYR E 21 1569 1147 1694 -167 605 273 C ATOM 3697 O TYR E 21 16.450 9.846 7.750 1.00 10.58 O ANISOU 3697 O TYR E 21 1515 882 1621 -84 631 392 O ATOM 3698 CB TYR E 21 15.052 10.449 4.893 1.00 15.13 C ANISOU 3698 CB TYR E 21 1917 1767 2066 -284 507 267 C ATOM 3699 CG TYR E 21 14.199 10.192 3.676 1.00 23.18 C ANISOU 3699 CG TYR E 21 2971 2753 3084 -249 357 238 C ATOM 3700 CD1 TYR E 21 12.815 10.241 3.755 1.00 28.83 C ANISOU 3700 CD1 TYR E 21 3650 3547 3758 -125 272 174 C ATOM 3701 CD2 TYR E 21 14.778 9.874 2.451 1.00 28.11 C ANISOU 3701 CD2 TYR E 21 3579 3434 3668 -194 302 213 C ATOM 3702 CE1 TYR E 21 12.032 9.995 2.649 1.00 35.15 C ANISOU 3702 CE1 TYR E 21 4410 4456 4487 -106 216 125 C ATOM 3703 CE2 TYR E 21 14.001 9.626 1.340 1.00 30.46 C ANISOU 3703 CE2 TYR E 21 3843 3779 3952 -77 206 161 C ATOM 3704 CZ TYR E 21 12.628 9.687 1.444 1.00 35.43 C ANISOU 3704 CZ TYR E 21 4463 4477 4523 -59 227 78 C ATOM 3705 OH TYR E 21 11.844 9.440 0.333 1.00 40.72 O ANISOU 3705 OH TYR E 21 5144 5158 5169 13 302 -33 O ATOM 3706 H TYR E 21 13.757 9.474 6.875 1.00 13.73 H ATOM 3707 HA TYR E 21 15.545 8.456 5.088 1.00 16.24 H ATOM 3708 HB2 TYR E 21 14.588 11.091 5.453 1.00 18.16 H ATOM 3709 HB3 TYR E 21 15.896 10.821 4.593 1.00 18.16 H ATOM 3710 HD1 TYR E 21 12.410 10.448 4.566 1.00 34.60 H ATOM 3711 HD2 TYR E 21 15.704 9.831 2.381 1.00 33.73 H ATOM 3712 HE1 TYR E 21 11.105 10.036 2.714 1.00 42.17 H ATOM 3713 HE2 TYR E 21 14.400 9.419 0.526 1.00 36.55 H ATOM 3714 HH TYR E 21 11.984 8.682 0.054 1.00 48.86 H ATOM 3715 N PHE E 22 17.735 9.130 6.063 1.00 12.38 N ANISOU 3715 N PHE E 22 1764 1304 1636 -354 764 202 N ATOM 3716 CA PHE E 22 18.991 9.517 6.691 1.00 12.13 C ANISOU 3716 CA PHE E 22 1686 1375 1548 -300 860 189 C ATOM 3717 C PHE E 22 19.903 10.069 5.607 1.00 11.70 C ANISOU 3717 C PHE E 22 1736 1247 1462 -376 872 -18 C ATOM 3718 O PHE E 22 19.761 9.732 4.422 1.00 11.76 O ANISOU 3718 O PHE E 22 1975 1065 1428 -416 963 -141 O ATOM 3719 CB PHE E 22 19.659 8.330 7.426 1.00 11.22 C ANISOU 3719 CB PHE E 22 1477 1301 1485 -94 883 334 C ATOM 3720 CG PHE E 22 20.306 7.325 6.517 1.00 14.22 C ANISOU 3720 CG PHE E 22 1894 1652 1857 -95 1144 461 C ATOM 3721 CD1 PHE E 22 21.688 7.285 6.383 1.00 15.77 C ANISOU 3721 CD1 PHE E 22 2076 1840 2077 120 1226 518 C ATOM 3722 CD2 PHE E 22 19.538 6.422 5.800 1.00 16.34 C ANISOU 3722 CD2 PHE E 22 2131 1963 2113 -110 1345 474 C ATOM 3723 CE1 PHE E 22 22.303 6.365 5.542 1.00 17.86 C ANISOU 3723 CE1 PHE E 22 2338 2162 2286 -14 1293 480 C ATOM 3724 CE2 PHE E 22 20.150 5.489 4.957 1.00 18.23 C ANISOU 3724 CE2 PHE E 22 2398 2173 2355 78 1422 490 C ATOM 3725 CZ PHE E 22 21.532 5.468 4.834 1.00 18.49 C ANISOU 3725 CZ PHE E 22 2468 2182 2374 56 1338 477 C ATOM 3726 H PHE E 22 17.834 8.700 5.325 1.00 14.85 H ATOM 3727 HA PHE E 22 18.822 10.228 7.344 1.00 14.56 H ATOM 3728 HB2 PHE E 22 20.346 8.678 8.017 1.00 13.46 H ATOM 3729 HB3 PHE E 22 18.984 7.867 7.945 1.00 13.46 H ATOM 3730 HD1 PHE E 22 22.210 7.890 6.859 1.00 18.92 H ATOM 3731 HD2 PHE E 22 18.612 6.435 5.881 1.00 19.60 H ATOM 3732 HE1 PHE E 22 23.230 6.350 5.462 1.00 21.43 H ATOM 3733 HE2 PHE E 22 19.631 4.885 4.477 1.00 21.87 H ATOM 3734 HZ PHE E 22 21.938 4.848 4.272 1.00 22.19 H ATOM 3735 N TYR E 23 20.837 10.925 5.995 1.00 11.03 N ANISOU 3735 N TYR E 23 1609 1119 1463 -283 869 -99 N ATOM 3736 CA TYR E 23 21.870 11.351 5.063 1.00 11.98 C ANISOU 3736 CA TYR E 23 1686 1316 1550 -287 930 -170 C ATOM 3737 C TYR E 23 22.992 10.314 5.009 1.00 12.82 C ANISOU 3737 C TYR E 23 1830 1415 1626 -62 829 -72 C ATOM 3738 O TYR E 23 23.589 9.975 6.036 1.00 12.68 O ANISOU 3738 O TYR E 23 1853 1369 1596 -114 724 -147 O ATOM 3739 CB TYR E 23 22.435 12.725 5.450 1.00 13.66 C ANISOU 3739 CB TYR E 23 1839 1575 1777 -450 1041 -86 C ATOM 3740 CG TYR E 23 23.440 13.240 4.455 1.00 14.29 C ANISOU 3740 CG TYR E 23 1959 1554 1918 -419 1090 -185 C ATOM 3741 CD1 TYR E 23 24.792 13.298 4.772 1.00 15.04 C ANISOU 3741 CD1 TYR E 23 1963 1715 2036 -447 1119 -181 C ATOM 3742 CD2 TYR E 23 23.045 13.666 3.200 1.00 14.66 C ANISOU 3742 CD2 TYR E 23 1973 1636 1961 -441 1065 -281 C ATOM 3743 CE1 TYR E 23 25.719 13.757 3.865 1.00 17.04 C ANISOU 3743 CE1 TYR E 23 2241 1992 2242 -610 1197 -215 C ATOM 3744 CE2 TYR E 23 23.958 14.123 2.289 1.00 16.17 C ANISOU 3744 CE2 TYR E 23 2160 1863 2119 -433 1207 -180 C ATOM 3745 CZ TYR E 23 25.296 14.172 2.622 1.00 17.61 C ANISOU 3745 CZ TYR E 23 2337 2060 2292 -575 1291 -169 C ATOM 3746 OH TYR E 23 26.211 14.640 1.708 1.00 20.62 O ANISOU 3746 OH TYR E 23 2756 2451 2627 -568 1448 -149 O ATOM 3747 H TYR E 23 20.896 11.270 6.780 1.00 13.23 H ATOM 3748 HA TYR E 23 21.481 11.425 4.166 1.00 14.38 H ATOM 3749 HB2 TYR E 23 21.707 13.364 5.500 1.00 16.40 H ATOM 3750 HB3 TYR E 23 22.875 12.655 6.312 1.00 16.40 H ATOM 3751 HD1 TYR E 23 25.077 13.014 5.611 1.00 18.05 H ATOM 3752 HD2 TYR E 23 22.145 13.632 2.968 1.00 17.59 H ATOM 3753 HE1 TYR E 23 26.620 13.791 4.090 1.00 20.45 H ATOM 3754 HE2 TYR E 23 23.676 14.407 1.450 1.00 19.40 H ATOM 3755 HH TYR E 23 26.764 14.058 1.541 1.00 24.74 H ATOM 3756 N ASN E 24 23.254 9.803 3.806 1.00 13.16 N ANISOU 3756 N ASN E 24 1831 1400 1768 396 884 -92 N ATOM 3757 CA ASN E 24 24.361 8.896 3.555 1.00 16.85 C ANISOU 3757 CA ASN E 24 2254 1995 2152 365 933 -21 C ATOM 3758 C ASN E 24 25.526 9.692 2.986 1.00 17.49 C ANISOU 3758 C ASN E 24 2379 1994 2271 394 1032 -73 C ATOM 3759 O ASN E 24 25.553 10.022 1.796 1.00 16.24 O ANISOU 3759 O ASN E 24 2418 1681 2072 428 989 37 O ATOM 3760 CB ASN E 24 23.939 7.801 2.574 1.00 17.45 C ANISOU 3760 CB ASN E 24 2295 2065 2269 328 895 82 C ATOM 3761 CG ASN E 24 25.061 6.806 2.280 1.00 19.18 C ANISOU 3761 CG ASN E 24 2554 2266 2469 223 948 108 C ATOM 3762 OD1 ASN E 24 26.238 7.065 2.552 1.00 18.96 O ANISOU 3762 OD1 ASN E 24 2676 2017 2509 159 974 -2 O ATOM 3763 ND2 ASN E 24 24.700 5.670 1.706 1.00 21.22 N ANISOU 3763 ND2 ASN E 24 2725 2589 2749 112 932 230 N ATOM 3764 H ASN E 24 22.789 9.975 3.103 1.00 15.79 H ATOM 3765 HA ASN E 24 24.644 8.477 4.395 1.00 20.22 H ATOM 3766 HB2 ASN E 24 23.193 7.309 2.951 1.00 20.94 H ATOM 3767 HB3 ASN E 24 23.676 8.213 1.736 1.00 20.94 H ATOM 3768 HD21 ASN E 24 25.376 4.992 1.493 1.00 25.46 H ATOM 3769 HD22 ASN E 24 23.758 5.506 1.494 1.00 25.46 H ATOM 3770 N ALA E 25 26.478 10.023 3.852 1.00 20.38 N ANISOU 3770 N ALA E 25 2636 2496 2611 378 1134 -80 N ATOM 3771 CA ALA E 25 27.561 10.920 3.492 1.00 22.67 C ANISOU 3771 CA ALA E 25 2837 2883 2894 385 1227 -218 C ATOM 3772 C ALA E 25 28.458 10.312 2.413 1.00 23.77 C ANISOU 3772 C ALA E 25 2917 3124 2992 290 1369 -225 C ATOM 3773 O ALA E 25 29.076 11.042 1.637 1.00 23.42 O ANISOU 3773 O ALA E 25 2800 3117 2979 -33 1327 -191 O ATOM 3774 CB ALA E 25 28.375 11.287 4.740 1.00 25.26 C ANISOU 3774 CB ALA E 25 3176 3193 3228 425 1249 -288 C ATOM 3775 H ALA E 25 26.516 9.736 4.662 1.00 24.45 H ATOM 3776 HA ALA E 25 27.178 11.747 3.131 1.00 27.20 H ATOM 3777 HB1 ALA E 25 29.086 11.880 4.486 1.00 30.31 H ATOM 3778 HB2 ALA E 25 27.798 11.720 5.373 1.00 30.31 H ATOM 3779 HB3 ALA E 25 28.738 10.485 5.123 1.00 30.31 H ATOM 3780 N LYS E 26 28.510 8.981 2.349 1.00 25.53 N ANISOU 3780 N LYS E 26 3185 3270 3247 540 1435 -118 N ATOM 3781 CA LYS E 26 29.299 8.297 1.320 1.00 29.69 C ANISOU 3781 CA LYS E 26 3764 3781 3738 616 1327 -76 C ATOM 3782 C LYS E 26 28.699 8.499 -0.077 1.00 25.61 C ANISOU 3782 C LYS E 26 3222 3297 3213 674 1233 79 C ATOM 3783 O LYS E 26 29.434 8.651 -1.059 1.00 24.19 O ANISOU 3783 O LYS E 26 2991 3139 3061 845 1202 148 O ATOM 3784 CB LYS E 26 29.402 6.793 1.621 1.00 31.71 C ANISOU 3784 CB LYS E 26 3998 3981 4069 485 1169 -79 C ATOM 3785 CG LYS E 26 30.216 6.002 0.605 1.00 41.66 C ANISOU 3785 CG LYS E 26 5288 5260 5281 307 1007 -64 C ATOM 3786 CD LYS E 26 31.640 6.518 0.500 0.00 46.99 C ANISOU 3786 CD LYS E 26 5945 5947 5961 131 914 -76 C ATOM 3787 CE LYS E 26 32.422 6.285 1.781 0.00 49.36 C ANISOU 3787 CE LYS E 26 6241 6240 6276 -4 853 -89 C ATOM 3788 NZ LYS E 26 33.829 6.758 1.659 0.00 51.23 N ANISOU 3788 NZ LYS E 26 6464 6451 6549 -78 779 -97 N ATOM 3789 H LYS E 26 28.099 8.452 2.888 1.00 30.64 H ATOM 3790 HA LYS E 26 30.207 8.667 1.316 1.00 35.63 H ATOM 3791 HB2 LYS E 26 29.822 6.678 2.488 1.00 38.05 H ATOM 3792 HB3 LYS E 26 28.508 6.418 1.638 1.00 38.05 H ATOM 3793 HG2 LYS E 26 30.250 5.072 0.878 1.00 49.99 H ATOM 3794 HG3 LYS E 26 29.800 6.080 -0.268 1.00 49.99 H ATOM 3795 HD2 LYS E 26 32.095 6.055 -0.221 0.00 56.38 H ATOM 3796 HD3 LYS E 26 31.621 7.472 0.326 0.00 56.38 H ATOM 3797 HE2 LYS E 26 32.000 6.772 2.506 0.00 59.24 H ATOM 3798 HE3 LYS E 26 32.438 5.336 1.978 0.00 59.24 H ATOM 3799 HZ1 LYS E 26 34.301 6.600 2.480 0.00 61.47 H ATOM 3800 HZ2 LYS E 26 34.273 6.289 0.949 0.00 61.47 H ATOM 3801 HZ3 LYS E 26 33.843 7.699 1.467 0.00 61.47 H ATOM 3802 N ALA E 27 27.369 8.479 -0.159 1.00 23.43 N ANISOU 3802 N ALA E 27 2997 2959 2945 440 1318 63 N ATOM 3803 CA ALA E 27 26.673 8.639 -1.428 1.00 19.63 C ANISOU 3803 CA ALA E 27 2513 2450 2494 341 1228 -15 C ATOM 3804 C ALA E 27 26.356 10.109 -1.733 1.00 19.71 C ANISOU 3804 C ALA E 27 2636 2445 2407 137 1216 -54 C ATOM 3805 O ALA E 27 26.038 10.454 -2.861 1.00 19.76 O ANISOU 3805 O ALA E 27 2750 2414 2343 -33 1205 -57 O ATOM 3806 CB ALA E 27 25.408 7.819 -1.442 1.00 19.61 C ANISOU 3806 CB ALA E 27 2489 2463 2500 434 1306 -39 C ATOM 3807 H ALA E 27 26.845 8.373 0.515 1.00 28.11 H ATOM 3808 HA ALA E 27 27.251 8.306 -2.146 1.00 23.55 H ATOM 3809 HB1 ALA E 27 24.967 7.940 -2.286 1.00 23.53 H ATOM 3810 HB2 ALA E 27 25.635 6.894 -1.321 1.00 23.53 H ATOM 3811 HB3 ALA E 27 24.837 8.113 -0.729 1.00 23.53 H ATOM 3812 N GLY E 28 26.445 10.977 -0.733 1.00 19.40 N ANISOU 3812 N GLY E 28 2525 2387 2458 58 1197 -4 N ATOM 3813 CA GLY E 28 26.137 12.378 -0.942 1.00 19.31 C ANISOU 3813 CA GLY E 28 2462 2386 2487 7 1297 123 C ATOM 3814 C GLY E 28 24.648 12.634 -1.083 1.00 20.03 C ANISOU 3814 C GLY E 28 2748 2297 2565 134 1400 250 C ATOM 3815 O GLY E 28 24.241 13.622 -1.692 1.00 20.01 O ANISOU 3815 O GLY E 28 2900 2124 2580 105 1601 430 O ATOM 3816 H GLY E 28 26.680 10.779 0.070 1.00 23.28 H ATOM 3817 HA2 GLY E 28 26.468 12.896 -0.192 1.00 23.17 H ATOM 3818 HA3 GLY E 28 26.579 12.689 -1.748 1.00 23.17 H ATOM 3819 N LEU E 29 23.822 11.760 -0.515 1.00 20.79 N ANISOU 3819 N LEU E 29 2739 2434 2727 87 1455 122 N ATOM 3820 CA LEU E 29 22.393 11.942 -0.655 1.00 26.08 C ANISOU 3820 CA LEU E 29 3388 3127 3393 -145 1439 70 C ATOM 3821 C LEU E 29 21.579 11.289 0.459 1.00 19.50 C ANISOU 3821 C LEU E 29 2692 2173 2545 -344 1382 -5 C ATOM 3822 O LEU E 29 22.036 10.387 1.156 1.00 17.34 O ANISOU 3822 O LEU E 29 2492 1799 2299 -217 1364 52 O ATOM 3823 CB LEU E 29 21.914 11.483 -2.038 1.00 43.66 C ANISOU 3823 CB LEU E 29 5540 5484 5563 -131 1296 46 C ATOM 3824 CG LEU E 29 21.828 9.991 -2.350 1.00 51.35 C ANISOU 3824 CG LEU E 29 6513 6489 6510 -95 1204 14 C ATOM 3825 CD1 LEU E 29 21.955 9.795 -3.850 1.00 48.34 C ANISOU 3825 CD1 LEU E 29 6083 6085 6200 -64 1209 13 C ATOM 3826 CD2 LEU E 29 22.901 9.223 -1.638 1.00 59.08 C ANISOU 3826 CD2 LEU E 29 7460 7438 7548 -124 1146 -14 C ATOM 3827 H LEU E 29 24.060 11.073 -0.056 1.00 24.95 H ATOM 3828 HA LEU E 29 22.213 12.904 -0.603 1.00 31.29 H ATOM 3829 HB2 LEU E 29 21.025 11.845 -2.174 1.00 52.39 H ATOM 3830 HB3 LEU E 29 22.512 11.869 -2.697 1.00 52.39 H ATOM 3831 HG LEU E 29 20.965 9.650 -2.067 1.00 61.62 H ATOM 3832 HD11 LEU E 29 21.901 8.857 -4.048 1.00 58.01 H ATOM 3833 HD12 LEU E 29 21.241 10.264 -4.288 1.00 58.01 H ATOM 3834 HD13 LEU E 29 22.802 10.142 -4.140 1.00 58.01 H ATOM 3835 HD21 LEU E 29 22.816 8.292 -1.858 1.00 70.89 H ATOM 3836 HD22 LEU E 29 23.758 9.549 -1.921 1.00 70.89 H ATOM 3837 HD23 LEU E 29 22.799 9.347 -0.692 1.00 70.89 H ATOM 3838 N CYS E 30 20.366 11.794 0.607 1.00 15.92 N ANISOU 3838 N CYS E 30 2174 1780 2097 -295 1306 72 N ATOM 3839 CA CYS E 30 19.406 11.269 1.567 1.00 15.03 C ANISOU 3839 CA CYS E 30 1987 1785 1941 -469 1221 -135 C ATOM 3840 C CYS E 30 18.779 9.985 1.018 1.00 17.41 C ANISOU 3840 C CYS E 30 2561 2007 2046 -771 1228 -64 C ATOM 3841 O CYS E 30 18.367 9.926 -0.142 1.00 18.89 O ANISOU 3841 O CYS E 30 3013 2090 2073 -845 1149 97 O ATOM 3842 CB CYS E 30 18.346 12.341 1.874 1.00 15.25 C ANISOU 3842 CB CYS E 30 2000 1799 1993 -335 1067 -238 C ATOM 3843 SG CYS E 30 19.012 13.751 2.845 1.00 16.51 S ANISOU 3843 SG CYS E 30 2134 1879 2259 -220 828 -209 S ATOM 3844 H CYS E 30 20.066 12.458 0.151 1.00 19.11 H ATOM 3845 HA CYS E 30 19.871 11.050 2.401 1.00 18.04 H ATOM 3846 HB2 CYS E 30 18.000 12.690 1.038 1.00 18.30 H ATOM 3847 HB3 CYS E 30 17.629 11.937 2.386 1.00 18.30 H ATOM 3848 N GLN E 31 18.738 8.951 1.854 1.00 17.96 N ANISOU 3848 N GLN E 31 2543 2052 2229 -911 1176 -89 N ATOM 3849 CA GLN E 31 18.228 7.639 1.478 1.00 19.35 C ANISOU 3849 CA GLN E 31 2559 2345 2449 -1047 1153 26 C ATOM 3850 C GLN E 31 17.279 7.140 2.548 1.00 17.59 C ANISOU 3850 C GLN E 31 2400 2069 2213 -1020 1025 38 C ATOM 3851 O GLN E 31 17.242 7.683 3.650 1.00 16.37 O ANISOU 3851 O GLN E 31 2360 1838 2020 -1059 916 -25 O ATOM 3852 CB GLN E 31 19.392 6.671 1.353 1.00 23.36 C ANISOU 3852 CB GLN E 31 2997 2891 2987 -969 1302 23 C ATOM 3853 CG GLN E 31 20.385 7.081 0.282 1.00 32.31 C ANISOU 3853 CG GLN E 31 4093 4088 4097 -901 1253 46 C ATOM 3854 CD GLN E 31 21.467 6.054 0.090 1.00 41.35 C ANISOU 3854 CD GLN E 31 5231 5352 5130 -782 1180 68 C ATOM 3855 OE1 GLN E 31 21.863 5.377 1.035 1.00 40.48 O ANISOU 3855 OE1 GLN E 31 5128 5310 4941 -726 1124 89 O ATOM 3856 NE2 GLN E 31 21.949 5.922 -1.142 1.00 51.75 N ANISOU 3856 NE2 GLN E 31 6534 6582 6546 -721 1176 64 N ATOM 3857 H GLN E 31 19.010 8.988 2.669 1.00 21.55 H ATOM 3858 HA GLN E 31 17.754 7.690 0.622 1.00 23.22 H ATOM 3859 HB2 GLN E 31 19.863 6.632 2.200 1.00 28.03 H ATOM 3860 HB3 GLN E 31 19.050 5.793 1.124 1.00 28.03 H ATOM 3861 HG2 GLN E 31 19.918 7.189 -0.561 1.00 38.78 H ATOM 3862 HG3 GLN E 31 20.805 7.917 0.540 1.00 38.78 H ATOM 3863 HE21 GLN E 31 22.569 5.348 -1.302 1.00 62.10 H ATOM 3864 HE22 GLN E 31 21.642 6.411 -1.779 1.00 62.10 H ATOM 3865 N THR E 32 16.508 6.106 2.238 1.00 17.41 N ANISOU 3865 N THR E 32 2341 2011 2262 -1149 1002 26 N ATOM 3866 CA THR E 32 15.542 5.593 3.202 1.00 20.22 C ANISOU 3866 CA THR E 32 2653 2446 2584 -981 920 -2 C ATOM 3867 C THR E 32 16.141 4.457 4.036 1.00 17.02 C ANISOU 3867 C THR E 32 2393 1935 2138 -741 1005 -25 C ATOM 3868 O THR E 32 17.094 3.790 3.609 1.00 16.82 O ANISOU 3868 O THR E 32 2544 1790 2056 -638 1142 -5 O ATOM 3869 CB THR E 32 14.267 5.074 2.503 1.00 28.55 C ANISOU 3869 CB THR E 32 3706 3524 3620 -1242 861 21 C ATOM 3870 OG1 THR E 32 14.631 4.071 1.551 1.00 29.64 O ANISOU 3870 OG1 THR E 32 3939 3616 3705 -1390 923 -36 O ATOM 3871 CG2 THR E 32 13.545 6.201 1.796 1.00 35.23 C ANISOU 3871 CG2 THR E 32 4458 4434 4493 -1371 738 59 C ATOM 3872 H THR E 32 16.522 5.688 1.487 1.00 20.89 H ATOM 3873 HA THR E 32 15.283 6.315 3.812 1.00 24.26 H ATOM 3874 HB THR E 32 13.668 4.692 3.163 1.00 34.26 H ATOM 3875 HG1 THR E 32 15.139 4.388 0.990 1.00 35.56 H ATOM 3876 HG21 THR E 32 12.755 5.866 1.366 1.00 42.27 H ATOM 3877 HG22 THR E 32 13.293 6.877 2.429 1.00 42.27 H ATOM 3878 HG23 THR E 32 14.119 6.593 1.133 1.00 42.27 H ATOM 3879 N PHE E 33 15.583 4.262 5.230 1.00 14.89 N ANISOU 3879 N PHE E 33 2076 1714 1868 -480 872 -113 N ATOM 3880 CA PHE E 33 15.917 3.120 6.083 1.00 12.82 C ANISOU 3880 CA PHE E 33 1787 1427 1657 -257 892 -143 C ATOM 3881 C PHE E 33 14.698 2.762 6.918 1.00 11.76 C ANISOU 3881 C PHE E 33 1731 1245 1493 -261 834 -186 C ATOM 3882 O PHE E 33 13.710 3.509 6.924 1.00 11.10 O ANISOU 3882 O PHE E 33 1770 1055 1393 -258 780 -110 O ATOM 3883 CB PHE E 33 17.158 3.405 6.954 1.00 12.88 C ANISOU 3883 CB PHE E 33 1720 1479 1694 7 807 -26 C ATOM 3884 CG PHE E 33 16.907 4.296 8.163 1.00 11.38 C ANISOU 3884 CG PHE E 33 1572 1271 1481 31 878 -29 C ATOM 3885 CD1 PHE E 33 16.839 3.740 9.447 1.00 10.32 C ANISOU 3885 CD1 PHE E 33 1390 1192 1339 -26 897 -89 C ATOM 3886 CD2 PHE E 33 16.793 5.676 8.037 1.00 10.64 C ANISOU 3886 CD2 PHE E 33 1488 1171 1384 15 897 14 C ATOM 3887 CE1 PHE E 33 16.629 4.531 10.574 1.00 11.07 C ANISOU 3887 CE1 PHE E 33 1492 1328 1388 -90 786 -36 C ATOM 3888 CE2 PHE E 33 16.585 6.480 9.178 1.00 10.12 C ANISOU 3888 CE2 PHE E 33 1477 1077 1289 42 1017 27 C ATOM 3889 CZ PHE E 33 16.495 5.891 10.448 1.00 9.95 C ANISOU 3889 CZ PHE E 33 1391 1124 1267 69 827 -91 C ATOM 3890 H PHE E 33 14.996 4.788 5.575 1.00 17.87 H ATOM 3891 HA PHE E 33 16.124 2.351 5.512 1.00 15.39 H ATOM 3892 HB2 PHE E 33 17.506 2.561 7.281 1.00 15.45 H ATOM 3893 HB3 PHE E 33 17.828 3.842 6.404 1.00 15.45 H ATOM 3894 HD1 PHE E 33 16.921 2.819 9.547 1.00 12.38 H ATOM 3895 HD2 PHE E 33 16.846 6.071 7.196 1.00 12.77 H ATOM 3896 HE1 PHE E 33 16.573 4.135 11.414 1.00 13.29 H ATOM 3897 HE2 PHE E 33 16.494 7.400 9.086 1.00 12.14 H ATOM 3898 HZ PHE E 33 16.358 6.421 11.201 1.00 11.94 H ATOM 3899 N VAL E 34 14.751 1.602 7.577 1.00 11.50 N ANISOU 3899 N VAL E 34 1625 1280 1463 -240 843 -121 N ATOM 3900 CA VAL E 34 13.661 1.124 8.424 1.00 11.01 C ANISOU 3900 CA VAL E 34 1525 1216 1441 -241 606 -96 C ATOM 3901 C VAL E 34 13.949 1.485 9.873 1.00 10.13 C ANISOU 3901 C VAL E 34 1405 1153 1290 -26 478 2 C ATOM 3902 O VAL E 34 14.891 0.974 10.490 1.00 11.11 O ANISOU 3902 O VAL E 34 1662 1182 1377 242 466 17 O ATOM 3903 CB VAL E 34 13.467 -0.416 8.287 1.00 11.76 C ANISOU 3903 CB VAL E 34 1588 1332 1550 -290 667 -176 C ATOM 3904 CG1 VAL E 34 12.360 -0.910 9.199 1.00 11.66 C ANISOU 3904 CG1 VAL E 34 1526 1391 1515 -246 671 -90 C ATOM 3905 CG2 VAL E 34 13.162 -0.791 6.836 1.00 14.22 C ANISOU 3905 CG2 VAL E 34 1824 1729 1848 -405 715 -299 C ATOM 3906 H VAL E 34 15.423 1.065 7.546 1.00 13.80 H ATOM 3907 HA VAL E 34 12.827 1.564 8.157 1.00 13.21 H ATOM 3908 HB VAL E 34 14.297 -0.867 8.548 1.00 14.12 H ATOM 3909 HG11 VAL E 34 12.266 -1.859 9.090 1.00 14.00 H ATOM 3910 HG12 VAL E 34 12.589 -0.705 10.108 1.00 14.00 H ATOM 3911 HG13 VAL E 34 11.540 -0.470 8.961 1.00 14.00 H ATOM 3912 HG21 VAL E 34 13.046 -1.742 6.777 1.00 17.06 H ATOM 3913 HG22 VAL E 34 12.357 -0.346 6.561 1.00 17.06 H ATOM 3914 HG23 VAL E 34 13.895 -0.515 6.282 1.00 17.06 H ATOM 3915 N TYR E 35 13.147 2.402 10.395 1.00 8.88 N ANISOU 3915 N TYR E 35 1244 998 1132 -8 345 -27 N ATOM 3916 CA TYR E 35 13.224 2.835 11.791 1.00 8.54 C ANISOU 3916 CA TYR E 35 1141 1062 1042 38 184 -82 C ATOM 3917 C TYR E 35 12.275 2.017 12.667 1.00 7.15 C ANISOU 3917 C TYR E 35 1028 777 914 59 54 17 C ATOM 3918 O TYR E 35 11.130 1.792 12.297 1.00 7.19 O ANISOU 3918 O TYR E 35 1059 826 847 70 -13 179 O ATOM 3919 CB TYR E 35 12.895 4.334 11.859 1.00 7.64 C ANISOU 3919 CB TYR E 35 960 936 1006 129 264 -42 C ATOM 3920 CG TYR E 35 12.760 4.933 13.251 1.00 7.62 C ANISOU 3920 CG TYR E 35 967 893 1033 107 321 -65 C ATOM 3921 CD1 TYR E 35 13.765 4.787 14.203 1.00 7.99 C ANISOU 3921 CD1 TYR E 35 1015 931 1089 -75 490 7 C ATOM 3922 CD2 TYR E 35 11.637 5.677 13.594 1.00 8.91 C ANISOU 3922 CD2 TYR E 35 1212 991 1182 191 308 56 C ATOM 3923 CE1 TYR E 35 13.653 5.335 15.480 1.00 7.17 C ANISOU 3923 CE1 TYR E 35 965 800 959 -223 494 -51 C ATOM 3924 CE2 TYR E 35 11.503 6.251 14.869 1.00 8.19 C ANISOU 3924 CE2 TYR E 35 1124 876 1113 82 443 10 C ATOM 3925 CZ TYR E 35 12.512 6.075 15.814 1.00 7.97 C ANISOU 3925 CZ TYR E 35 1172 822 1034 -105 505 7 C ATOM 3926 OH TYR E 35 12.378 6.647 17.070 1.00 9.17 O ANISOU 3926 OH TYR E 35 1423 937 1124 -282 370 -28 O ATOM 3927 H TYR E 35 12.531 2.803 9.949 1.00 10.65 H ATOM 3928 HA TYR E 35 14.137 2.704 12.121 1.00 10.25 H ATOM 3929 HB2 TYR E 35 13.600 4.820 11.403 1.00 9.17 H ATOM 3930 HB3 TYR E 35 12.054 4.482 11.399 1.00 9.17 H ATOM 3931 HD1 TYR E 35 14.522 4.292 13.988 1.00 9.58 H ATOM 3932 HD2 TYR E 35 10.959 5.795 12.968 1.00 10.69 H ATOM 3933 HE1 TYR E 35 14.335 5.219 16.102 1.00 8.60 H ATOM 3934 HE2 TYR E 35 10.741 6.739 15.084 1.00 9.83 H ATOM 3935 HH TYR E 35 11.712 6.350 17.444 1.00 11.00 H ATOM 3936 N GLY E 36 12.759 1.587 13.835 1.00 6.69 N ANISOU 3936 N GLY E 36 931 784 826 24 110 106 N ATOM 3937 CA GLY E 36 12.010 0.706 14.725 1.00 6.97 C ANISOU 3937 CA GLY E 36 883 848 916 267 -42 103 C ATOM 3938 C GLY E 36 10.875 1.360 15.484 1.00 6.15 C ANISOU 3938 C GLY E 36 835 690 811 47 -74 15 C ATOM 3939 O GLY E 36 10.030 0.677 16.046 1.00 7.18 O ANISOU 3939 O GLY E 36 1131 818 780 53 -69 42 O ATOM 3940 H GLY E 36 13.536 1.798 14.138 1.00 8.02 H ATOM 3941 HA2 GLY E 36 11.636 -0.021 14.202 1.00 8.36 H ATOM 3942 HA3 GLY E 36 12.620 0.324 15.374 1.00 8.36 H ATOM 3943 N GLY E 37 10.855 2.690 15.526 1.00 6.68 N ANISOU 3943 N GLY E 37 886 700 953 136 3 98 N ATOM 3944 CA GLY E 37 9.772 3.408 16.184 1.00 7.41 C ANISOU 3944 CA GLY E 37 930 900 985 80 81 -155 C ATOM 3945 C GLY E 37 10.067 4.096 17.521 1.00 8.05 C ANISOU 3945 C GLY E 37 1033 998 1026 81 66 -201 C ATOM 3946 O GLY E 37 9.192 4.814 18.034 1.00 9.24 O ANISOU 3946 O GLY E 37 1196 1253 1060 223 91 -202 O ATOM 3947 H GLY E 37 11.457 3.197 15.180 1.00 8.02 H ATOM 3948 HA2 GLY E 37 9.449 4.091 15.575 1.00 8.89 H ATOM 3949 HA3 GLY E 37 9.044 2.786 16.335 1.00 8.89 H ATOM 3950 N CYS E 38 11.253 3.875 18.096 1.00 7.21 N ANISOU 3950 N CYS E 38 933 819 988 -126 -59 -64 N ATOM 3951 CA CYS E 38 11.676 4.611 19.297 1.00 8.19 C ANISOU 3951 CA CYS E 38 1083 909 1119 -68 66 19 C ATOM 3952 C CYS E 38 13.184 4.881 19.351 1.00 8.33 C ANISOU 3952 C CYS E 38 1183 877 1105 -126 200 -61 C ATOM 3953 O CYS E 38 13.984 4.240 18.660 1.00 7.96 O ANISOU 3953 O CYS E 38 1018 957 1049 -83 167 -53 O ATOM 3954 CB CYS E 38 11.274 3.842 20.567 1.00 9.24 C ANISOU 3954 CB CYS E 38 1207 1116 1188 -99 113 -81 C ATOM 3955 SG CYS E 38 12.186 2.281 20.822 1.00 8.87 S ANISOU 3955 SG CYS E 38 1310 949 1110 -193 148 -163 S ATOM 3956 H CYS E 38 11.832 3.305 17.812 1.00 8.65 H ATOM 3957 HA CYS E 38 11.217 5.477 19.313 1.00 9.82 H ATOM 3958 HB2 CYS E 38 11.436 4.407 21.338 1.00 11.09 H ATOM 3959 HB3 CYS E 38 10.329 3.626 20.514 1.00 11.09 H ATOM 3960 N ARG E 39 13.555 5.847 20.189 1.00 10.04 N ANISOU 3960 N ARG E 39 1409 1114 1293 -100 385 -161 N ATOM 3961 CA ARG E 39 14.945 6.130 20.553 1.00 9.82 C ANISOU 3961 CA ARG E 39 1241 1185 1306 -197 360 -344 C ATOM 3962 C ARG E 39 15.773 6.594 19.336 1.00 10.68 C ANISOU 3962 C ARG E 39 1391 1397 1271 -224 307 -260 C ATOM 3963 O ARG E 39 16.972 6.329 19.226 1.00 11.24 O ANISOU 3963 O ARG E 39 1453 1657 1159 93 201 -174 O ATOM 3964 CB ARG E 39 15.578 4.927 21.258 1.00 13.09 C ANISOU 3964 CB ARG E 39 1638 1618 1718 -243 264 -490 C ATOM 3965 CG ARG E 39 14.785 4.444 22.468 1.00 18.54 C ANISOU 3965 CG ARG E 39 2320 2304 2420 -178 -4 -480 C ATOM 3966 CD ARG E 39 15.231 5.122 23.719 1.00 29.79 C ANISOU 3966 CD ARG E 39 3749 3769 3802 -184 -85 -439 C ATOM 3967 NE ARG E 39 16.543 4.633 24.133 1.00 35.65 N ANISOU 3967 NE ARG E 39 4481 4539 4525 -220 -201 -418 N ATOM 3968 CZ ARG E 39 17.298 5.234 25.041 1.00 37.74 C ANISOU 3968 CZ ARG E 39 4769 4789 4782 -254 -309 -420 C ATOM 3969 NH1 ARG E 39 16.861 6.337 25.622 1.00 37.04 N ANISOU 3969 NH1 ARG E 39 4681 4650 4743 -343 -363 -459 N ATOM 3970 NH2 ARG E 39 18.479 4.733 25.365 1.00 41.52 N ANISOU 3970 NH2 ARG E 39 5209 5263 5305 -222 -325 -443 N ATOM 3971 H ARG E 39 12.996 6.374 20.575 1.00 12.05 H ATOM 3972 HA ARG E 39 14.944 6.870 21.196 1.00 11.79 H ATOM 3973 HB2 ARG E 39 15.638 4.191 20.629 1.00 15.71 H ATOM 3974 HB3 ARG E 39 16.465 5.173 21.563 1.00 15.71 H ATOM 3975 HG2 ARG E 39 13.844 4.641 22.334 1.00 22.24 H ATOM 3976 HG3 ARG E 39 14.915 3.489 22.577 1.00 22.24 H ATOM 3977 HD2 ARG E 39 15.296 6.077 23.562 1.00 35.75 H ATOM 3978 HD3 ARG E 39 14.597 4.938 24.429 1.00 35.75 H ATOM 3979 HE ARG E 39 16.821 3.758 23.819 1.00 42.78 H ATOM 3980 HH11 ARG E 39 16.093 6.660 25.409 1.00 44.45 H ATOM 3981 HH12 ARG E 39 17.345 6.732 26.213 1.00 44.45 H ATOM 3982 HH21 ARG E 39 18.760 4.015 24.986 1.00 49.83 H ATOM 3983 HH22 ARG E 39 18.965 5.126 25.956 1.00 49.83 H ATOM 3984 N ALA E 40 15.121 7.298 18.426 1.00 11.46 N ANISOU 3984 N ALA E 40 1531 1352 1471 -392 378 -257 N ATOM 3985 CA ALA E 40 15.797 7.838 17.241 1.00 11.89 C ANISOU 3985 CA ALA E 40 1500 1471 1548 -627 387 -193 C ATOM 3986 C ALA E 40 17.045 8.637 17.599 1.00 11.38 C ANISOU 3986 C ALA E 40 1578 1270 1477 -595 318 -149 C ATOM 3987 O ALA E 40 17.055 9.387 18.583 1.00 12.97 O ANISOU 3987 O ALA E 40 1831 1466 1629 -634 418 -161 O ATOM 3988 CB ALA E 40 14.853 8.717 16.451 1.00 13.62 C ANISOU 3988 CB ALA E 40 1739 1699 1738 -719 439 -199 C ATOM 3989 H ALA E 40 14.282 7.482 18.465 1.00 13.75 H ATOM 3990 HA ALA E 40 16.071 7.094 16.665 1.00 14.27 H ATOM 3991 HB1 ALA E 40 15.315 9.059 15.682 1.00 16.35 H ATOM 3992 HB2 ALA E 40 14.098 8.193 16.174 1.00 16.35 H ATOM 3993 HB3 ALA E 40 14.562 9.442 17.008 1.00 16.35 H ATOM 3994 N LYS E 41 18.084 8.476 16.781 1.00 9.95 N ANISOU 3994 N LYS E 41 1289 1128 1363 -587 218 -142 N ATOM 3995 CA LYS E 41 19.208 9.401 16.764 1.00 11.36 C ANISOU 3995 CA LYS E 41 1444 1328 1543 -407 195 7 C ATOM 3996 C LYS E 41 18.869 10.552 15.818 1.00 11.42 C ANISOU 3996 C LYS E 41 1458 1308 1573 -295 341 -15 C ATOM 3997 O LYS E 41 17.793 10.574 15.222 1.00 11.52 O ANISOU 3997 O LYS E 41 1573 1239 1566 -416 408 -180 O ATOM 3998 CB LYS E 41 20.503 8.695 16.345 1.00 14.90 C ANISOU 3998 CB LYS E 41 1863 1860 1939 -511 104 -3 C ATOM 3999 CG LYS E 41 20.985 7.690 17.404 1.00 19.96 C ANISOU 3999 CG LYS E 41 2510 2466 2608 -611 43 82 C ATOM 4000 CD LYS E 41 22.284 7.004 17.018 1.00 28.72 C ANISOU 4000 CD LYS E 41 3618 3587 3707 -657 4 108 C ATOM 4001 CE LYS E 41 22.794 6.171 18.182 1.00 43.32 C ANISOU 4001 CE LYS E 41 5455 5462 5541 -675 -13 104 C ATOM 4002 NZ LYS E 41 24.004 5.378 17.838 1.00 61.33 N ANISOU 4002 NZ LYS E 41 7745 7747 7811 -657 -45 87 N ATOM 4003 H LYS E 41 18.159 7.830 16.219 1.00 11.94 H ATOM 4004 HA LYS E 41 19.337 9.770 17.663 1.00 13.63 H ATOM 4005 HB2 LYS E 41 20.348 8.212 15.518 1.00 17.88 H ATOM 4006 HB3 LYS E 41 21.200 9.358 16.218 1.00 17.88 H ATOM 4007 HG2 LYS E 41 21.132 8.159 18.240 1.00 23.95 H ATOM 4008 HG3 LYS E 41 20.308 7.006 17.521 1.00 23.95 H ATOM 4009 HD2 LYS E 41 22.128 6.416 16.262 1.00 34.46 H ATOM 4010 HD3 LYS E 41 22.952 7.672 16.799 1.00 34.46 H ATOM 4011 HE2 LYS E 41 23.022 6.762 18.917 1.00 51.98 H ATOM 4012 HE3 LYS E 41 22.098 5.553 18.457 1.00 51.98 H ATOM 4013 HZ1 LYS E 41 24.290 4.869 18.601 1.00 73.59 H ATOM 4014 HZ2 LYS E 41 23.807 4.775 17.117 1.00 73.59 H ATOM 4015 HZ3 LYS E 41 24.715 5.964 17.569 1.00 73.59 H ATOM 4016 N ARG E 42 19.773 11.515 15.692 1.00 11.33 N ANISOU 4016 N ARG E 42 1446 1274 1587 -284 506 -17 N ATOM 4017 CA ARG E 42 19.445 12.753 14.978 1.00 12.50 C ANISOU 4017 CA ARG E 42 1559 1530 1660 -428 568 -99 C ATOM 4018 C ARG E 42 19.414 12.637 13.442 1.00 11.02 C ANISOU 4018 C ARG E 42 1344 1340 1503 -373 414 36 C ATOM 4019 O ARG E 42 18.713 13.416 12.788 1.00 10.35 O ANISOU 4019 O ARG E 42 1205 1312 1416 -189 413 78 O ATOM 4020 CB ARG E 42 20.380 13.884 15.424 1.00 14.11 C ANISOU 4020 CB ARG E 42 1756 1739 1866 -859 484 -398 C ATOM 4021 CG ARG E 42 20.071 14.409 16.844 1.00 20.23 C ANISOU 4021 CG ARG E 42 2550 2487 2651 -1019 327 -452 C ATOM 4022 CD ARG E 42 21.234 15.219 17.406 1.00 35.50 C ANISOU 4022 CD ARG E 42 4518 4390 4579 -961 359 -363 C ATOM 4023 NE ARG E 42 21.028 16.660 17.291 1.00 56.14 N ANISOU 4023 NE ARG E 42 7171 7088 7072 -856 450 -298 N ATOM 4024 CZ ARG E 42 21.970 17.570 17.532 1.00 53.41 C ANISOU 4024 CZ ARG E 42 6812 6741 6742 -684 464 -250 C ATOM 4025 NH1 ARG E 42 23.194 17.193 17.892 1.00 56.48 N ANISOU 4025 NH1 ARG E 42 7141 7113 7207 -639 424 -237 N ATOM 4026 NH2 ARG E 42 21.689 18.859 17.405 1.00 48.30 N ANISOU 4026 NH2 ARG E 42 6129 6043 6182 -586 527 -232 N ATOM 4027 H ARG E 42 20.574 11.483 16.005 1.00 13.60 H ATOM 4028 HA ARG E 42 18.542 13.016 15.252 1.00 15.00 H ATOM 4029 HB2 ARG E 42 21.294 13.558 15.419 1.00 16.93 H ATOM 4030 HB3 ARG E 42 20.292 14.627 14.806 1.00 16.93 H ATOM 4031 HG2 ARG E 42 19.290 14.983 16.810 1.00 24.28 H ATOM 4032 HG3 ARG E 42 19.911 13.657 17.435 1.00 24.28 H ATOM 4033 HD2 ARG E 42 21.342 15.006 18.346 1.00 42.60 H ATOM 4034 HD3 ARG E 42 22.042 14.992 16.919 1.00 42.60 H ATOM 4035 HE ARG E 42 20.135 16.975 17.082 1.00 67.37 H ATOM 4036 HH11 ARG E 42 23.379 16.357 17.976 1.00 67.78 H ATOM 4037 HH12 ARG E 42 23.799 17.785 18.044 1.00 67.78 H ATOM 4038 HH21 ARG E 42 20.899 19.105 17.170 1.00 57.96 H ATOM 4039 HH22 ARG E 42 22.296 19.448 17.556 1.00 57.96 H ATOM 4040 N ASN E 43 20.148 11.677 12.869 1.00 10.19 N ANISOU 4040 N ASN E 43 1236 1225 1410 -296 283 71 N ATOM 4041 CA ASN E 43 20.152 11.476 11.421 1.00 11.94 C ANISOU 4041 CA ASN E 43 1501 1440 1596 -13 337 174 C ATOM 4042 C ASN E 43 18.964 10.585 11.039 1.00 10.39 C ANISOU 4042 C ASN E 43 1450 1146 1352 -86 385 247 C ATOM 4043 O ASN E 43 19.123 9.415 10.659 1.00 9.92 O ANISOU 4043 O ASN E 43 1508 958 1304 198 476 93 O ATOM 4044 CB ASN E 43 21.480 10.846 10.982 1.00 12.33 C ANISOU 4044 CB ASN E 43 1511 1557 1617 -3 364 207 C ATOM 4045 CG ASN E 43 21.711 10.932 9.483 1.00 11.47 C ANISOU 4045 CG ASN E 43 1455 1363 1540 -117 289 379 C ATOM 4046 OD1 ASN E 43 20.966 11.587 8.760 1.00 10.15 O ANISOU 4046 OD1 ASN E 43 1266 1126 1464 -144 412 354 O ATOM 4047 ND2 ASN E 43 22.762 10.276 9.019 1.00 13.11 N ANISOU 4047 ND2 ASN E 43 1727 1583 1670 -10 320 409 N ATOM 4048 H ASN E 43 20.653 11.131 13.300 1.00 12.23 H ATOM 4049 HA ASN E 43 20.052 12.340 10.969 1.00 14.33 H ATOM 4050 HB2 ASN E 43 22.209 11.308 11.424 1.00 14.79 H ATOM 4051 HB3 ASN E 43 21.482 9.909 11.232 1.00 14.79 H ATOM 4052 HD21 ASN E 43 22.966 10.292 8.061 1.00 15.73 H ATOM 4053 HD22 ASN E 43 23.337 9.775 9.634 1.00 15.73 H ATOM 4054 N ASN E 44 17.773 11.164 11.152 1.00 10.58 N ANISOU 4054 N ASN E 44 1382 1276 1363 -107 351 235 N ATOM 4055 CA ASN E 44 16.496 10.448 11.049 1.00 9.84 C ANISOU 4055 CA ASN E 44 1283 1179 1278 -188 330 275 C ATOM 4056 C ASN E 44 15.433 11.521 10.789 1.00 9.66 C ANISOU 4056 C ASN E 44 1328 1133 1211 69 391 192 C ATOM 4057 O ASN E 44 15.147 12.347 11.668 1.00 10.11 O ANISOU 4057 O ASN E 44 1412 1227 1200 188 358 80 O ATOM 4058 CB ASN E 44 16.198 9.671 12.355 1.00 10.56 C ANISOU 4058 CB ASN E 44 1383 1271 1359 -194 194 357 C ATOM 4059 CG ASN E 44 14.841 8.935 12.337 1.00 9.35 C ANISOU 4059 CG ASN E 44 1266 1099 1186 -195 162 360 C ATOM 4060 OD1 ASN E 44 13.882 9.357 11.681 1.00 9.41 O ANISOU 4060 OD1 ASN E 44 1405 1057 1112 -243 255 458 O ATOM 4061 ND2 ASN E 44 14.756 7.842 13.098 1.00 9.50 N ANISOU 4061 ND2 ASN E 44 1224 1143 1241 -4 105 180 N ATOM 4062 H ASN E 44 17.672 12.006 11.295 1.00 12.70 H ATOM 4063 HA ASN E 44 16.516 9.821 10.296 1.00 11.81 H ATOM 4064 HB2 ASN E 44 16.893 9.009 12.491 1.00 12.67 H ATOM 4065 HB3 ASN E 44 16.187 10.296 13.096 1.00 12.67 H ATOM 4066 HD21 ASN E 44 13.920 7.331 13.130 1.00 11.40 H ATOM 4067 HD22 ASN E 44 15.529 7.551 13.625 1.00 11.40 H ATOM 4068 N PHE E 45 14.879 11.518 9.578 1.00 9.25 N ANISOU 4068 N PHE E 45 1240 1018 1257 -20 384 75 N ATOM 4069 CA PHE E 45 13.982 12.564 9.099 1.00 10.07 C ANISOU 4069 CA PHE E 45 1284 1215 1326 -37 357 160 C ATOM 4070 C PHE E 45 12.719 11.938 8.535 1.00 11.15 C ANISOU 4070 C PHE E 45 1462 1320 1454 -56 462 249 C ATOM 4071 O PHE E 45 12.754 10.828 7.998 1.00 10.70 O ANISOU 4071 O PHE E 45 1440 1175 1450 -56 569 209 O ATOM 4072 CB PHE E 45 14.663 13.370 7.983 1.00 11.52 C ANISOU 4072 CB PHE E 45 1492 1400 1485 152 299 186 C ATOM 4073 CG PHE E 45 15.953 14.025 8.396 1.00 11.31 C ANISOU 4073 CG PHE E 45 1426 1371 1501 103 259 207 C ATOM 4074 CD1 PHE E 45 17.170 13.362 8.264 1.00 11.49 C ANISOU 4074 CD1 PHE E 45 1497 1326 1541 176 296 255 C ATOM 4075 CD2 PHE E 45 15.946 15.309 8.932 1.00 11.45 C ANISOU 4075 CD2 PHE E 45 1437 1346 1566 -16 172 197 C ATOM 4076 CE1 PHE E 45 18.365 13.969 8.664 1.00 12.07 C ANISOU 4076 CE1 PHE E 45 1605 1393 1590 83 232 246 C ATOM 4077 CE2 PHE E 45 17.119 15.917 9.335 1.00 12.74 C ANISOU 4077 CE2 PHE E 45 1625 1533 1681 -99 103 255 C ATOM 4078 CZ PHE E 45 18.335 15.255 9.187 1.00 12.63 C ANISOU 4078 CZ PHE E 45 1625 1531 1643 -118 113 212 C ATOM 4079 H PHE E 45 15.013 10.898 8.997 1.00 11.10 H ATOM 4080 HA PHE E 45 13.743 13.168 9.833 1.00 12.08 H ATOM 4081 HB2 PHE E 45 14.858 12.774 7.243 1.00 13.82 H ATOM 4082 HB3 PHE E 45 14.058 14.069 7.689 1.00 13.82 H ATOM 4083 HD1 PHE E 45 17.189 12.503 7.910 1.00 13.78 H ATOM 4084 HD2 PHE E 45 15.139 15.760 9.031 1.00 13.73 H ATOM 4085 HE1 PHE E 45 19.174 13.521 8.566 1.00 14.49 H ATOM 4086 HE2 PHE E 45 17.098 16.779 9.684 1.00 15.28 H ATOM 4087 HZ PHE E 45 19.125 15.666 9.456 1.00 15.16 H ATOM 4088 N LYS E 46 11.612 12.674 8.626 1.00 12.02 N ANISOU 4088 N LYS E 46 1506 1461 1600 -137 373 316 N ATOM 4089 CA LYS E 46 10.316 12.171 8.190 1.00 12.27 C ANISOU 4089 CA LYS E 46 1583 1464 1614 -227 268 267 C ATOM 4090 C LYS E 46 10.081 12.368 6.690 1.00 13.28 C ANISOU 4090 C LYS E 46 1737 1667 1643 -471 163 214 C ATOM 4091 O LYS E 46 9.155 11.773 6.110 1.00 14.92 O ANISOU 4091 O LYS E 46 1992 2001 1677 -659 163 329 O ATOM 4092 CB LYS E 46 9.196 12.822 9.007 1.00 14.37 C ANISOU 4092 CB LYS E 46 1851 1707 1902 -122 365 361 C ATOM 4093 CG LYS E 46 9.148 12.320 10.459 1.00 16.15 C ANISOU 4093 CG LYS E 46 2021 2023 2093 29 563 387 C ATOM 4094 CD LYS E 46 8.033 12.954 11.275 1.00 17.85 C ANISOU 4094 CD LYS E 46 2257 2216 2310 87 702 552 C ATOM 4095 CE LYS E 46 8.204 12.625 12.745 1.00 23.69 C ANISOU 4095 CE LYS E 46 3014 2954 3035 228 758 724 C ATOM 4096 NZ LYS E 46 7.043 13.062 13.573 1.00 28.17 N ANISOU 4096 NZ LYS E 46 3568 3521 3615 200 811 871 N ATOM 4097 H LYS E 46 11.588 13.474 8.940 1.00 14.42 H ATOM 4098 HA LYS E 46 10.284 11.208 8.366 1.00 14.72 H ATOM 4099 HB2 LYS E 46 9.335 13.782 9.026 1.00 17.24 H ATOM 4100 HB3 LYS E 46 8.343 12.619 8.592 1.00 17.24 H ATOM 4101 HG2 LYS E 46 9.007 11.361 10.456 1.00 19.38 H ATOM 4102 HG3 LYS E 46 9.991 12.529 10.892 1.00 19.38 H ATOM 4103 HD2 LYS E 46 8.062 13.918 11.170 1.00 21.42 H ATOM 4104 HD3 LYS E 46 7.177 12.606 10.980 1.00 21.42 H ATOM 4105 HE2 LYS E 46 8.299 11.665 12.845 1.00 28.43 H ATOM 4106 HE3 LYS E 46 8.996 13.074 13.079 1.00 28.43 H ATOM 4107 HZ1 LYS E 46 7.193 12.835 14.493 1.00 33.81 H ATOM 4108 HZ2 LYS E 46 6.929 14.013 13.501 1.00 33.81 H ATOM 4109 HZ3 LYS E 46 6.243 12.627 13.270 1.00 33.81 H ATOM 4110 N SER E 47 10.912 13.185 6.056 1.00 13.90 N ANISOU 4110 N SER E 47 1784 1742 1755 -533 42 88 N ATOM 4111 CA SER E 47 10.828 13.363 4.603 1.00 15.52 C ANISOU 4111 CA SER E 47 2007 1956 1932 -561 116 -9 C ATOM 4112 C SER E 47 12.202 13.591 3.980 1.00 15.62 C ANISOU 4112 C SER E 47 2116 1923 1893 -628 167 -162 C ATOM 4113 O SER E 47 13.152 13.969 4.657 1.00 14.22 O ANISOU 4113 O SER E 47 2089 1688 1624 -573 171 -234 O ATOM 4114 CB SER E 47 9.919 14.545 4.262 1.00 15.68 C ANISOU 4114 CB SER E 47 2049 1926 1981 -459 209 156 C ATOM 4115 OG SER E 47 10.591 15.765 4.550 1.00 18.29 O ANISOU 4115 OG SER E 47 2379 2279 2290 -357 202 263 O ATOM 4116 H SER E 47 11.530 13.647 6.436 1.00 16.68 H ATOM 4117 HA SER E 47 10.442 12.556 4.203 1.00 18.62 H ATOM 4118 HB2 SER E 47 9.700 14.517 3.317 1.00 18.81 H ATOM 4119 HB3 SER E 47 9.111 14.491 4.796 1.00 18.81 H ATOM 4120 HG SER E 47 10.106 16.401 4.368 1.00 21.94 H ATOM 4121 N ALA E 48 12.314 13.355 2.678 1.00 17.67 N ANISOU 4121 N ALA E 48 2359 2208 2148 -602 117 -311 N ATOM 4122 CA ALA E 48 13.559 13.637 1.980 1.00 18.89 C ANISOU 4122 CA ALA E 48 2499 2404 2275 -342 303 -366 C ATOM 4123 C ALA E 48 13.888 15.126 2.040 1.00 17.15 C ANISOU 4123 C ALA E 48 2368 2225 1925 -206 513 -65 C ATOM 4124 O ALA E 48 15.043 15.496 2.178 1.00 16.17 O ANISOU 4124 O ALA E 48 2308 2158 1677 -189 589 7 O ATOM 4125 CB ALA E 48 13.481 13.166 0.520 1.00 20.38 C ANISOU 4125 CB ALA E 48 2620 2586 2539 -265 444 -433 C ATOM 4126 H ALA E 48 11.690 13.035 2.181 1.00 21.20 H ATOM 4127 HA ALA E 48 14.288 13.148 2.417 1.00 22.67 H ATOM 4128 HB1 ALA E 48 14.313 13.363 0.083 1.00 24.46 H ATOM 4129 HB2 ALA E 48 13.320 12.219 0.506 1.00 24.46 H ATOM 4130 HB3 ALA E 48 12.763 13.627 0.081 1.00 24.46 H ATOM 4131 N GLU E 49 12.866 15.973 1.956 1.00 17.75 N ANISOU 4131 N GLU E 49 2424 2234 2087 -57 670 3 N ATOM 4132 CA AGLU E 49 13.074 17.417 1.994 0.54 18.71 C ANISOU 4132 CA AGLU E 49 2442 2359 2306 80 625 93 C ATOM 4133 CA BGLU E 49 13.041 17.421 2.009 0.46 17.84 C ANISOU 4133 CA BGLU E 49 2461 2322 1997 96 683 42 C ATOM 4134 C GLU E 49 13.651 17.868 3.338 1.00 16.02 C ANISOU 4134 C GLU E 49 2110 1972 2006 102 535 60 C ATOM 4135 O GLU E 49 14.517 18.727 3.372 1.00 14.83 O ANISOU 4135 O GLU E 49 1875 1805 1954 131 432 318 O ATOM 4136 CB AGLU E 49 11.768 18.157 1.703 0.54 21.97 C ANISOU 4136 CB AGLU E 49 2790 2778 2780 186 599 183 C ATOM 4137 CB BGLU E 49 11.692 18.107 1.787 0.46 19.67 C ANISOU 4137 CB BGLU E 49 2766 2659 2050 236 737 32 C ATOM 4138 CG AGLU E 49 11.883 19.665 1.818 0.54 22.65 C ANISOU 4138 CG AGLU E 49 2851 2861 2893 209 613 230 C ATOM 4139 CG BGLU E 49 11.535 19.444 2.480 0.46 21.73 C ANISOU 4139 CG BGLU E 49 3139 2945 2172 290 790 -23 C ATOM 4140 CD AGLU E 49 10.670 20.395 1.256 0.54 21.49 C ANISOU 4140 CD AGLU E 49 2633 2736 2796 264 620 251 C ATOM 4141 CD BGLU E 49 10.102 19.701 2.920 0.46 23.34 C ANISOU 4141 CD BGLU E 49 3473 3173 2224 325 801 -117 C ATOM 4142 OE1AGLU E 49 9.808 19.741 0.637 0.54 22.05 O ANISOU 4142 OE1AGLU E 49 2667 2859 2851 364 737 265 O ATOM 4143 OE1BGLU E 49 9.217 19.853 2.048 0.46 24.37 O ANISOU 4143 OE1BGLU E 49 3668 3297 2296 327 823 -251 O ATOM 4144 OE2AGLU E 49 10.580 21.624 1.430 0.54 20.17 O ANISOU 4144 OE2AGLU E 49 2465 2448 2750 317 478 310 O ATOM 4145 OE2BGLU E 49 9.862 19.752 4.143 0.46 23.26 O ANISOU 4145 OE2BGLU E 49 3489 3089 2258 297 874 -175 O ATOM 4146 H AGLU E 49 12.042 15.737 1.877 1.00 21.30 H ATOM 4147 HA AGLU E 49 13.718 17.660 1.296 0.54 22.45 H ATOM 4148 HB2AGLU E 49 11.485 17.949 0.799 0.54 26.37 H ATOM 4149 HB3AGLU E 49 11.094 17.862 2.335 0.54 26.37 H ATOM 4150 HG2AGLU E 49 11.970 19.905 2.753 0.54 27.17 H ATOM 4151 HG3AGLU E 49 12.665 19.960 1.325 0.54 27.17 H ATOM 4152 N ASP E 50 13.181 17.278 4.435 1.00 13.62 N ANISOU 4152 N ASP E 50 1769 1649 1758 52 554 -54 N ATOM 4153 CA ASP E 50 13.704 17.629 5.760 1.00 11.85 C ANISOU 4153 CA ASP E 50 1528 1418 1554 -7 436 27 C ATOM 4154 C ASP E 50 15.184 17.247 5.836 1.00 11.32 C ANISOU 4154 C ASP E 50 1468 1261 1572 -143 410 60 C ATOM 4155 O ASP E 50 16.020 18.000 6.354 1.00 10.98 O ANISOU 4155 O ASP E 50 1455 1187 1530 -21 391 109 O ATOM 4156 CB ASP E 50 12.942 16.914 6.895 1.00 10.53 C ANISOU 4156 CB ASP E 50 1299 1345 1358 -46 414 -25 C ATOM 4157 CG ASP E 50 11.507 17.409 7.081 1.00 13.52 C ANISOU 4157 CG ASP E 50 1648 1929 1562 105 292 -42 C ATOM 4158 OD1 ASP E 50 11.144 18.486 6.575 1.00 14.88 O ANISOU 4158 OD1 ASP E 50 1755 2161 1737 456 -28 167 O ATOM 4159 OD2 ASP E 50 10.743 16.702 7.763 1.00 14.64 O ANISOU 4159 OD2 ASP E 50 1606 2326 1631 123 625 -367 O ATOM 4160 H ASP E 50 12.565 16.678 4.443 1.00 16.34 H ATOM 4161 HA ASP E 50 13.626 18.596 5.895 1.00 14.21 H ATOM 4162 HB2 ASP E 50 12.905 15.965 6.697 1.00 12.64 H ATOM 4163 HB3 ASP E 50 13.416 17.058 7.729 1.00 12.64 H ATOM 4164 N CYS E 51 15.491 16.049 5.353 1.00 11.97 N ANISOU 4164 N CYS E 51 1496 1458 1594 -277 356 -12 N ATOM 4165 CA CYS E 51 16.856 15.536 5.360 1.00 11.60 C ANISOU 4165 CA CYS E 51 1511 1334 1561 -244 395 50 C ATOM 4166 C CYS E 51 17.768 16.423 4.505 1.00 12.89 C ANISOU 4166 C CYS E 51 1695 1419 1785 -269 393 109 C ATOM 4167 O CYS E 51 18.854 16.798 4.947 1.00 12.56 O ANISOU 4167 O CYS E 51 1601 1362 1809 -331 273 220 O ATOM 4168 CB CYS E 51 16.869 14.085 4.881 1.00 10.99 C ANISOU 4168 CB CYS E 51 1422 1238 1517 -105 439 102 C ATOM 4169 SG CYS E 51 18.500 13.313 4.785 1.00 13.06 S ANISOU 4169 SG CYS E 51 1646 1382 1935 28 446 45 S ATOM 4170 H CYS E 51 14.919 15.506 5.010 1.00 14.36 H ATOM 4171 HA CYS E 51 17.197 15.552 6.279 1.00 13.92 H ATOM 4172 HB2 CYS E 51 16.332 13.556 5.491 1.00 13.19 H ATOM 4173 HB3 CYS E 51 16.478 14.052 3.994 1.00 13.19 H ATOM 4174 N MET E 52 17.316 16.788 3.303 1.00 14.63 N ANISOU 4174 N MET E 52 1880 1691 1986 -249 503 238 N ATOM 4175 CA MET E 52 18.127 17.605 2.394 1.00 16.71 C ANISOU 4175 CA MET E 52 2194 1897 2257 -188 463 361 C ATOM 4176 C MET E 52 18.323 18.999 2.996 1.00 15.90 C ANISOU 4176 C MET E 52 2145 1642 2256 -42 537 284 C ATOM 4177 O MET E 52 19.394 19.592 2.882 1.00 15.16 O ANISOU 4177 O MET E 52 2118 1368 2274 194 725 259 O ATOM 4178 CB MET E 52 17.463 17.710 1.008 1.00 23.10 C ANISOU 4178 CB MET E 52 2976 2806 2995 -434 474 456 C ATOM 4179 CG MET E 52 17.333 16.387 0.249 1.00 31.17 C ANISOU 4179 CG MET E 52 3964 3916 3963 -504 332 525 C ATOM 4180 SD MET E 52 16.307 16.561 -1.240 1.00 41.70 S ANISOU 4180 SD MET E 52 5394 5262 5187 -449 178 551 S ATOM 4181 CE MET E 52 17.104 17.965 -2.006 1.00 53.55 C ANISOU 4181 CE MET E 52 6801 6727 6816 -463 152 609 C ATOM 4182 H MET E 52 16.544 16.575 2.990 1.00 17.55 H ATOM 4183 HA MET E 52 19.003 17.181 2.280 1.00 20.05 H ATOM 4184 HB2 MET E 52 16.570 18.071 1.121 1.00 27.72 H ATOM 4185 HB3 MET E 52 17.990 18.311 0.459 1.00 27.72 H ATOM 4186 HG2 MET E 52 18.215 16.088 -0.024 1.00 37.40 H ATOM 4187 HG3 MET E 52 16.919 15.727 0.826 1.00 37.40 H ATOM 4188 HE1 MET E 52 16.651 18.172 -2.827 1.00 64.25 H ATOM 4189 HE2 MET E 52 17.059 18.715 -1.408 1.00 64.25 H ATOM 4190 HE3 MET E 52 18.021 17.744 -2.186 1.00 64.25 H ATOM 4191 N ARG E 53 17.294 19.520 3.660 1.00 17.17 N ANISOU 4191 N ARG E 53 2268 1945 2311 -39 474 243 N ATOM 4192 CA ARG E 53 17.393 20.865 4.218 1.00 16.53 C ANISOU 4192 CA ARG E 53 2114 1929 2238 -7 550 68 C ATOM 4193 C ARG E 53 18.482 20.899 5.294 1.00 16.69 C ANISOU 4193 C ARG E 53 2200 1800 2341 -173 614 -120 C ATOM 4194 O ARG E 53 19.256 21.847 5.383 1.00 16.79 O ANISOU 4194 O ARG E 53 2286 1572 2523 -424 685 -92 O ATOM 4195 CB ARG E 53 16.062 21.323 4.807 1.00 18.67 C ANISOU 4195 CB ARG E 53 2371 2283 2439 84 652 140 C ATOM 4196 CG ARG E 53 16.187 22.613 5.584 1.00 23.09 C ANISOU 4196 CG ARG E 53 2904 2872 2997 150 666 38 C ATOM 4197 CD ARG E 53 14.834 23.209 5.977 1.00 29.87 C ANISOU 4197 CD ARG E 53 3748 3663 3940 291 839 -38 C ATOM 4198 NE ARG E 53 13.720 22.280 5.825 1.00 50.97 N ANISOU 4198 NE ARG E 53 6504 6393 6469 467 909 -174 N ATOM 4199 CZ ARG E 53 12.778 22.381 4.892 1.00 53.82 C ANISOU 4199 CZ ARG E 53 6859 6735 6853 429 965 -296 C ATOM 4200 NH1 ARG E 53 12.808 23.368 4.010 1.00 50.61 N ANISOU 4200 NH1 ARG E 53 6438 6299 6493 403 991 -347 N ATOM 4201 NH2 ARG E 53 11.801 21.490 4.841 1.00 61.38 N ANISOU 4201 NH2 ARG E 53 7773 7712 7837 337 959 -330 N ATOM 4202 H ARG E 53 16.542 19.126 3.798 1.00 20.60 H ATOM 4203 HA ARG E 53 17.645 21.491 3.507 1.00 19.84 H ATOM 4204 HB2 ARG E 53 15.429 21.467 4.086 1.00 22.40 H ATOM 4205 HB3 ARG E 53 15.730 20.640 5.410 1.00 22.40 H ATOM 4206 HG2 ARG E 53 16.687 22.444 6.398 1.00 27.71 H ATOM 4207 HG3 ARG E 53 16.654 23.266 5.039 1.00 27.71 H ATOM 4208 HD2 ARG E 53 14.869 23.481 6.907 1.00 35.85 H ATOM 4209 HD3 ARG E 53 14.656 23.980 5.415 1.00 35.85 H ATOM 4210 HE ARG E 53 13.662 21.538 6.446 1.00 61.16 H ATOM 4211 HH11 ARG E 53 13.439 23.952 4.040 1.00 60.73 H ATOM 4212 HH12 ARG E 53 12.196 23.427 3.409 1.00 60.73 H ATOM 4213 HH21 ARG E 53 11.777 20.846 5.409 1.00 73.66 H ATOM 4214 HH22 ARG E 53 11.193 21.553 4.236 1.00 73.66 H ATOM 4215 N THR E 54 18.549 19.852 6.105 1.00 15.60 N ANISOU 4215 N THR E 54 2072 1628 2229 49 478 -240 N ATOM 4216 CA THR E 54 19.471 19.829 7.234 1.00 16.51 C ANISOU 4216 CA THR E 54 2108 1849 2316 81 452 -478 C ATOM 4217 C THR E 54 20.875 19.330 6.830 1.00 15.56 C ANISOU 4217 C THR E 54 1862 1775 2277 -78 236 -539 C ATOM 4218 O THR E 54 21.886 19.898 7.256 1.00 15.14 O ANISOU 4218 O THR E 54 1730 1609 2415 21 183 -573 O ATOM 4219 CB THR E 54 18.895 18.955 8.394 1.00 19.34 C ANISOU 4219 CB THR E 54 2467 2306 2574 131 609 -583 C ATOM 4220 OG1 THR E 54 17.616 19.462 8.802 1.00 18.51 O ANISOU 4220 OG1 THR E 54 2362 2146 2526 104 637 -623 O ATOM 4221 CG2 THR E 54 19.810 18.942 9.586 1.00 18.61 C ANISOU 4221 CG2 THR E 54 2376 2254 2440 208 466 -559 C ATOM 4222 H THR E 54 18.071 19.141 6.025 1.00 18.73 H ATOM 4223 HA THR E 54 19.570 20.743 7.573 1.00 19.81 H ATOM 4224 HB THR E 54 18.790 18.042 8.084 1.00 23.20 H ATOM 4225 HG1 THR E 54 17.691 20.236 9.063 1.00 22.21 H ATOM 4226 HG21 THR E 54 19.434 18.400 10.283 1.00 22.33 H ATOM 4227 HG22 THR E 54 20.665 18.583 9.338 1.00 22.33 H ATOM 4228 HG23 THR E 54 19.931 19.835 9.916 1.00 22.33 H ATOM 4229 N CYS E 55 20.933 18.291 5.994 1.00 14.47 N ANISOU 4229 N CYS E 55 1781 1605 2113 -81 243 -543 N ATOM 4230 CA CYS E 55 22.193 17.580 5.735 1.00 15.95 C ANISOU 4230 CA CYS E 55 1940 1854 2266 -260 267 -426 C ATOM 4231 C CYS E 55 22.718 17.700 4.304 1.00 19.26 C ANISOU 4231 C CYS E 55 2286 2310 2722 -244 385 -309 C ATOM 4232 O CYS E 55 23.855 17.316 4.033 1.00 18.02 O ANISOU 4232 O CYS E 55 1933 2142 2770 -406 355 -255 O ATOM 4233 CB CYS E 55 22.067 16.091 6.071 1.00 15.63 C ANISOU 4233 CB CYS E 55 1928 1743 2266 -131 257 -458 C ATOM 4234 SG CYS E 55 21.811 15.699 7.810 1.00 14.12 S ANISOU 4234 SG CYS E 55 1591 1350 2423 -40 439 -309 S ATOM 4235 H CYS E 55 20.258 17.977 5.563 1.00 17.37 H ATOM 4236 HA CYS E 55 22.880 17.954 6.326 1.00 19.14 H ATOM 4237 HB2 CYS E 55 21.313 15.730 5.579 1.00 18.75 H ATOM 4238 HB3 CYS E 55 22.880 15.644 5.790 1.00 18.75 H ATOM 4239 N GLY E 56 21.899 18.201 3.389 1.00 24.35 N ANISOU 4239 N GLY E 56 3005 3029 3219 -176 437 -298 N ATOM 4240 CA GLY E 56 22.359 18.474 2.036 1.00 32.38 C ANISOU 4240 CA GLY E 56 4056 4076 4172 44 592 -137 C ATOM 4241 C GLY E 56 22.197 17.297 1.094 1.00 46.94 C ANISOU 4241 C GLY E 56 5890 6072 5874 221 699 90 C ATOM 4242 O GLY E 56 21.293 16.477 1.254 1.00 46.66 O ANISOU 4242 O GLY E 56 5770 6156 5802 347 777 152 O ATOM 4243 H GLY E 56 21.071 18.392 3.526 1.00 29.23 H ATOM 4244 HA2 GLY E 56 21.861 19.224 1.674 1.00 38.86 H ATOM 4245 HA3 GLY E 56 23.298 18.716 2.061 1.00 38.86 H ATOM 4246 N GLY E 57 23.079 17.215 0.101 1.00 62.21 N ANISOU 4246 N GLY E 57 7852 7905 7880 163 718 205 N ATOM 4247 CA GLY E 57 23.024 16.152 -0.887 1.00 72.91 C ANISOU 4247 CA GLY E 57 9208 9202 9291 102 618 235 C ATOM 4248 C GLY E 57 21.867 16.311 -1.858 1.00 80.45 C ANISOU 4248 C GLY E 57 10200 10256 10112 21 545 247 C ATOM 4249 O GLY E 57 20.907 17.032 -1.584 1.00 80.90 O ANISOU 4249 O GLY E 57 10200 10470 10069 0 624 247 O ATOM 4250 H GLY E 57 23.725 17.771 -0.020 1.00 74.65 H ATOM 4251 HA2 GLY E 57 23.850 16.140 -1.395 1.00 87.49 H ATOM 4252 HA3 GLY E 57 22.930 15.298 -0.436 1.00 87.49 H ATOM 4253 N ALA E 58 21.962 15.633 -2.997 0.00 88.60 N ANISOU 4253 N ALA E 58 11239 11181 11243 -27 402 246 N ATOM 4254 CA ALA E 58 20.932 15.705 -4.028 0.00 91.92 C ANISOU 4254 CA ALA E 58 11645 11524 11758 -60 312 243 C ATOM 4255 C ALA E 58 20.859 17.107 -4.624 0.00 91.50 C ANISOU 4255 C ALA E 58 11588 11334 11842 -72 288 240 C ATOM 4256 O ALA E 58 21.776 17.914 -4.464 0.00 91.55 O ANISOU 4256 O ALA E 58 11587 11253 11944 -77 309 238 O ATOM 4257 CB ALA E 58 19.580 15.298 -3.459 0.00 94.61 C ANISOU 4257 CB ALA E 58 11930 11864 12153 -69 204 243 C ATOM 4258 OXT ALA E 58 19.885 17.465 -5.286 0.00 91.55 O ANISOU 4258 OXT ALA E 58 11586 11253 11946 -74 307 240 O ATOM 4259 H ALA E 58 22.621 15.118 -3.200 0.00106.32 H ATOM 4260 HA ALA E 58 21.158 15.081 -4.749 0.00110.31 H ATOM 4261 HB1 ALA E 58 18.920 15.353 -4.154 0.00113.53 H ATOM 4262 HB2 ALA E 58 19.637 14.397 -3.133 0.00113.53 H ATOM 4263 HB3 ALA E 58 19.351 15.893 -2.741 0.00113.53 H TER 4264 ALA E 58 HETATM 4265 CA CA A 1 -3.760 -11.780 1.368 1.00 12.62 CA ANISOU 4265 CA CA A 1 1752 1815 1227 320 -137 -95 CA HETATM 4266 O HOH A 2 8.168 -12.772 10.051 1.00 5.74 O ANISOU 4266 O HOH A 2 1008 760 411 112 136 -31 O HETATM 4267 O HOH A 3 14.917 -5.035 17.927 1.00 6.68 O ANISOU 4267 O HOH A 3 938 860 742 -207 157 -72 O HETATM 4268 O HOH A 4 14.938 -14.694 21.673 1.00 9.97 O ANISOU 4268 O HOH A 4 1652 931 1207 -17 100 5 O HETATM 4269 O HOH A 5 3.310 -9.394 14.750 1.00 5.17 O ANISOU 4269 O HOH A 5 797 569 600 -17 84 -196 O HETATM 4270 O HOH A 6 0.532 -11.242 30.461 1.00 5.92 O ANISOU 4270 O HOH A 6 683 764 803 338 -71 29 O HETATM 4271 O HOH A 7 2.924 -17.072 36.389 1.00 7.69 O ANISOU 4271 O HOH A 7 1010 1133 778 -270 110 58 O HETATM 4272 O HOH A 8 18.408 -9.798 19.781 1.00 7.95 O ANISOU 4272 O HOH A 8 873 784 1364 127 360 -46 O HETATM 4273 O HOH A 10 5.989 -2.316 28.004 1.00 7.50 O ANISOU 4273 O HOH A 10 942 1133 774 173 195 -83 O HETATM 4274 O HOH A 12 10.741 -12.433 31.854 1.00 7.84 O ANISOU 4274 O HOH A 12 975 1201 805 208 163 160 O HETATM 4275 O HOH A 13 3.581 -8.445 12.067 1.00 5.23 O ANISOU 4275 O HOH A 13 782 431 775 84 225 27 O HETATM 4276 O HOH A 14 -4.604 -10.678 9.323 1.00 8.67 O ANISOU 4276 O HOH A 14 1080 1384 830 107 -107 98 O HETATM 4277 O HOH A 15 -2.035 -6.930 3.156 1.00 9.16 O ANISOU 4277 O HOH A 15 1722 1094 664 209 -232 -103 O HETATM 4278 O HOH A 35 -4.365 -14.063 10.187 1.00 12.02 O ANISOU 4278 O HOH A 35 1501 1617 1448 440 139 16 O HETATM 4279 O HOH A 68 -10.765 -11.377 24.086 1.00 15.94 O ANISOU 4279 O HOH A 68 1672 2083 2302 475 795 430 O HETATM 4280 O HOH A 131 6.833 -15.860 2.796 1.00 26.35 O ANISOU 4280 O HOH A 131 2945 3457 3608 1212 1282 -786 O HETATM 4281 O HOH A 206 -11.982 -14.328 23.007 1.00 30.85 O ANISOU 4281 O HOH A 206 3146 5192 3384 -1257 -1060 1117 O HETATM 4282 O HOH A 207 17.555 -0.209 24.984 1.00 27.25 O ANISOU 4282 O HOH A 207 4701 3805 1846 -2006 -272 -160 O HETATM 4283 O HOH A 218 1.637 -21.680 3.310 1.00 39.32 O ANISOU 4283 O HOH A 218 5385 4791 4763 -100 342 336 O HETATM 4284 O HOH A 247 17.523 -24.168 24.089 1.00 44.23 O ANISOU 4284 O HOH A 247 5858 5481 5465 -436 354 307 O HETATM 4285 O HOH A 248 11.501 -13.569 21.225 1.00 7.23 O ANISOU 4285 O HOH A 248 993 674 1078 198 130 255 O HETATM 4286 O HOH A 249 17.424 -4.772 14.561 1.00 14.68 O ANISOU 4286 O HOH A 249 929 2208 2440 29 -118 -172 O HETATM 4287 O HOH A 250 0.876 9.667 12.116 1.00 28.99 O ANISOU 4287 O HOH A 250 4549 2085 4381 -1210 476 968 O HETATM 4288 O HOH A 251 -5.091 -18.780 33.497 1.00 8.80 O ANISOU 4288 O HOH A 251 1433 1135 774 -19 259 298 O HETATM 4289 O HOH A 252 -5.652 -5.240 35.259 1.00 11.33 O ANISOU 4289 O HOH A 252 1540 1504 1259 190 -252 -206 O HETATM 4290 O HOH A 253 -5.054 -7.915 35.799 1.00 14.03 O ANISOU 4290 O HOH A 253 2113 1731 1486 469 524 675 O HETATM 4291 O HOH A 254 -20.258 0.649 27.000 1.00 26.48 O ANISOU 4291 O HOH A 254 2488 4423 3150 -478 -259 -232 O HETATM 4292 O HOH A 255 -7.226 -11.898 11.490 1.00 10.20 O ANISOU 4292 O HOH A 255 1549 1402 924 92 -250 345 O HETATM 4293 O HOH A 256 24.283 -17.870 25.534 1.00 45.59 O ANISOU 4293 O HOH A 256 5170 5776 6374 561 -459 322 O HETATM 4294 O HOH A 257 21.893 -2.055 30.294 1.00 14.59 O ANISOU 4294 O HOH A 257 2332 1666 1546 -861 58 19 O HETATM 4295 O HOH A 258 -7.793 -11.350 34.283 1.00 12.16 O ANISOU 4295 O HOH A 258 2025 1271 1326 309 976 203 O HETATM 4296 O HOH A 259 4.880 6.381 12.893 1.00 36.61 O ANISOU 4296 O HOH A 259 3801 5053 5057 1162 790 61 O HETATM 4297 O HOH A 260 0.574 -15.898 18.132 1.00 6.60 O ANISOU 4297 O HOH A 260 1078 680 750 55 -18 151 O HETATM 4298 O HOH A 261 1.157 1.262 34.476 1.00 38.81 O ANISOU 4298 O HOH A 261 4970 5338 4439 320 684 -810 O HETATM 4299 O HOH A 262 -3.417 -16.953 10.739 1.00 12.01 O ANISOU 4299 O HOH A 262 1721 1262 1580 -130 -73 375 O HETATM 4300 O HOH A 263 -14.341 -15.280 0.972 1.00 40.08 O ANISOU 4300 O HOH A 263 4603 6372 4255 -1034 -752 -33 O HETATM 4301 O HOH A 264 11.510 -23.055 18.708 1.00 13.83 O ANISOU 4301 O HOH A 264 1995 1669 1591 565 -76 -364 O HETATM 4302 O HOH A 265 4.624 4.531 14.779 1.00 28.82 O ANISOU 4302 O HOH A 265 3587 3473 3891 995 1653 1065 O HETATM 4303 O HOH A 266 -0.832 -8.085 20.494 1.00 8.51 O ANISOU 4303 O HOH A 266 1122 1120 992 -260 298 -411 O HETATM 4304 O HOH A 267 8.298 -2.161 26.482 1.00 9.84 O ANISOU 4304 O HOH A 267 947 1709 1082 428 172 -174 O HETATM 4305 O HOH A 268 -0.377 -2.018 1.112 1.00 31.01 O ANISOU 4305 O HOH A 268 5623 3849 2310 -365 909 -660 O HETATM 4306 O HOH A 269 -3.808 -9.387 0.923 1.00 14.13 O ANISOU 4306 O HOH A 269 2021 1807 1542 219 -277 -31 O HETATM 4307 O HOH A 270 20.369 -15.095 13.554 1.00 32.73 O ANISOU 4307 O HOH A 270 3964 3915 4559 1005 1978 73 O HETATM 4308 O HOH A 271 -2.616 -1.635 -0.443 1.00 31.22 O ANISOU 4308 O HOH A 271 5152 3835 2876 942 1256 1377 O HETATM 4309 O HOH A 272 6.783 5.190 17.123 1.00 34.77 O ANISOU 4309 O HOH A 272 4418 3200 5593 -605 557 492 O HETATM 4310 O HOH A 273 9.742 -22.587 16.501 1.00 11.45 O ANISOU 4310 O HOH A 273 1429 1527 1394 192 -13 -234 O HETATM 4311 O HOH A 274 11.442 -22.580 14.449 1.00 14.18 O ANISOU 4311 O HOH A 274 2064 1615 1707 -142 801 -297 O HETATM 4312 O HOH A 275 -10.753 6.364 26.942 1.00 21.85 O ANISOU 4312 O HOH A 275 2688 2809 2807 -200 -946 609 O HETATM 4313 O HOH A 276 15.625 -5.369 10.943 1.00 12.84 O ANISOU 4313 O HOH A 276 1385 1711 1784 -181 250 -883 O HETATM 4314 O HOH A 277 -12.378 -14.804 26.256 1.00 39.15 O ANISOU 4314 O HOH A 277 3421 5345 6109 -26 -353 -2 O HETATM 4315 O HOH A 278 15.170 -16.864 9.817 1.00 13.31 O ANISOU 4315 O HOH A 278 2798 1244 1015 -27 615 -308 O HETATM 4316 O HOH A 279 11.360 -17.132 10.472 1.00 9.78 O ANISOU 4316 O HOH A 279 2070 718 928 139 68 -25 O HETATM 4317 O HOH A 280 -6.830 -2.237 38.014 1.00 16.61 O ANISOU 4317 O HOH A 280 2773 2343 1196 -921 455 -47 O HETATM 4318 O HOH A 281 -12.556 -11.187 1.823 1.00 35.41 O ANISOU 4318 O HOH A 281 4421 4865 4167 -293 -1823 116 O HETATM 4319 O HOH A 282 -0.690 6.872 9.172 1.00 44.31 O ANISOU 4319 O HOH A 282 6061 5677 5096 146 56 959 O HETATM 4320 O HOH A 283 17.081 -13.114 20.764 1.00 11.33 O ANISOU 4320 O HOH A 283 1736 1540 1030 -204 510 -176 O HETATM 4321 O HOH A 284 -2.539 -18.071 32.826 1.00 10.56 O ANISOU 4321 O HOH A 284 1583 1591 837 294 214 202 O HETATM 4322 O HOH A 285 -3.272 0.622 33.550 1.00 10.71 O ANISOU 4322 O HOH A 285 1413 1260 1398 399 622 295 O HETATM 4323 O HOH A 286 -6.165 -22.591 14.621 1.00 35.24 O ANISOU 4323 O HOH A 286 4624 3762 5004 -1456 431 109 O HETATM 4324 O HOH A 287 15.227 -20.341 26.243 1.00 15.65 O ANISOU 4324 O HOH A 287 1257 1998 2691 209 244 612 O HETATM 4325 O HOH A 288 -2.465 -16.842 8.271 1.00 13.67 O ANISOU 4325 O HOH A 288 2692 1255 1248 -456 186 77 O HETATM 4326 O HOH A 289 -7.464 -0.165 0.888 1.00 30.55 O ANISOU 4326 O HOH A 289 4238 5593 1775 -646 -1071 694 O HETATM 4327 O HOH A 290 -2.078 -21.544 23.016 1.00 17.34 O ANISOU 4327 O HOH A 290 3874 970 1745 138 676 -49 O HETATM 4328 O HOH A 291 23.998 -9.071 33.942 1.00 26.48 O ANISOU 4328 O HOH A 291 2323 4063 3676 -553 -1899 1012 O HETATM 4329 O HOH A 292 -6.515 -15.622 9.476 1.00 14.65 O ANISOU 4329 O HOH A 292 1795 1802 1971 521 480 372 O HETATM 4330 O HOH A 293 12.865 -14.450 38.555 1.00 13.26 O ANISOU 4330 O HOH A 293 1851 1927 1258 -5 -157 359 O HETATM 4331 O HOH A 294 18.405 -10.184 37.577 1.00 16.01 O ANISOU 4331 O HOH A 294 2213 1884 1984 8 -971 -327 O HETATM 4332 O HOH A 295 25.135 -10.275 21.824 1.00 20.52 O ANISOU 4332 O HOH A 295 1363 3156 3276 -474 314 -71 O HETATM 4333 O HOH A 296 -4.628 -20.343 16.893 1.00 38.72 O ANISOU 4333 O HOH A 296 5377 4897 4438 -1273 -716 -69 O HETATM 4334 O HOH A 297 -0.533 -5.453 5.157 1.00 8.87 O ANISOU 4334 O HOH A 297 1342 1272 755 186 -7 305 O HETATM 4335 O HOH A 298 14.686 -18.092 32.034 1.00 9.82 O ANISOU 4335 O HOH A 298 1074 1491 1167 61 -210 577 O HETATM 4336 O HOH A 299 -8.606 -17.655 23.188 1.00 18.91 O ANISOU 4336 O HOH A 299 2940 1369 2875 137 963 314 O HETATM 4337 O HOH A 300 -7.096 -9.502 36.145 1.00 15.61 O ANISOU 4337 O HOH A 300 1820 2366 1746 126 849 -85 O HETATM 4338 O HOH A 301 -7.163 8.837 21.217 1.00 43.88 O ANISOU 4338 O HOH A 301 6038 5108 5524 481 188 206 O HETATM 4339 O HOH A 302 -12.158 0.880 37.537 1.00 14.79 O ANISOU 4339 O HOH A 302 1823 1254 2542 -28 825 67 O HETATM 4340 O HOH A 303 17.638 2.813 28.705 1.00 16.07 O ANISOU 4340 O HOH A 303 2504 1582 2019 -175 131 -38 O HETATM 4341 O HOH A 304 -16.443 -5.080 20.245 1.00 18.07 O ANISOU 4341 O HOH A 304 2596 2145 2123 634 575 223 O HETATM 4342 O HOH A 305 17.488 -4.236 9.909 1.00 43.30 O ANISOU 4342 O HOH A 305 6140 5519 4794 -1705 -213 103 O HETATM 4343 O HOH A 306 -15.594 -10.849 21.372 1.00 30.74 O ANISOU 4343 O HOH A 306 3143 3585 4950 -960 1999 119 O HETATM 4344 O HOH A 307 24.095 -6.746 35.742 1.00 32.89 O ANISOU 4344 O HOH A 307 4222 5286 2988 2175 -1068 624 O HETATM 4345 O HOH A 308 -1.199 1.189 35.073 1.00 33.21 O ANISOU 4345 O HOH A 308 4125 5292 3201 973 398 -185 O HETATM 4346 O HOH A 309 4.447 -26.560 12.442 1.00 45.29 O ANISOU 4346 O HOH A 309 5758 5063 6386 -564 -277 -846 O HETATM 4347 O HOH A 310 26.080 -7.995 32.036 1.00 56.86 O ANISOU 4347 O HOH A 310 6906 7130 7570 -347 -397 -126 O HETATM 4348 O HOH A 311 -6.620 5.714 28.926 1.00 10.95 O ANISOU 4348 O HOH A 311 1216 1860 1086 436 -115 -491 O HETATM 4349 O HOH A 312 2.918 8.692 10.210 1.00 39.21 O ANISOU 4349 O HOH A 312 5058 4517 5324 4 -122 -62 O HETATM 4350 O HOH A 313 25.518 -10.676 35.652 1.00 30.99 O ANISOU 4350 O HOH A 313 4144 4009 3622 55 1491 1227 O HETATM 4351 O HOH A 314 24.800 -12.624 18.272 1.00 14.06 O ANISOU 4351 O HOH A 314 825 1704 2813 -126 202 550 O HETATM 4352 O HOH A 315 -13.113 0.934 6.983 1.00 16.86 O ANISOU 4352 O HOH A 315 2236 1952 2218 381 -1190 509 O HETATM 4353 O HOH A 316 2.642 -2.783 34.004 1.00 14.72 O ANISOU 4353 O HOH A 316 2252 1855 1486 636 305 -35 O HETATM 4354 O HOH A 317 6.432 -23.780 33.189 1.00 17.15 O ANISOU 4354 O HOH A 317 1732 2035 2750 -367 -274 721 O HETATM 4355 O HOH A 318 1.830 8.609 7.418 1.00 37.19 O ANISOU 4355 O HOH A 318 5264 4115 4752 175 -462 -434 O HETATM 4356 O HOH A 319 11.565 7.399 21.598 1.00 17.85 O ANISOU 4356 O HOH A 319 3116 1497 2168 412 1468 -447 O HETATM 4357 O HOH A 320 14.713 -2.509 4.009 1.00 30.03 O ANISOU 4357 O HOH A 320 4319 4038 3055 467 1791 -465 O HETATM 4358 O HOH A 321 -15.767 -6.572 24.425 1.00 32.85 O ANISOU 4358 O HOH A 321 4669 4748 3062 164 653 -51 O HETATM 4359 O HOH A 322 -15.603 -3.844 28.591 1.00 16.12 O ANISOU 4359 O HOH A 322 1794 1370 2959 -170 139 -371 O HETATM 4360 O HOH A 323 16.539 -4.908 33.938 1.00 17.34 O ANISOU 4360 O HOH A 323 2195 1781 2614 -205 594 164 O HETATM 4361 O HOH A 324 -5.814 -0.760 35.931 1.00 13.10 O ANISOU 4361 O HOH A 324 2196 1238 1543 382 712 5 O HETATM 4362 O HOH A 325 9.856 -8.267 21.288 1.00 10.77 O ANISOU 4362 O HOH A 325 1370 1424 1297 -182 26 -68 O HETATM 4363 O HOH A 326 6.391 -5.989 4.493 1.00 33.67 O ANISOU 4363 O HOH A 326 4096 3720 4977 1240 603 758 O HETATM 4364 O HOH A 327 19.367 -7.059 14.163 1.00 19.62 O ANISOU 4364 O HOH A 327 2674 2813 1966 -732 906 -464 O HETATM 4365 O HOH A 328 22.417 -5.209 24.922 1.00 31.56 O ANISOU 4365 O HOH A 328 4551 3428 4011 -142 -561 -432 O HETATM 4366 O HOH A 329 6.544 -8.521 5.469 1.00 10.58 O ANISOU 4366 O HOH A 329 1544 1734 742 367 181 -147 O HETATM 4367 O HOH A 330 12.399 -23.427 29.170 1.00 27.64 O ANISOU 4367 O HOH A 330 4384 2879 3238 733 -16 1274 O HETATM 4368 O HOH A 331 24.738 -6.228 29.432 1.00 31.81 O ANISOU 4368 O HOH A 331 2331 4522 5234 -1118 876 -1640 O HETATM 4369 O HOH A 332 -9.001 -5.740 39.406 1.00 25.71 O ANISOU 4369 O HOH A 332 3824 3657 2286 391 762 736 O HETATM 4370 O HOH A 333 8.650 -25.161 16.180 1.00 30.55 O ANISOU 4370 O HOH A 333 4222 2699 4685 -794 -1426 544 O HETATM 4371 O HOH A 334 3.809 6.541 20.217 1.00 18.32 O ANISOU 4371 O HOH A 334 2340 1399 3223 -631 -648 456 O HETATM 4372 O HOH A 335 16.462 -17.206 36.887 1.00 20.96 O ANISOU 4372 O HOH A 335 1831 1575 4556 -493 -1803 809 O HETATM 4373 O HOH A 336 1.731 -22.773 5.629 1.00 28.10 O ANISOU 4373 O HOH A 336 4382 3687 2609 -1514 1192 -1039 O HETATM 4374 O HOH A 337 10.810 -19.078 8.725 1.00 33.29 O ANISOU 4374 O HOH A 337 4605 3804 4240 119 139 -1674 O HETATM 4375 O HOH A 338 7.755 7.420 33.251 1.00 35.95 O ANISOU 4375 O HOH A 338 3909 5149 4603 -588 1068 -1012 O HETATM 4376 O HOH A 339 7.446 -17.826 36.826 1.00 16.81 O ANISOU 4376 O HOH A 339 1575 3531 1281 413 152 -708 O HETATM 4377 O HOH A 340 -11.713 -18.990 14.151 1.00 31.46 O ANISOU 4377 O HOH A 340 2707 4034 5210 -913 -790 -1360 O HETATM 4378 O HOH A 341 0.671 -21.634 22.366 1.00 39.59 O ANISOU 4378 O HOH A 341 5175 5050 4815 -663 245 191 O HETATM 4379 O HOH A 342 21.346 -6.810 36.660 1.00 39.38 O ANISOU 4379 O HOH A 342 4833 5027 5102 -308 516 662 O HETATM 4380 O HOH A 343 -10.374 -11.324 33.388 1.00 23.02 O ANISOU 4380 O HOH A 343 1910 2157 4677 -556 1595 -212 O HETATM 4381 O HOH A 344 17.526 -16.308 19.898 1.00 17.87 O ANISOU 4381 O HOH A 344 2388 2673 1728 1226 129 -1053 O HETATM 4382 O HOH A 345 -12.231 -5.755 3.019 1.00 21.05 O ANISOU 4382 O HOH A 345 3363 2531 2106 -288 -1583 811 O HETATM 4383 O HOH A 346 -10.095 -7.319 1.345 1.00 36.88 O ANISOU 4383 O HOH A 346 4404 5547 4062 530 165 -406 O HETATM 4384 O HOH A 347 4.256 -7.338 36.810 1.00 19.90 O ANISOU 4384 O HOH A 347 1812 3019 2731 22 -423 963 O HETATM 4385 O HOH A 348 -9.351 4.849 28.622 1.00 12.37 O ANISOU 4385 O HOH A 348 1820 1210 1668 -141 -346 62 O HETATM 4386 O HOH A 349 -12.007 -3.530 1.645 1.00 25.44 O ANISOU 4386 O HOH A 349 3645 2628 3393 -413 -2263 346 O HETATM 4387 O HOH A 350 -16.802 -4.591 8.837 1.00 25.22 O ANISOU 4387 O HOH A 350 2774 4370 2440 226 -1187 -196 O HETATM 4388 O HOH A 351 -19.608 -9.276 13.864 1.00 28.87 O ANISOU 4388 O HOH A 351 1686 5269 4013 808 249 -2031 O HETATM 4389 O HOH A 352 -19.953 -11.526 13.114 1.00 26.71 O ANISOU 4389 O HOH A 352 2112 3661 4375 -385 -263 2278 O HETATM 4390 O HOH A 353 -16.167 -4.458 31.275 1.00 30.76 O ANISOU 4390 O HOH A 353 4412 4364 2913 -463 -171 -429 O HETATM 4391 O HOH A 354 -3.621 -7.072 37.969 1.00 31.23 O ANISOU 4391 O HOH A 354 5008 3775 3084 921 -56 -1660 O HETATM 4392 O HOH A 355 -14.449 -18.866 15.403 1.00 32.33 O ANISOU 4392 O HOH A 355 4027 4124 4132 -1033 322 -928 O HETATM 4393 O HOH A 356 3.224 -24.552 9.848 1.00 41.16 O ANISOU 4393 O HOH A 356 4670 4832 6136 -38 -605 187 O HETATM 4394 O HOH A 357 -15.412 -6.741 7.427 1.00 22.39 O ANISOU 4394 O HOH A 357 3021 2548 2940 -381 454 -717 O HETATM 4395 O HOH A 358 -13.007 -12.974 6.574 1.00 18.74 O ANISOU 4395 O HOH A 358 2496 3201 1422 -918 106 -144 O HETATM 4396 O HOH A 359 20.995 -9.251 37.408 1.00 19.35 O ANISOU 4396 O HOH A 359 1532 2422 3397 376 -425 994 O HETATM 4397 O HOH A 360 9.451 4.520 33.067 1.00 18.71 O ANISOU 4397 O HOH A 360 1624 4083 1400 -1232 104 461 O HETATM 4398 O HOH A 361 -11.590 -9.546 35.014 1.00 22.62 O ANISOU 4398 O HOH A 361 2631 2931 3033 -175 628 186 O HETATM 4399 O HOH A 362 18.320 -18.490 12.755 1.00 16.82 O ANISOU 4399 O HOH A 362 1888 2712 1791 -207 130 -251 O HETATM 4400 O HOH A 363 21.528 -3.358 27.953 1.00 19.88 O ANISOU 4400 O HOH A 363 3264 2807 1484 737 -519 23 O HETATM 4401 O AHOH A 364 15.046 -3.722 8.142 0.64 14.87 O ANISOU 4401 O AHOH A 364 2187 705 2758 240 -239 -481 O HETATM 4402 O BHOH A 364 15.155 -3.170 9.605 0.36 13.52 O ANISOU 4402 O BHOH A 364 1528 1190 2417 -838 1503 2 O HETATM 4403 O HOH A 365 0.283 8.003 25.901 1.00 16.76 O ANISOU 4403 O HOH A 365 2487 2240 1642 571 422 445 O HETATM 4404 O HOH A 366 13.994 0.562 29.654 1.00 17.45 O ANISOU 4404 O HOH A 366 1613 1600 3419 -386 -441 1018 O HETATM 4405 O HOH A 367 0.992 -23.071 12.446 1.00 22.07 O ANISOU 4405 O HOH A 367 3487 2985 1916 -1976 -425 886 O HETATM 4406 O HOH A 368 -7.545 5.332 10.811 1.00 21.12 O ANISOU 4406 O HOH A 368 2225 2141 3658 445 -58 923 O HETATM 4407 O HOH A 369 9.869 -15.289 36.928 1.00 22.42 O ANISOU 4407 O HOH A 369 1909 3271 3339 1030 2048 921 O HETATM 4408 O HOH A 370 17.762 -19.786 26.401 1.00 24.88 O ANISOU 4408 O HOH A 370 2325 2472 4657 -690 -1857 1833 O HETATM 4409 O HOH A 371 -14.467 -3.541 33.461 1.00 22.90 O ANISOU 4409 O HOH A 371 3853 2159 2690 34 393 -949 O HETATM 4410 O HOH A 372 18.039 -4.835 36.259 1.00 18.86 O ANISOU 4410 O HOH A 372 4223 1299 1643 -892 -4 246 O HETATM 4411 O HOH A 373 -17.594 3.512 30.537 1.00 19.77 O ANISOU 4411 O HOH A 373 1987 2845 2682 556 642 1121 O HETATM 4412 O HOH A 374 -7.859 8.417 17.640 1.00 25.54 O ANISOU 4412 O HOH A 374 3487 1567 4649 1251 -1621 -541 O HETATM 4413 O AHOH A 375 7.171 9.808 26.749 0.48 11.59 O ANISOU 4413 O AHOH A 375 2208 870 1326 117 696 541 O HETATM 4414 O BHOH A 375 6.065 9.263 25.900 0.52 16.60 O ANISOU 4414 O BHOH A 375 2733 861 2714 964 299 339 O HETATM 4415 O HOH A 376 5.423 -0.294 34.928 1.00 23.07 O ANISOU 4415 O HOH A 376 5474 1850 1441 -212 1520 253 O HETATM 4416 O AHOH A 377 -4.586 -1.862 33.946 0.54 5.75 O ANISOU 4416 O AHOH A 377 1367 502 316 -48 269 351 O HETATM 4417 O BHOH A 377 -5.272 -2.843 34.188 0.46 8.96 O ANISOU 4417 O BHOH A 377 965 1379 1062 137 -225 154 O HETATM 4418 O HOH A 378 -14.033 -2.286 35.666 1.00 21.29 O ANISOU 4418 O HOH A 378 1437 3672 2979 181 1083 97 O HETATM 4419 O HOH A 379 8.893 -0.495 36.770 1.00 23.60 O ANISOU 4419 O HOH A 379 5118 2129 1722 169 383 -1391 O HETATM 4420 O HOH A 380 0.984 -22.438 24.806 1.00 20.40 O ANISOU 4420 O HOH A 380 1668 1888 4194 -166 491 -607 O HETATM 4421 O HOH A 381 6.504 -7.701 34.432 1.00 17.17 O ANISOU 4421 O HOH A 381 1336 1684 3503 154 247 140 O HETATM 4422 O HOH A 382 12.721 -20.383 30.191 1.00 16.06 O ANISOU 4422 O HOH A 382 1704 2836 1561 1635 362 717 O HETATM 4423 O HOH A 383 -9.458 -8.058 36.496 1.00 20.73 O ANISOU 4423 O HOH A 383 3106 2011 2760 -19 945 -2 O HETATM 4424 O HOH A 384 7.574 -21.843 36.275 1.00 21.32 O ANISOU 4424 O HOH A 384 2672 3468 1959 796 486 1084 O HETATM 4425 O AHOH A 385 -6.968 -14.312 3.103 0.54 13.84 O ANISOU 4425 O AHOH A 385 1614 2461 1182 3 -763 -633 O HETATM 4426 O BHOH A 385 -6.054 -14.879 3.774 0.46 16.30 O ANISOU 4426 O BHOH A 385 2120 2539 1535 -40 -64 217 O HETATM 4427 O HOH A 386 9.438 7.724 20.073 1.00 22.20 O ANISOU 4427 O HOH A 386 3700 2595 2139 -201 526 -592 O HETATM 4428 O HOH A 387 -11.182 -12.001 26.717 1.00 13.19 O ANISOU 4428 O HOH A 387 1309 1774 1931 -250 387 -6 O HETATM 4429 O HOH A 388 3.596 -13.947 -2.953 1.00 19.13 O ANISOU 4429 O HOH A 388 2521 2914 1833 -130 636 -776 O HETATM 4430 O HOH A 389 4.039 -24.863 28.344 1.00 22.31 O ANISOU 4430 O HOH A 389 3545 1985 2948 -644 -348 -293 O HETATM 4431 O HOH A 390 -12.129 -5.259 34.612 1.00 22.20 O ANISOU 4431 O HOH A 390 2276 3099 3061 -183 512 972 O HETATM 4432 O HOH A 391 15.340 -23.019 25.495 1.00 23.63 O ANISOU 4432 O HOH A 391 3793 2143 3041 443 934 1003 O HETATM 4433 O HOH A 392 19.264 -19.995 31.607 1.00 34.01 O ANISOU 4433 O HOH A 392 5474 3660 3789 1704 -1273 623 O HETATM 4434 O AHOH A 393 15.289 2.808 27.616 0.45 10.50 O ANISOU 4434 O AHOH A 393 699 1646 1643 535 345 -1085 O HETATM 4435 O BHOH A 393 15.434 2.279 26.345 0.55 24.20 O ANISOU 4435 O BHOH A 393 3006 3581 2606 429 353 -938 O HETATM 4436 O HOH A 394 -14.397 -14.707 18.548 1.00 21.40 O ANISOU 4436 O HOH A 394 2027 3586 2516 -582 -72 508 O HETATM 4437 O HOH A 395 -3.652 -10.154 -5.543 1.00 23.78 O ANISOU 4437 O HOH A 395 3971 3724 1343 428 -544 764 O HETATM 4438 O HOH A 396 8.545 -14.609 34.131 1.00 26.57 O ANISOU 4438 O HOH A 396 4141 4558 1397 -736 164 -531 O HETATM 4439 O HOH A 397 17.348 -19.700 29.736 1.00 29.51 O ANISOU 4439 O HOH A 397 4188 3214 3809 -732 -242 -775 O HETATM 4440 O HOH A 398 10.847 3.795 35.334 1.00 28.61 O ANISOU 4440 O HOH A 398 3889 3833 3147 123 -610 105 O HETATM 4441 O HOH A 399 1.245 -17.722 -0.188 1.00 22.21 O ANISOU 4441 O HOH A 399 3578 1755 3105 -167 -891 -652 O HETATM 4442 O HOH A 400 19.519 -14.424 10.411 1.00 29.36 O ANISOU 4442 O HOH A 400 2952 4770 3434 962 -1295 271 O HETATM 4443 O HOH A 401 -5.103 -13.415 -6.136 1.00 18.73 O ANISOU 4443 O HOH A 401 1635 3757 1722 60 -83 -93 O HETATM 4444 O HOH A 402 11.706 -2.783 3.790 1.00 23.45 O ANISOU 4444 O HOH A 402 3043 3272 2594 -196 990 422 O HETATM 4445 O HOH A 403 2.856 6.027 7.410 1.00 25.78 O ANISOU 4445 O HOH A 403 3768 3301 2725 -1034 179 633 O HETATM 4446 O HOH A 404 -6.491 -17.156 3.531 1.00 26.83 O ANISOU 4446 O HOH A 404 4909 3427 1858 346 612 -542 O HETATM 4447 O HOH A 405 17.620 -7.571 11.557 1.00 20.86 O ANISOU 4447 O HOH A 405 1662 2776 3488 -84 -390 -663 O HETATM 4448 O HOH A 406 19.357 -15.051 21.733 1.00 24.57 O ANISOU 4448 O HOH A 406 2650 2781 3906 -556 -429 1084 O HETATM 4449 O AHOH A 407 15.775 0.403 27.360 0.44 14.98 O ANISOU 4449 O AHOH A 407 1948 1109 2633 -71 1260 -31 O HETATM 4450 O BHOH A 407 15.397 -0.046 25.295 0.56 20.48 O ANISOU 4450 O BHOH A 407 2655 2085 3043 55 -658 1667 O HETATM 4451 O HOH A 408 16.319 -2.567 6.111 1.00 27.51 O ANISOU 4451 O HOH A 408 3437 2436 4580 786 1287 -963 O HETATM 4452 O HOH A 409 -2.664 -19.835 18.946 1.00 19.74 O ANISOU 4452 O HOH A 409 2517 2656 2328 195 534 789 O HETATM 4453 O HOH A 410 -14.358 -4.720 37.080 1.00 25.60 O ANISOU 4453 O HOH A 410 2954 1664 5108 -288 828 -753 O HETATM 4454 O AHOH A 411 1.497 -22.730 14.719 0.73 22.81 O ANISOU 4454 O AHOH A 411 3075 2247 3346 -701 888 80 O HETATM 4455 O BHOH A 411 2.103 -24.107 15.099 0.27 10.94 O ANISOU 4455 O BHOH A 411 804 1509 1845 -240 -247 -354 O HETATM 4456 O HOH A 412 5.155 -13.766 33.824 1.00 30.10 O ANISOU 4456 O HOH A 412 4783 1946 4706 -947 -604 494 O HETATM 4457 O HOH A 413 -2.733 -4.530 -0.846 1.00 26.59 O ANISOU 4457 O HOH A 413 4443 4093 1568 143 346 842 O HETATM 4458 O HOH A 414 4.572 1.997 6.323 1.00 33.75 O ANISOU 4458 O HOH A 414 4062 4329 4432 -421 -1176 1338 O HETATM 4459 O HOH A 415 8.352 -14.354 1.128 1.00 27.11 O ANISOU 4459 O HOH A 415 3402 3964 2937 22 329 -1096 O HETATM 4460 O HOH A 416 7.536 5.802 20.500 1.00 24.22 O ANISOU 4460 O HOH A 416 4119 2994 2091 -991 1102 -706 O HETATM 4461 O HOH A 417 3.801 -11.314 36.921 1.00 28.05 O ANISOU 4461 O HOH A 417 2344 4603 3711 -1369 -942 436 O HETATM 4462 O HOH A 418 -18.609 -3.078 19.535 1.00 24.09 O ANISOU 4462 O HOH A 418 1689 3464 3999 -208 114 -791 O HETATM 4463 O HOH A 419 7.659 -12.060 34.263 1.00 26.51 O ANISOU 4463 O HOH A 419 4574 3054 2443 879 -23 205 O HETATM 4464 O HOH A 420 5.130 6.767 32.639 1.00 21.90 O ANISOU 4464 O HOH A 420 2303 3290 2728 352 -413 -1433 O HETATM 4465 O HOH A 421 23.342 0.321 29.376 1.00 31.95 O ANISOU 4465 O HOH A 421 4569 4650 2920 -1800 -286 863 O HETATM 4466 O AHOH A 422 3.414 -4.732 2.939 0.56 19.65 O ANISOU 4466 O AHOH A 422 3582 2966 918 -721 105 942 O HETATM 4467 O BHOH A 422 1.626 -5.022 2.841 0.44 19.72 O ANISOU 4467 O BHOH A 422 3109 1493 2892 736 58 1008 O HETATM 4468 O HOH A 423 12.033 -7.842 1.861 1.00 23.50 O ANISOU 4468 O HOH A 423 3143 4005 1783 -455 748 746 O HETATM 4469 O HOH A 424 4.398 2.910 34.989 1.00 26.66 O ANISOU 4469 O HOH A 424 3474 5090 1565 1504 -1459 -642 O HETATM 4470 O HOH A 425 -18.062 -3.228 27.252 1.00 31.74 O ANISOU 4470 O HOH A 425 4148 4732 3178 -1131 3 -349 O HETATM 4471 O HOH A 426 -7.325 -19.059 18.106 1.00 27.83 O ANISOU 4471 O HOH A 426 3646 2990 3938 -1355 721 184 O HETATM 4472 O HOH A 427 -8.974 -17.217 17.919 1.00 27.83 O ANISOU 4472 O HOH A 427 4108 3649 2816 967 -201 281 O HETATM 4473 O HOH A 428 22.521 -5.698 27.600 1.00 26.67 O ANISOU 4473 O HOH A 428 3453 3336 3346 -116 1855 -614 O HETATM 4474 O HOH A 429 -5.664 7.568 27.145 1.00 26.79 O ANISOU 4474 O HOH A 429 4699 2538 2943 -953 -903 138 O HETATM 4475 O HOH A 430 12.779 -12.215 40.175 1.00 29.64 O ANISOU 4475 O HOH A 430 5271 3683 2308 1108 -726 -115 O HETATM 4476 O HOH A 431 -3.359 8.037 22.210 1.00 26.05 O ANISOU 4476 O HOH A 431 3676 1896 4327 -526 -300 1019 O HETATM 4477 O HOH A 432 6.178 -3.324 4.668 1.00 28.90 O ANISOU 4477 O HOH A 432 4498 4816 1667 830 1475 1 O HETATM 4478 O AHOH A 433 -2.659 2.400 3.568 0.56 22.08 O ANISOU 4478 O AHOH A 433 3104 3541 1743 542 131 401 O HETATM 4479 O BHOH A 433 -2.476 0.974 2.293 0.44 22.34 O ANISOU 4479 O BHOH A 433 3800 2601 2086 -198 -108 662 O HETATM 4480 O HOH A 434 3.841 9.043 30.622 1.00 41.96 O ANISOU 4480 O HOH A 434 5821 4612 5510 -691 590 60 O HETATM 4481 O HOH A 435 3.698 5.443 38.249 1.00 49.96 O ANISOU 4481 O HOH A 435 6597 6376 6009 -522 -459 347 O HETATM 4482 O HOH A 436 1.637 1.591 -0.753 1.00 31.85 O ANISOU 4482 O HOH A 436 6236 3763 2104 809 747 1679 O HETATM 4483 O AHOH A 437 10.983 -4.254 36.991 0.50 16.26 O ANISOU 4483 O AHOH A 437 2378 2057 1741 1013 -284 -180 O HETATM 4484 O BHOH A 437 10.566 -6.238 36.539 0.50 21.84 O ANISOU 4484 O BHOH A 437 2779 3456 2064 957 -880 -679 O HETATM 4485 O HOH A 438 -19.517 4.476 21.551 1.00 41.28 O ANISOU 4485 O HOH A 438 4570 5479 5634 1757 484 429 O HETATM 4486 O HOH A 439 -13.556 6.019 10.541 1.00 42.76 O ANISOU 4486 O HOH A 439 5508 4830 5907 -101 -613 498 O HETATM 4487 O HOH A 440 -2.488 -7.370 -0.708 1.00 30.57 O ANISOU 4487 O HOH A 440 3855 5343 2416 -125 1330 669 O HETATM 4488 O HOH A 441 6.512 1.209 2.152 1.00 29.44 O ANISOU 4488 O HOH A 441 4040 3426 3719 -142 -2305 166 O HETATM 4489 O HOH A 442 8.512 1.958 35.745 1.00 31.16 O ANISOU 4489 O HOH A 442 5044 3602 3192 -20 -1153 43 O HETATM 4490 O HOH A 443 22.309 -12.239 6.953 1.00 31.65 O ANISOU 4490 O HOH A 443 3677 4502 3846 1584 -291 -878 O HETATM 4491 O HOH A 444 -8.678 -20.840 11.652 1.00 33.97 O ANISOU 4491 O HOH A 444 2413 4649 5845 -585 1016 684 O HETATM 4492 O HOH A 445 -3.440 3.862 7.134 1.00 32.77 O ANISOU 4492 O HOH A 445 4912 3240 4298 536 1099 1566 O HETATM 4493 O HOH A 446 2.421 -25.486 12.028 1.00 32.64 O ANISOU 4493 O HOH A 446 3595 3592 5215 -249 466 -128 O HETATM 4494 O HOH A 447 7.226 -9.550 1.153 1.00 32.70 O ANISOU 4494 O HOH A 447 5628 3173 3623 -338 -1114 730 O HETATM 4495 O HOH A 448 4.818 2.802 3.692 1.00 27.86 O ANISOU 4495 O HOH A 448 4069 2841 3677 78 93 972 O HETATM 4496 O HOH A 449 2.618 -23.959 18.419 1.00 35.07 O ANISOU 4496 O HOH A 449 4254 3784 5288 -1702 711 -18 O HETATM 4497 O HOH A 450 -7.673 7.652 12.342 1.00 40.31 O ANISOU 4497 O HOH A 450 5153 4753 5412 161 359 -121 O HETATM 4498 O HOH A 451 21.311 -13.448 30.605 1.00 36.70 O ANISOU 4498 O HOH A 451 4702 3754 5488 -511 -1402 -1276 O HETATM 4499 O HOH A 452 -16.472 -12.951 19.218 1.00 28.81 O ANISOU 4499 O HOH A 452 1612 5558 3777 -643 732 592 O HETATM 4500 O HOH A 453 10.149 -24.558 28.286 1.00 29.28 O ANISOU 4500 O HOH A 453 3685 2655 4786 1508 1123 -489 O HETATM 4501 O HOH A 454 16.220 -23.968 20.383 1.00 33.80 O ANISOU 4501 O HOH A 454 3626 4178 5038 502 414 -477 O HETATM 4502 O HOH A 455 -12.447 -16.781 20.240 1.00 50.24 O ANISOU 4502 O HOH A 455 6181 5958 6949 28 506 937 O HETATM 4503 O HOH A 456 10.186 10.309 27.660 1.00 30.03 O ANISOU 4503 O HOH A 456 5128 2272 4011 1107 -1168 725 O HETATM 4504 O HOH A 457 7.113 5.185 33.893 1.00 33.20 O ANISOU 4504 O HOH A 457 3881 3601 5133 1093 1657 -675 O HETATM 4505 O HOH A 458 5.779 -24.441 8.313 1.00 26.23 O ANISOU 4505 O HOH A 458 3264 2790 3910 859 505 -1010 O HETATM 4506 O HOH A 459 -1.441 12.622 17.188 1.00 46.28 O ANISOU 4506 O HOH A 459 6433 4992 6158 1063 113 -326 O HETATM 4507 O HOH A 460 -15.676 0.061 7.931 1.00 30.16 O ANISOU 4507 O HOH A 460 3482 4807 3172 -793 -792 2722 O HETATM 4508 O HOH A 461 -6.813 3.637 4.876 1.00 38.96 O ANISOU 4508 O HOH A 461 4840 4865 5097 86 856 1334 O HETATM 4509 O HOH A 462 -13.984 9.696 21.037 1.00 44.95 O ANISOU 4509 O HOH A 462 5588 5464 6029 165 -209 -98 O HETATM 4510 O HOH A 463 1.527 -8.918 37.353 1.00 32.77 O ANISOU 4510 O HOH A 463 4118 4780 3554 -184 -1005 953 O HETATM 4511 O HOH A 464 7.087 7.276 35.918 1.00 44.26 O ANISOU 4511 O HOH A 464 5959 5186 5672 172 -636 -28 O HETATM 4512 O HOH E 59 13.589 1.768 17.476 1.00 6.65 O ANISOU 4512 O HOH E 59 1049 849 630 241 350 249 O HETATM 4513 O HOH E 60 21.887 8.075 13.311 1.00 14.93 O ANISOU 4513 O HOH E 60 2136 1280 2256 654 453 355 O HETATM 4514 O HOH E 61 19.395 7.410 12.498 1.00 10.37 O ANISOU 4514 O HOH E 61 1108 959 1872 168 363 518 O HETATM 4515 O HOH E 62 11.908 15.248 9.857 1.00 12.35 O ANISOU 4515 O HOH E 62 1691 1208 1792 -186 293 -44 O HETATM 4516 O HOH E 63 17.385 6.807 14.330 1.00 9.13 O ANISOU 4516 O HOH E 63 1274 1161 1035 272 166 -17 O HETATM 4517 O HOH E 73 17.064 -0.178 7.145 1.00 19.46 O ANISOU 4517 O HOH E 73 1927 1217 4248 693 1082 201 O HETATM 4518 O HOH E 74 8.205 16.393 6.952 1.00 13.33 O ANISOU 4518 O HOH E 74 1341 1952 1772 560 378 -629 O HETATM 4519 O HOH E 86 20.618 0.394 12.665 1.00 24.50 O ANISOU 4519 O HOH E 86 1605 1931 5774 726 1075 11 O HETATM 4520 O HOH E 89 19.194 6.520 21.072 1.00 31.48 O ANISOU 4520 O HOH E 89 2768 5040 4152 -393 347 -937 O HETATM 4521 O HOH E 96 22.263 11.595 17.378 1.00 20.65 O ANISOU 4521 O HOH E 96 3205 1955 2685 -866 -683 49 O HETATM 4522 O HOH E 97 13.816 17.862 10.473 1.00 20.43 O ANISOU 4522 O HOH E 97 1621 3881 2260 693 233 -1271 O HETATM 4523 O HOH E 98 16.933 24.829 2.439 1.00 22.39 O ANISOU 4523 O HOH E 98 2681 2263 3564 275 992 474 O HETATM 4524 O HOH E 112 17.175 15.432 13.909 1.00 23.21 O ANISOU 4524 O HOH E 112 3440 2151 3229 21 -81 -932 O HETATM 4525 O HOH E 114 17.882 21.942 10.240 1.00 18.32 O ANISOU 4525 O HOH E 114 2487 2173 2302 1009 934 -253 O HETATM 4526 O HOH E 125 9.987 12.567 1.067 1.00 25.47 O ANISOU 4526 O HOH E 125 3777 4152 1750 -1763 -153 -778 O HETATM 4527 O HOH E 126 10.225 15.372 0.619 1.00 19.88 O ANISOU 4527 O HOH E 126 2422 3495 1636 -949 -486 698 O HETATM 4528 O HOH E 127 6.609 0.015 6.638 1.00 19.98 O ANISOU 4528 O HOH E 127 3059 1832 2699 -503 1334 455 O HETATM 4529 O HOH E 130 6.160 3.922 7.578 1.00 30.49 O ANISOU 4529 O HOH E 130 3619 4251 3715 -347 -1264 926 O HETATM 4530 O HOH E 135 11.336 14.739 12.448 1.00 25.66 O ANISOU 4530 O HOH E 135 3596 1818 4335 119 -775 -705 O HETATM 4531 O HOH E 136 17.669 -3.216 16.792 1.00 23.97 O ANISOU 4531 O HOH E 136 2462 1997 4647 840 -295 -1579 O HETATM 4532 O HOH E 137 10.325 8.223 17.559 1.00 23.73 O ANISOU 4532 O HOH E 137 3942 2847 2225 1496 203 -355 O HETATM 4533 O HOH E 156 7.001 8.567 10.160 1.00 23.47 O ANISOU 4533 O HOH E 156 3435 2183 3299 282 392 323 O HETATM 4534 O HOH E 158 19.861 -0.251 15.436 1.00 23.29 O ANISOU 4534 O HOH E 158 2285 3187 3377 325 -17 609 O HETATM 4535 O HOH E 159 19.356 24.037 3.587 1.00 24.40 O ANISOU 4535 O HOH E 159 2766 3078 3427 580 680 -751 O HETATM 4536 O AHOH E 165 26.331 9.609 6.807 0.45 13.53 O ANISOU 4536 O AHOH E 165 2414 2208 519 236 721 -437 O HETATM 4537 O BHOH E 165 25.462 7.971 7.066 0.55 22.95 O ANISOU 4537 O BHOH E 165 3657 2475 2587 749 349 -297 O HETATM 4538 O HOH E 172 8.394 17.524 4.331 1.00 30.61 O ANISOU 4538 O HOH E 172 3743 4137 3749 1367 800 1266 O HETATM 4539 O HOH E 173 24.170 4.867 14.407 1.00 28.09 O ANISOU 4539 O HOH E 173 2774 3744 4154 1146 232 2167 O HETATM 4540 O HOH E 177 14.861 19.719 8.625 1.00 29.67 O ANISOU 4540 O HOH E 177 4105 4125 3041 -1965 1092 -1241 O HETATM 4541 O HOH E 191 27.686 20.386 13.970 1.00 30.82 O ANISOU 4541 O HOH E 191 4347 3310 4053 -516 834 -166 O HETATM 4542 O HOH E 192 12.500 11.463 14.871 1.00 37.87 O ANISOU 4542 O HOH E 192 5646 4295 4448 1045 -570 -617 O HETATM 4543 O HOH E 196 15.417 12.369 14.920 1.00 33.03 O ANISOU 4543 O HOH E 196 3693 3860 4998 -172 1264 462 O HETATM 4544 O HOH E 197 14.855 15.636 12.533 1.00 41.78 O ANISOU 4544 O HOH E 197 5360 5938 4578 737 455 -274 O HETATM 4545 O HOH E 200 26.581 3.836 -0.058 1.00 40.75 O ANISOU 4545 O HOH E 200 5271 4446 5765 -716 464 250 O HETATM 4546 O HOH E 204 6.817 10.394 7.226 1.00 35.68 O ANISOU 4546 O HOH E 204 4795 3806 4954 -1170 659 762 O HETATM 4547 O HOH E 205 29.860 12.106 -0.581 1.00 40.50 O ANISOU 4547 O HOH E 205 5193 5871 4325 -39 470 256 O HETATM 4548 O HOH E 210 18.539 3.024 22.292 1.00 41.20 O ANISOU 4548 O HOH E 210 4131 5893 5631 436 -1010 -233 O HETATM 4549 O HOH E 214 24.567 2.679 18.449 1.00 42.12 O ANISOU 4549 O HOH E 214 4246 5553 6206 210 -305 304 O HETATM 4550 O HOH E 215 15.048 20.638 1.407 1.00 32.55 O ANISOU 4550 O HOH E 215 4375 4369 3624 -566 339 809 O HETATM 4551 O HOH E 217 25.734 7.266 19.252 1.00 56.52 O ANISOU 4551 O HOH E 217 6571 7387 7519 -507 -260 -280 O HETATM 4552 O HOH E 239 32.542 8.928 -0.997 1.00 35.35 O ANISOU 4552 O HOH E 239 4951 4961 3517 -1409 186 714 O HETATM 4553 O HOH E 244 7.842 6.604 15.666 1.00 41.07 O ANISOU 4553 O HOH E 244 5478 4748 5377 324 312 287 O HETATM 4554 O HOH E 248 12.770 9.208 19.464 1.00 40.27 O ANISOU 4554 O HOH E 248 5374 5137 4791 -646 431 -321 O HETATM 4555 O HOH E 251 21.008 2.984 1.988 1.00 37.03 O ANISOU 4555 O HOH E 251 5595 3925 4552 -288 -73 -814 O HETATM 4556 O HOH E 252 15.373 9.757 20.642 1.00 32.85 O ANISOU 4556 O HOH E 252 4328 4190 3964 -1879 2787 -1545 O HETATM 4557 O HOH E 255 6.833 12.307 4.520 1.00 30.51 O ANISOU 4557 O HOH E 255 3937 3251 4404 546 -146 -704 O HETATM 4558 O HOH E 262 28.892 14.221 2.338 1.00 35.63 O ANISOU 4558 O HOH E 262 4093 4396 5050 -1924 1042 617 O HETATM 4559 O HOH E 267 24.162 2.761 -1.178 1.00 41.48 O ANISOU 4559 O HOH E 267 5296 5554 4910 -381 1432 -337 O HETATM 4560 O HOH E 273 23.880 8.632 20.706 1.00 49.62 O ANISOU 4560 O HOH E 273 6432 6216 6208 -702 260 -432 O HETATM 4561 O HOH E 274 6.078 8.626 12.758 1.00 40.68 O ANISOU 4561 O HOH E 274 4468 5534 5453 -884 -883 -90 O HETATM 4562 O HOH E 276 12.896 20.924 8.131 1.00 38.32 O ANISOU 4562 O HOH E 276 5067 4390 5103 -747 1047 92 O HETATM 4563 O HOH E 280 24.858 1.636 15.957 1.00 36.34 O ANISOU 4563 O HOH E 280 3453 5153 5202 2448 267 50 O HETATM 4564 O HOH E 285 19.976 14.880 -0.138 1.00 31.59 O ANISOU 4564 O HOH E 285 4180 4768 3053 -153 1510 1764 O HETATM 4565 O HOH E 304 25.279 21.540 15.233 1.00 44.84 O ANISOU 4565 O HOH E 304 6094 4618 6325 -852 81 -744 O HETATM 4566 O HOH E 311 21.913 21.938 3.384 1.00 52.59 O ANISOU 4566 O HOH E 311 7099 6214 6667 215 1856 -99 O HETATM 4567 O HOH E 315 22.445 20.763 15.330 1.00 42.41 O ANISOU 4567 O HOH E 315 5795 4847 5473 -21 461 -102 O HETATM 4568 O HOH E 317 20.950 21.367 13.037 1.00 32.37 O ANISOU 4568 O HOH E 317 2536 4631 5133 10 1152 -966 O HETATM 4569 O HOH E 319 10.916 9.943 15.863 1.00 40.72 O ANISOU 4569 O HOH E 319 5552 4858 5062 679 -338 -491 O HETATM 4570 O HOH E 325 8.429 8.975 16.005 1.00 41.06 O ANISOU 4570 O HOH E 325 5912 4847 4841 32 -435 -421 O HETATM 4571 O HOH E 327 24.199 1.581 11.004 1.00 33.38 O ANISOU 4571 O HOH E 327 4425 3312 4945 130 869 -270 O HETATM 4572 O HOH E 335 7.053 12.563 1.952 1.00 33.03 O ANISOU 4572 O HOH E 335 4185 4209 4156 656 736 845 O HETATM 4573 O HOH E 339 12.550 12.587 12.869 1.00 35.03 O ANISOU 4573 O HOH E 339 5060 3694 4558 -494 612 82 O HETATM 4574 O HOH E 343 16.585 5.538 -0.650 1.00 32.46 O ANISOU 4574 O HOH E 343 4995 3938 3401 -127 -209 -1956 O HETATM 4575 O HOH E 347 29.941 20.598 6.960 1.00 33.62 O ANISOU 4575 O HOH E 347 4487 4017 4270 -114 112 -1767 O CONECT 89 2076 CONECT 350 572 CONECT 572 350 CONECT 767 4265 CONECT 794 4265 CONECT 849 4265 CONECT 889 4265 CONECT 925 4265 CONECT 1769 2728 CONECT 2076 89 CONECT 2237 2449 CONECT 2449 2237 CONECT 2595 2923 CONECT 2728 1769 CONECT 2923 2595 CONECT 3458 4234 CONECT 3586 3955 CONECT 3843 4169 CONECT 3955 3586 CONECT 4169 3843 CONECT 4234 3458 CONECT 4265 767 794 849 889 CONECT 4265 925 4306 CONECT 4306 4265 MASTER 277 0 1 5 16 0 2 6 2450 2 24 23 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
3p92
Complex Type
Protein-Protein
PDBbind Subset
general set
Protein Name
Human mesotrypsin
Ligand Name
bovine pancreatic trypsin inhibitor variant (BPTI-K15R/R17G)
EC.Number
E.C.3.4.21.4
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
Ki=5.9nM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) Biochem.J. Vol. 440: pp. 95-105
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00974
P35030
Entrez Gene ID
NCBI Entrez Gene ID:
5646
ASD
Information of known allosteric effects of PDB entries
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