Browse entries in the PDBbind-CN Database
HEADER HYDROLASE/HYDROLASE INHIBITOR 28-JUN-00 1F7Z TITLE RAT TRYPSINOGEN K15A COMPLEXED WITH BOVINE PANCREATIC TITLE 2 TRYPSIN INHIBITOR COMPND MOL_ID: 1; COMPND 2 MOLECULE: TRYPSIN II, ANIONIC; 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: I; COMPND 10 SYNONYM: BPTI SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; SOURCE 3 ORGANISM_COMMON: NORWAY RAT; SOURCE 4 ORGANISM_TAXID: 10116; SOURCE 5 EXPRESSION_SYSTEM: SACCHAROMYCES CEREVISIAE; SOURCE 6 EXPRESSION_SYSTEM_COMMON: BAKER'S YEAST; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 4932; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PYT; SOURCE 10 MOL_ID: 2; SOURCE 11 ORGANISM_SCIENTIFIC: BOS TAURUS; SOURCE 12 ORGANISM_COMMON: CATTLE; SOURCE 13 ORGANISM_TAXID: 9913; SOURCE 14 TISSUE: PANCREAS KEYWDS SERINE PROTEASE, TRYPSIN PRECURSOR, HYDROLASE/HYDROLASE KEYWDS 2 INHIBITOR COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR A.PASTERNAK,A.WHITE,C.J.JEFFERY,N.MEDINA,M.CAHOON,D.RINGE, AUTHOR 2 L.HEDSTROM REVDAT 2 24-FEB-09 1F7Z 1 VERSN REVDAT 1 04-JUL-01 1F7Z 0 JRNL AUTH A.PASTERNAK,A.WHITE,C.J.JEFFERY,N.MEDINA,M.CAHOON, JRNL AUTH 2 D.RINGE,L.HEDSTROM JRNL TITL THE ENERGETIC COST OF INDUCED FIT CATALYSIS: JRNL TITL 2 CRYSTAL STRUCTURES OF TRYPSINOGEN MUTANTS WITH JRNL TITL 3 ENHANCED ACTIVITY AND INHIBITOR AFFINITY. JRNL REF PROTEIN SCI. V. 10 1331 2001 JRNL REFN ISSN 0961-8368 JRNL PMID 11420435 JRNL DOI 10.1110/PS.44101 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 1.55 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU, REMARK 3 : READ,RICE,SIMONSON,WARREN REMARK 3 REMARK 3 REFINEMENT TARGET : CNS REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.55 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 30.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 98.1 REMARK 3 NUMBER OF REFLECTIONS : 44058 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : NULL REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING SET) : 0.199 REMARK 3 FREE R VALUE : 0.209 REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 FREE R VALUE TEST SET COUNT : 4305 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : NULL REMARK 3 BIN RESOLUTION RANGE HIGH (A) : NULL REMARK 3 BIN RESOLUTION RANGE LOW (A) : NULL REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 REFLECTIONS IN BIN (WORKING SET) : NULL REMARK 3 BIN R VALUE (WORKING SET) : NULL REMARK 3 BIN FREE R VALUE : NULL REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2039 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 11 REMARK 3 SOLVENT ATOMS : 153 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM SIGMAA (A) : NULL REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM C-V SIGMAA (A) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : NULL REMARK 3 BOND ANGLES (DEGREES) : NULL REMARK 3 DIHEDRAL ANGLES (DEGREES) : NULL REMARK 3 IMPROPER ANGLES (DEGREES) : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : NULL REMARK 3 KSOL : NULL REMARK 3 BSOL : NULL REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : NULL REMARK 3 TOPOLOGY FILE 1 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1F7Z COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 07-JUL-00. REMARK 100 THE RCSB ID CODE IS RCSB011354. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 24-JUN-99 REMARK 200 TEMPERATURE (KELVIN) : 277 REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : RIGAKU RU300 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : RIGAKU RAXIS IV REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 44058 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.550 REMARK 200 RESOLUTION RANGE LOW (A) : 35.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 95.7 REMARK 200 DATA REDUNDANCY : 4.000 REMARK 200 R MERGE (I) : 0.05600 REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 31.5000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.55 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.61 REMARK 200 COMPLETENESS FOR SHELL (%) : 89.5 REMARK 200 DATA REDUNDANCY IN SHELL : 2.40 REMARK 200 R MERGE FOR SHELL (I) : 0.03600 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: NULL REMARK 200 SOFTWARE USED: CNS REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 48.48 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.39 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: NULL REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 32 2 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+2/3 REMARK 290 3555 -X+Y,-X,Z+1/3 REMARK 290 4555 Y,X,-Z REMARK 290 5555 X-Y,-Y,-Z+1/3 REMARK 290 6555 -X,-X+Y,-Z+2/3 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 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 41.38400 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 20.69200 REMARK 290 SMTRY1 4 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 4 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 5 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 20.69200 REMARK 290 SMTRY1 6 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 41.38400 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 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 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 1750 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 11650 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -47.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, I 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 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLU A 6 REMARK 465 ALA A 7 REMARK 465 PHE A 8 REMARK 465 PRO A 9 REMARK 465 VAL A 10 REMARK 465 ASP A 11 REMARK 465 ASP A 12 REMARK 465 ASP A 13 REMARK 465 ASP A 14 REMARK 465 ALA A 15 REMARK 465 ASN A 143 REMARK 465 THR A 144 REMARK 465 LEU A 145 REMARK 465 SER A 146 REMARK 465 SER A 147 REMARK 465 GLY A 148 REMARK 465 VAL A 149 REMARK 465 ASN A 150 REMARK 465 GLU A 151 REMARK 465 PRO A 152 REMARK 465 GLY I 57 REMARK 465 ALA I 58 REMARK 465 ILE I 59 REMARK 465 GLY I 60 REMARK 465 PRO I 61 REMARK 465 TRP I 62 REMARK 465 GLU I 63 REMARK 465 ASN I 64 REMARK 465 LEU I 65 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS(M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 SER A 195 OG REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O HOH A 570 O HOH A 610 0.70 REMARK 500 N ASP A 153 O HOH A 613 1.72 REMARK 500 REMARK 500 REMARK: NULL 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 HIS A 71 -64.15 -132.68 REMARK 500 SER A 214 -69.10 -124.54 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 800 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 ASN A 72 O REMARK 620 2 VAL A 75 O 84.2 REMARK 620 3 GLU A 70 OE1 89.3 165.1 REMARK 620 4 HOH A 570 O 101.0 84.3 83.8 REMARK 620 5 HOH A 610 O 104.4 86.3 82.3 3.8 REMARK 620 6 GLU A 80 OE2 159.4 84.1 105.7 94.7 91.7 REMARK 620 7 GLU A 77 OE1 82.0 96.8 95.5 176.9 173.1 82.6 REMARK 620 N 1 2 3 4 5 6 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 I 990 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 I 991 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 800 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3TGI RELATED DB: PDB REMARK 900 3TGI CONTAINS WILD-TYPE RAT ANIONIC TRYPSIN COMPLEXED WITH REMARK 900 BOVINE PANCREATIC TRYPSIN INHIBITOR (BPTI) REMARK 900 RELATED ID: 1F5R RELATED DB: PDB REMARK 900 1F5R CONTAINS MUTANT RAT ANIONIC TRYPSIN COMPLEXED WITH REMARK 900 BOVINE PANCREATIC TRYPSIN INHIBITOR (BPTI) DBREF 1F7Z A 7 245 UNP P00763 TRY2_RAT 15 246 DBREF 1F7Z I 1 65 UNP P00974 BPT1_BOVIN 36 100 SEQADV 1F7Z GLU A 6 UNP P00763 CLONING ARTIFACT SEQADV 1F7Z ALA A 15 UNP P00763 LYS 23 ENGINEERED SEQRES 1 A 233 GLU ALA PHE PRO VAL ASP ASP ASP ASP ALA ILE VAL GLY SEQRES 2 A 233 GLY TYR THR CYS GLN GLU ASN SER VAL PRO TYR GLN VAL SEQRES 3 A 233 SER LEU ASN SER GLY TYR HIS PHE CYS GLY GLY SER LEU SEQRES 4 A 233 ILE ASN ASP GLN TRP VAL VAL SER ALA ALA HIS CYS TYR SEQRES 5 A 233 LYS SER ARG ILE GLN VAL ARG LEU GLY GLU HIS ASN ILE SEQRES 6 A 233 ASN VAL LEU GLU GLY ASN GLU GLN PHE VAL ASN ALA ALA SEQRES 7 A 233 LYS ILE ILE LYS HIS PRO ASN PHE ASP ARG LYS THR LEU SEQRES 8 A 233 ASN ASN ASP ILE MET LEU ILE LYS LEU SER SER PRO VAL SEQRES 9 A 233 LYS LEU ASN ALA ARG VAL ALA THR VAL ALA LEU PRO SER SEQRES 10 A 233 SER CYS ALA PRO ALA GLY THR GLN CYS LEU ILE SER GLY SEQRES 11 A 233 TRP GLY ASN THR LEU SER SER GLY VAL ASN GLU PRO ASP SEQRES 12 A 233 LEU LEU GLN CYS LEU ASP ALA PRO LEU LEU PRO GLN ALA SEQRES 13 A 233 ASP CYS GLU ALA SER TYR PRO GLY LYS ILE THR ASP ASN SEQRES 14 A 233 MET VAL CYS VAL GLY PHE LEU GLU GLY GLY LYS ASP SER SEQRES 15 A 233 CYS GLN GLY ASP SER GLY GLY PRO VAL VAL CYS ASN GLY SEQRES 16 A 233 GLU LEU GLN GLY ILE VAL SER TRP GLY TYR GLY CYS ALA SEQRES 17 A 233 LEU PRO ASP ASN PRO GLY VAL TYR THR LYS VAL CYS ASN SEQRES 18 A 233 TYR VAL ASP TRP ILE GLN ASP THR ILE ALA ALA ASN SEQRES 1 I 65 ARG PRO ASP PHE CYS LEU GLU PRO PRO TYR THR GLY PRO SEQRES 2 I 65 CYS LYS ALA ARG ILE ILE ARG TYR PHE TYR ASN ALA LYS SEQRES 3 I 65 ALA GLY LEU CYS GLN THR PHE VAL TYR GLY GLY CYS ARG SEQRES 4 I 65 ALA LYS ARG ASN ASN PHE LYS SER ALA GLU ASP CYS MET SEQRES 5 I 65 ARG THR CYS GLY GLY ALA ILE GLY PRO TRP GLU ASN LEU HET SO4 I 990 5 HET SO4 I 991 5 HET CA A 800 1 HETNAM SO4 SULFATE ION HETNAM CA CALCIUM ION FORMUL 3 SO4 2(O4 S 2-) FORMUL 5 CA CA 2+ FORMUL 6 HOH *153(H2 O) HELIX 1 1 ALA A 55 TYR A 59 5 5 HELIX 2 2 PRO A 164 TYR A 172 1 9 HELIX 3 3 TYR A 234 ALA A 244 1 11 HELIX 4 4 PRO I 2 GLU I 7 5 6 HELIX 5 5 SER I 47 GLY I 56 1 10 SHEET 1 A 7 TYR A 20 THR A 21 0 SHEET 2 A 7 GLN A 156 PRO A 161 -1 N CYS A 157 O TYR A 20 SHEET 3 A 7 GLN A 135 GLY A 140 -1 N CYS A 136 O ALA A 160 SHEET 4 A 7 PRO A 198 CYS A 201 -1 O PRO A 198 N SER A 139 SHEET 5 A 7 GLU A 204 TRP A 215 -1 O GLU A 204 N CYS A 201 SHEET 6 A 7 GLY A 226 LYS A 230 -1 N VAL A 227 O TRP A 215 SHEET 7 A 7 MET A 180 VAL A 183 -1 O VAL A 181 N TYR A 228 SHEET 1 B 7 GLN A 30 ASN A 34 0 SHEET 2 B 7 HIS A 40 ASN A 48 -1 N PHE A 41 O LEU A 33 SHEET 3 B 7 TRP A 51 SER A 54 -1 O TRP A 51 N ILE A 47 SHEET 4 B 7 MET A 104 LEU A 108 -1 O MET A 104 N SER A 54 SHEET 5 B 7 GLN A 81 LYS A 90 -1 N ALA A 86 O LYS A 107 SHEET 6 B 7 GLN A 64 LEU A 68 -1 N VAL A 66 O VAL A 83 SHEET 7 B 7 GLN A 30 ASN A 34 -1 O SER A 32 N ARG A 67 SHEET 1 C 2 ILE I 18 ASN I 24 0 SHEET 2 C 2 LEU I 29 TYR I 35 -1 O LEU I 29 N ASN I 24 SSBOND 1 CYS A 22 CYS A 157 1555 1555 2.03 SSBOND 2 CYS A 42 CYS A 58 1555 1555 2.03 SSBOND 3 CYS A 128 CYS A 232 1555 1555 2.03 SSBOND 4 CYS A 136 CYS A 201 1555 1555 2.03 SSBOND 5 CYS A 168 CYS A 182 1555 1555 2.03 SSBOND 6 CYS A 191 CYS A 220 1555 1555 2.03 SSBOND 7 CYS I 5 CYS I 55 1555 1555 2.03 SSBOND 8 CYS I 14 CYS I 38 1555 1555 2.03 SSBOND 9 CYS I 30 CYS I 51 1555 1555 2.03 LINK CA CA A 800 O ASN A 72 1555 1555 2.38 LINK CA CA A 800 O VAL A 75 1555 1555 2.33 LINK CA CA A 800 OE1 GLU A 70 1555 1555 2.18 LINK CA CA A 800 O HOH A 570 1555 1555 1.67 LINK CA CA A 800 O HOH A 610 1555 1555 2.35 LINK CA CA A 800 OE2 GLU A 80 1555 1555 2.35 LINK CA CA A 800 OE1 GLU A 77 1555 1555 2.43 SITE 1 AC1 2 ARG I 42 HOH I 615 SITE 1 AC2 3 ARG I 20 TYR I 35 HOH I 650 SITE 1 AC3 7 GLU A 70 ASN A 72 VAL A 75 GLU A 77 SITE 2 AC3 7 GLU A 80 HOH A 570 HOH A 610 CRYST1 92.696 92.696 62.076 90.00 90.00 120.00 P 32 2 1 6 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 0.010788 0.006228 -0.000001 0.00000 SCALE2 0.000000 0.012457 -0.000001 0.00000 SCALE3 0.000000 0.000000 0.016109 0.00000 ATOM 1 N ILE A 16 -19.471 -85.423 -2.820 1.00 37.89 N ATOM 2 CA ILE A 16 -19.543 -84.961 -1.404 1.00 37.69 C ATOM 3 C ILE A 16 -20.883 -84.299 -1.105 1.00 37.42 C ATOM 4 O ILE A 16 -21.273 -83.330 -1.762 1.00 38.04 O ATOM 5 CB ILE A 16 -18.415 -83.947 -1.082 1.00 37.93 C ATOM 6 CG1 ILE A 16 -17.047 -84.585 -1.336 1.00 38.20 C ATOM 7 CG2 ILE A 16 -18.527 -83.477 0.369 1.00 37.82 C ATOM 8 CD1 ILE A 16 -16.757 -85.798 -0.465 1.00 38.32 C ATOM 9 N VAL A 17 -21.586 -84.835 -0.112 1.00 36.77 N ATOM 10 CA VAL A 17 -22.879 -84.301 0.299 1.00 35.92 C ATOM 11 C VAL A 17 -22.723 -83.686 1.684 1.00 34.97 C ATOM 12 O VAL A 17 -22.010 -84.228 2.530 1.00 35.15 O ATOM 13 CB VAL A 17 -23.956 -85.411 0.368 1.00 36.09 C ATOM 14 CG1 VAL A 17 -25.297 -84.811 0.775 1.00 36.26 C ATOM 15 CG2 VAL A 17 -24.074 -86.110 -0.975 1.00 36.30 C ATOM 16 N GLY A 18 -23.386 -82.554 1.909 1.00 33.74 N ATOM 17 CA GLY A 18 -23.299 -81.891 3.198 1.00 31.95 C ATOM 18 C GLY A 18 -21.902 -81.388 3.507 1.00 30.49 C ATOM 19 O GLY A 18 -21.560 -81.153 4.667 1.00 31.06 O ATOM 20 N GLY A 19 -21.086 -81.227 2.471 1.00 28.81 N ATOM 21 CA GLY A 19 -19.736 -80.738 2.674 1.00 25.98 C ATOM 22 C GLY A 19 -19.673 -79.239 2.458 1.00 24.18 C ATOM 23 O GLY A 19 -20.687 -78.546 2.565 1.00 24.42 O ATOM 24 N TYR A 20 -18.483 -78.736 2.154 1.00 21.52 N ATOM 25 CA TYR A 20 -18.295 -77.315 1.910 1.00 19.53 C ATOM 26 C TYR A 20 -17.206 -77.135 0.865 1.00 18.79 C ATOM 27 O TYR A 20 -16.348 -77.997 0.696 1.00 18.71 O ATOM 28 CB TYR A 20 -17.919 -76.594 3.214 1.00 19.20 C ATOM 29 CG TYR A 20 -16.679 -77.129 3.901 1.00 18.02 C ATOM 30 CD1 TYR A 20 -15.418 -76.603 3.621 1.00 17.54 C ATOM 31 CD2 TYR A 20 -16.768 -78.162 4.835 1.00 18.10 C ATOM 32 CE1 TYR A 20 -14.278 -77.089 4.254 1.00 16.91 C ATOM 33 CE2 TYR A 20 -15.631 -78.658 5.471 1.00 17.24 C ATOM 34 CZ TYR A 20 -14.390 -78.116 5.175 1.00 16.83 C ATOM 35 OH TYR A 20 -13.256 -78.603 5.783 1.00 16.89 O ATOM 36 N THR A 21 -17.246 -76.022 0.146 1.00 18.24 N ATOM 37 CA THR A 21 -16.234 -75.774 -0.869 1.00 17.44 C ATOM 38 C THR A 21 -14.904 -75.520 -0.175 1.00 16.97 C ATOM 39 O THR A 21 -14.810 -74.679 0.721 1.00 16.44 O ATOM 40 CB THR A 21 -16.602 -74.555 -1.742 1.00 17.91 C ATOM 41 OG1 THR A 21 -17.842 -74.807 -2.411 1.00 19.14 O ATOM 42 CG2 THR A 21 -15.520 -74.299 -2.781 1.00 17.89 C ATOM 43 N CYS A 22 -13.876 -76.260 -0.575 1.00 16.39 N ATOM 44 CA CYS A 22 -12.563 -76.091 0.028 1.00 16.22 C ATOM 45 C CYS A 22 -12.008 -74.719 -0.290 1.00 17.06 C ATOM 46 O CYS A 22 -12.332 -74.129 -1.320 1.00 16.93 O ATOM 47 CB CYS A 22 -11.556 -77.085 -0.526 1.00 15.56 C ATOM 48 SG CYS A 22 -11.970 -78.849 -0.540 1.00 13.45 S ATOM 49 N GLN A 23 -11.158 -74.219 0.594 1.00 17.86 N ATOM 50 CA GLN A 23 -10.510 -72.943 0.364 1.00 19.17 C ATOM 51 C GLN A 23 -9.601 -73.211 -0.833 1.00 19.32 C ATOM 52 O GLN A 23 -8.918 -74.233 -0.880 1.00 19.34 O ATOM 53 CB GLN A 23 -9.687 -72.557 1.589 1.00 19.89 C ATOM 54 CG GLN A 23 -8.814 -71.335 1.416 1.00 21.51 C ATOM 55 CD GLN A 23 -8.106 -70.973 2.704 1.00 22.86 C ATOM 56 OE1 GLN A 23 -7.564 -71.843 3.389 1.00 24.06 O ATOM 57 NE2 GLN A 23 -8.105 -69.687 3.042 1.00 23.22 N ATOM 58 N GLU A 24 -9.610 -72.307 -1.804 1.00 19.82 N ATOM 59 CA GLU A 24 -8.797 -72.468 -3.003 1.00 20.45 C ATOM 60 C GLU A 24 -7.361 -72.899 -2.714 1.00 20.00 C ATOM 61 O GLU A 24 -6.637 -72.244 -1.964 1.00 19.97 O ATOM 62 CB GLU A 24 -8.809 -71.169 -3.814 1.00 22.10 C ATOM 63 CG GLU A 24 -7.843 -71.151 -4.984 1.00 24.80 C ATOM 64 CD GLU A 24 -8.119 -70.022 -5.955 1.00 26.43 C ATOM 65 OE1 GLU A 24 -8.482 -68.917 -5.496 1.00 27.81 O ATOM 66 OE2 GLU A 24 -7.960 -70.238 -7.176 1.00 27.52 O ATOM 67 N ASN A 25 -6.970 -74.020 -3.317 1.00 20.02 N ATOM 68 CA ASN A 25 -5.633 -74.587 -3.176 1.00 19.89 C ATOM 69 C ASN A 25 -5.242 -75.000 -1.759 1.00 19.18 C ATOM 70 O ASN A 25 -4.053 -75.065 -1.446 1.00 19.63 O ATOM 71 CB ASN A 25 -4.584 -73.607 -3.709 1.00 21.45 C ATOM 72 CG ASN A 25 -4.861 -73.172 -5.132 1.00 22.25 C ATOM 73 OD1 ASN A 25 -4.935 -71.979 -5.417 1.00 24.38 O ATOM 74 ND2 ASN A 25 -5.012 -74.137 -6.036 1.00 22.83 N ATOM 75 N SER A 26 -6.222 -75.288 -0.906 1.00 18.04 N ATOM 76 CA SER A 26 -5.917 -75.697 0.464 1.00 16.90 C ATOM 77 C SER A 26 -5.639 -77.196 0.570 1.00 16.05 C ATOM 78 O SER A 26 -5.240 -77.690 1.627 1.00 16.04 O ATOM 79 CB SER A 26 -7.056 -75.303 1.419 1.00 16.57 C ATOM 80 OG SER A 26 -8.283 -75.920 1.078 1.00 16.59 O ATOM 81 N VAL A 27 -5.844 -77.907 -0.536 1.00 15.00 N ATOM 82 CA VAL A 27 -5.612 -79.351 -0.613 1.00 14.36 C ATOM 83 C VAL A 27 -4.715 -79.541 -1.842 1.00 13.62 C ATOM 84 O VAL A 27 -5.128 -80.107 -2.857 1.00 13.09 O ATOM 85 CB VAL A 27 -6.943 -80.104 -0.816 1.00 14.50 C ATOM 86 CG1 VAL A 27 -6.731 -81.595 -0.643 1.00 14.59 C ATOM 87 CG2 VAL A 27 -7.977 -79.599 0.177 1.00 15.48 C ATOM 88 N PRO A 28 -3.461 -79.075 -1.751 1.00 13.00 N ATOM 89 CA PRO A 28 -2.458 -79.140 -2.817 1.00 12.51 C ATOM 90 C PRO A 28 -2.058 -80.506 -3.354 1.00 12.18 C ATOM 91 O PRO A 28 -1.446 -80.597 -4.418 1.00 11.80 O ATOM 92 CB PRO A 28 -1.276 -78.380 -2.218 1.00 13.06 C ATOM 93 CG PRO A 28 -1.381 -78.705 -0.773 1.00 13.64 C ATOM 94 CD PRO A 28 -2.859 -78.580 -0.499 1.00 13.62 C ATOM 95 N TYR A 29 -2.397 -81.563 -2.623 1.00 11.96 N ATOM 96 CA TYR A 29 -2.060 -82.917 -3.044 1.00 11.62 C ATOM 97 C TYR A 29 -3.179 -83.558 -3.856 1.00 11.66 C ATOM 98 O TYR A 29 -3.010 -84.648 -4.406 1.00 11.99 O ATOM 99 CB TYR A 29 -1.736 -83.777 -1.817 1.00 12.04 C ATOM 100 CG TYR A 29 -2.771 -83.683 -0.719 1.00 11.71 C ATOM 101 CD1 TYR A 29 -3.957 -84.412 -0.786 1.00 11.94 C ATOM 102 CD2 TYR A 29 -2.580 -82.838 0.372 1.00 11.94 C ATOM 103 CE1 TYR A 29 -4.927 -84.304 0.204 1.00 12.50 C ATOM 104 CE2 TYR A 29 -3.543 -82.718 1.368 1.00 12.86 C ATOM 105 CZ TYR A 29 -4.716 -83.452 1.280 1.00 12.54 C ATOM 106 OH TYR A 29 -5.681 -83.318 2.250 1.00 14.37 O ATOM 107 N GLN A 30 -4.317 -82.877 -3.939 1.00 11.26 N ATOM 108 CA GLN A 30 -5.457 -83.393 -4.688 1.00 11.56 C ATOM 109 C GLN A 30 -5.247 -83.284 -6.193 1.00 11.40 C ATOM 110 O GLN A 30 -4.799 -82.251 -6.690 1.00 12.29 O ATOM 111 CB GLN A 30 -6.728 -82.618 -4.323 1.00 11.41 C ATOM 112 CG GLN A 30 -7.949 -82.992 -5.170 1.00 12.46 C ATOM 113 CD GLN A 30 -8.657 -84.236 -4.673 1.00 12.66 C ATOM 114 OE1 GLN A 30 -8.983 -85.140 -5.452 1.00 14.26 O ATOM 115 NE2 GLN A 30 -8.919 -84.282 -3.378 1.00 13.10 N ATOM 116 N VAL A 31 -5.563 -84.348 -6.923 1.00 11.00 N ATOM 117 CA VAL A 31 -5.452 -84.296 -8.376 1.00 10.84 C ATOM 118 C VAL A 31 -6.759 -84.784 -8.982 1.00 10.17 C ATOM 119 O VAL A 31 -7.575 -85.423 -8.313 1.00 9.71 O ATOM 120 CB VAL A 31 -4.300 -85.175 -8.933 1.00 11.70 C ATOM 121 CG1 VAL A 31 -2.983 -84.789 -8.277 1.00 13.11 C ATOM 122 CG2 VAL A 31 -4.612 -86.644 -8.726 1.00 12.90 C ATOM 123 N SER A 32 -6.959 -84.452 -10.250 1.00 10.25 N ATOM 124 CA SER A 32 -8.141 -84.877 -10.982 1.00 10.48 C ATOM 125 C SER A 32 -7.665 -85.790 -12.108 1.00 10.48 C ATOM 126 O SER A 32 -6.693 -85.470 -12.798 1.00 10.92 O ATOM 127 CB SER A 32 -8.868 -83.662 -11.575 1.00 10.69 C ATOM 128 OG SER A 32 -9.778 -84.051 -12.602 1.00 11.60 O ATOM 129 N LEU A 33 -8.321 -86.936 -12.268 1.00 10.19 N ATOM 130 CA LEU A 33 -7.979 -87.865 -13.344 1.00 10.28 C ATOM 131 C LEU A 33 -8.957 -87.553 -14.465 1.00 9.91 C ATOM 132 O LEU A 33 -10.170 -87.548 -14.261 1.00 10.13 O ATOM 133 CB LEU A 33 -8.131 -89.313 -12.885 1.00 10.63 C ATOM 134 CG LEU A 33 -7.237 -89.684 -11.698 1.00 11.52 C ATOM 135 CD1 LEU A 33 -7.282 -91.193 -11.490 1.00 12.34 C ATOM 136 CD2 LEU A 33 -5.812 -89.221 -11.943 1.00 12.79 C ATOM 137 N ASN A 34 -8.416 -87.301 -15.651 1.00 9.69 N ATOM 138 CA ASN A 34 -9.229 -86.900 -16.786 1.00 10.62 C ATOM 139 C ASN A 34 -8.858 -87.667 -18.051 1.00 11.25 C ATOM 140 O ASN A 34 -7.688 -87.762 -18.397 1.00 11.87 O ATOM 141 CB ASN A 34 -9.007 -85.392 -16.989 1.00 10.75 C ATOM 142 CG ASN A 34 -9.877 -84.796 -18.083 1.00 10.84 C ATOM 143 OD1 ASN A 34 -9.815 -85.206 -19.245 1.00 12.11 O ATOM 144 ND2 ASN A 34 -10.683 -83.807 -17.715 1.00 11.59 N ATOM 145 N SER A 37 -9.860 -88.220 -18.728 1.00 12.14 N ATOM 146 CA SER A 37 -9.627 -88.945 -19.975 1.00 13.15 C ATOM 147 C SER A 37 -10.593 -88.373 -21.010 1.00 13.12 C ATOM 148 O SER A 37 -11.021 -89.063 -21.944 1.00 13.02 O ATOM 149 CB SER A 37 -9.884 -90.439 -19.780 1.00 14.53 C ATOM 150 OG SER A 37 -9.463 -91.173 -20.913 1.00 17.97 O ATOM 151 N GLY A 38 -10.915 -87.095 -20.829 1.00 12.61 N ATOM 152 CA GLY A 38 -11.851 -86.399 -21.695 1.00 12.71 C ATOM 153 C GLY A 38 -12.681 -85.509 -20.788 1.00 12.60 C ATOM 154 O GLY A 38 -13.076 -84.402 -21.146 1.00 13.13 O ATOM 155 N TYR A 39 -12.950 -86.028 -19.595 1.00 12.23 N ATOM 156 CA TYR A 39 -13.692 -85.320 -18.563 1.00 11.97 C ATOM 157 C TYR A 39 -13.226 -85.898 -17.234 1.00 11.43 C ATOM 158 O TYR A 39 -12.591 -86.953 -17.200 1.00 11.36 O ATOM 159 CB TYR A 39 -15.205 -85.511 -18.738 1.00 12.93 C ATOM 160 CG TYR A 39 -15.673 -86.949 -18.788 1.00 13.82 C ATOM 161 CD1 TYR A 39 -15.868 -87.689 -17.620 1.00 14.76 C ATOM 162 CD2 TYR A 39 -15.938 -87.570 -20.009 1.00 14.99 C ATOM 163 CE1 TYR A 39 -16.317 -89.011 -17.668 1.00 15.90 C ATOM 164 CE2 TYR A 39 -16.386 -88.889 -20.067 1.00 16.14 C ATOM 165 CZ TYR A 39 -16.575 -89.603 -18.896 1.00 16.29 C ATOM 166 OH TYR A 39 -17.037 -90.903 -18.955 1.00 17.80 O ATOM 167 N HIS A 40 -13.518 -85.195 -16.147 1.00 11.13 N ATOM 168 CA HIS A 40 -13.128 -85.648 -14.816 1.00 10.46 C ATOM 169 C HIS A 40 -13.897 -86.915 -14.458 1.00 10.44 C ATOM 170 O HIS A 40 -15.126 -86.925 -14.527 1.00 10.64 O ATOM 171 CB HIS A 40 -13.452 -84.565 -13.789 1.00 10.59 C ATOM 172 CG HIS A 40 -13.339 -85.034 -12.372 1.00 10.22 C ATOM 173 ND1 HIS A 40 -12.147 -85.041 -11.684 1.00 10.69 N ATOM 174 CD2 HIS A 40 -14.260 -85.575 -11.539 1.00 11.12 C ATOM 175 CE1 HIS A 40 -12.335 -85.568 -10.488 1.00 10.83 C ATOM 176 NE2 HIS A 40 -13.608 -85.900 -10.373 1.00 11.33 N ATOM 177 N PHE A 41 -13.194 -87.977 -14.069 1.00 9.62 N ATOM 178 CA PHE A 41 -13.888 -89.208 -13.709 1.00 9.74 C ATOM 179 C PHE A 41 -13.470 -89.800 -12.366 1.00 9.25 C ATOM 180 O PHE A 41 -14.170 -90.650 -11.833 1.00 9.95 O ATOM 181 CB PHE A 41 -13.743 -90.276 -14.815 1.00 9.94 C ATOM 182 CG PHE A 41 -12.350 -90.835 -14.967 1.00 10.32 C ATOM 183 CD1 PHE A 41 -11.409 -90.207 -15.780 1.00 10.37 C ATOM 184 CD2 PHE A 41 -11.973 -91.988 -14.283 1.00 10.82 C ATOM 185 CE1 PHE A 41 -10.119 -90.711 -15.906 1.00 11.12 C ATOM 186 CE2 PHE A 41 -10.681 -92.500 -14.404 1.00 11.09 C ATOM 187 CZ PHE A 41 -9.753 -91.858 -15.219 1.00 11.44 C ATOM 188 N CYS A 42 -12.345 -89.341 -11.823 1.00 9.00 N ATOM 189 CA CYS A 42 -11.840 -89.828 -10.536 1.00 9.15 C ATOM 190 C CYS A 42 -10.854 -88.842 -9.942 1.00 9.20 C ATOM 191 O CYS A 42 -10.374 -87.936 -10.623 1.00 9.36 O ATOM 192 CB CYS A 42 -11.108 -91.162 -10.697 1.00 9.21 C ATOM 193 SG CYS A 42 -12.128 -92.666 -10.667 1.00 9.17 S ATOM 194 N GLY A 43 -10.559 -89.035 -8.663 1.00 9.12 N ATOM 195 CA GLY A 43 -9.593 -88.197 -7.979 1.00 9.53 C ATOM 196 C GLY A 43 -8.342 -89.018 -7.709 1.00 9.74 C ATOM 197 O GLY A 43 -8.250 -90.183 -8.108 1.00 9.50 O ATOM 198 N GLY A 44 -7.369 -88.405 -7.045 1.00 9.21 N ATOM 199 CA GLY A 44 -6.127 -89.080 -6.716 1.00 9.95 C ATOM 200 C GLY A 44 -5.306 -88.196 -5.799 1.00 10.30 C ATOM 201 O GLY A 44 -5.689 -87.056 -5.544 1.00 10.32 O ATOM 202 N SER A 45 -4.184 -88.713 -5.305 1.00 10.65 N ATOM 203 CA SER A 45 -3.314 -87.941 -4.416 1.00 11.45 C ATOM 204 C SER A 45 -1.867 -88.014 -4.877 1.00 11.73 C ATOM 205 O SER A 45 -1.388 -89.076 -5.265 1.00 11.96 O ATOM 206 CB SER A 45 -3.397 -88.476 -2.986 1.00 11.77 C ATOM 207 OG SER A 45 -4.717 -88.406 -2.490 1.00 14.78 O ATOM 208 N LEU A 46 -1.173 -86.882 -4.822 1.00 11.51 N ATOM 209 CA LEU A 46 0.229 -86.826 -5.218 1.00 11.94 C ATOM 210 C LEU A 46 1.073 -87.227 -4.009 1.00 12.28 C ATOM 211 O LEU A 46 1.002 -86.574 -2.964 1.00 12.42 O ATOM 212 CB LEU A 46 0.587 -85.400 -5.656 1.00 12.22 C ATOM 213 CG LEU A 46 1.995 -85.191 -6.205 1.00 12.21 C ATOM 214 CD1 LEU A 46 2.113 -85.872 -7.569 1.00 12.63 C ATOM 215 CD2 LEU A 46 2.293 -83.704 -6.314 1.00 13.05 C ATOM 216 N ILE A 47 1.855 -88.301 -4.136 1.00 12.93 N ATOM 217 CA ILE A 47 2.693 -88.747 -3.019 1.00 14.56 C ATOM 218 C ILE A 47 4.178 -88.430 -3.187 1.00 15.49 C ATOM 219 O ILE A 47 4.958 -88.541 -2.239 1.00 16.32 O ATOM 220 CB ILE A 47 2.501 -90.252 -2.723 1.00 15.12 C ATOM 221 CG1 ILE A 47 2.733 -91.083 -3.983 1.00 15.87 C ATOM 222 CG2 ILE A 47 1.106 -90.483 -2.152 1.00 15.82 C ATOM 223 CD1 ILE A 47 2.743 -92.577 -3.708 1.00 16.68 C ATOM 224 N ASN A 48 4.568 -88.057 -4.400 1.00 16.02 N ATOM 225 CA ASN A 48 5.936 -87.629 -4.693 1.00 17.39 C ATOM 226 C ASN A 48 5.878 -86.924 -6.043 1.00 17.63 C ATOM 227 O ASN A 48 4.849 -86.973 -6.714 1.00 17.71 O ATOM 228 CB ASN A 48 6.949 -88.790 -4.675 1.00 19.13 C ATOM 229 CG ASN A 48 6.728 -89.796 -5.772 1.00 20.31 C ATOM 230 OD1 ASN A 48 6.648 -89.447 -6.947 1.00 21.91 O ATOM 231 ND2 ASN A 48 6.651 -91.067 -5.395 1.00 22.71 N ATOM 232 N ASP A 49 6.954 -86.262 -6.451 1.00 17.69 N ATOM 233 CA ASP A 49 6.908 -85.515 -7.701 1.00 18.18 C ATOM 234 C ASP A 49 6.669 -86.295 -8.994 1.00 17.82 C ATOM 235 O ASP A 49 6.537 -85.689 -10.055 1.00 18.25 O ATOM 236 CB ASP A 49 8.158 -84.626 -7.835 1.00 19.30 C ATOM 237 CG ASP A 49 9.415 -85.404 -8.166 1.00 20.28 C ATOM 238 OD1 ASP A 49 9.426 -86.640 -8.007 1.00 21.19 O ATOM 239 OD2 ASP A 49 10.405 -84.762 -8.582 1.00 22.70 O ATOM 240 N GLN A 50 6.577 -87.620 -8.918 1.00 17.19 N ATOM 241 CA GLN A 50 6.341 -88.416 -10.123 1.00 17.01 C ATOM 242 C GLN A 50 5.284 -89.502 -9.966 1.00 15.47 C ATOM 243 O GLN A 50 5.007 -90.236 -10.913 1.00 15.58 O ATOM 244 CB GLN A 50 7.633 -89.084 -10.588 1.00 18.69 C ATOM 245 CG GLN A 50 8.782 -88.143 -10.860 1.00 21.69 C ATOM 246 CD GLN A 50 9.999 -88.886 -11.370 1.00 22.63 C ATOM 247 OE1 GLN A 50 9.990 -89.431 -12.476 1.00 23.37 O ATOM 248 NE2 GLN A 50 11.051 -88.926 -10.559 1.00 24.26 N ATOM 249 N TRP A 51 4.693 -89.611 -8.781 1.00 14.43 N ATOM 250 CA TRP A 51 3.695 -90.652 -8.548 1.00 12.79 C ATOM 251 C TRP A 51 2.413 -90.178 -7.889 1.00 12.35 C ATOM 252 O TRP A 51 2.426 -89.316 -7.013 1.00 12.61 O ATOM 253 CB TRP A 51 4.289 -91.773 -7.693 1.00 13.55 C ATOM 254 CG TRP A 51 5.347 -92.572 -8.376 1.00 13.53 C ATOM 255 CD1 TRP A 51 6.671 -92.259 -8.488 1.00 14.65 C ATOM 256 CD2 TRP A 51 5.173 -93.831 -9.029 1.00 14.30 C ATOM 257 NE1 TRP A 51 7.333 -93.250 -9.169 1.00 15.02 N ATOM 258 CE2 TRP A 51 6.438 -94.228 -9.515 1.00 14.50 C ATOM 259 CE3 TRP A 51 4.069 -94.665 -9.255 1.00 14.02 C ATOM 260 CZ2 TRP A 51 6.630 -95.426 -10.210 1.00 14.87 C ATOM 261 CZ3 TRP A 51 4.260 -95.854 -9.943 1.00 14.95 C ATOM 262 CH2 TRP A 51 5.533 -96.223 -10.415 1.00 14.71 C ATOM 263 N VAL A 52 1.306 -90.774 -8.323 1.00 12.01 N ATOM 264 CA VAL A 52 -0.019 -90.473 -7.801 1.00 11.92 C ATOM 265 C VAL A 52 -0.658 -91.783 -7.369 1.00 11.52 C ATOM 266 O VAL A 52 -0.421 -92.820 -7.984 1.00 11.79 O ATOM 267 CB VAL A 52 -0.904 -89.813 -8.891 1.00 12.16 C ATOM 268 CG1 VAL A 52 -2.381 -89.871 -8.494 1.00 12.84 C ATOM 269 CG2 VAL A 52 -0.471 -88.372 -9.094 1.00 12.55 C ATOM 270 N VAL A 53 -1.439 -91.748 -6.294 1.00 11.30 N ATOM 271 CA VAL A 53 -2.126 -92.947 -5.843 1.00 11.87 C ATOM 272 C VAL A 53 -3.619 -92.699 -6.023 1.00 11.30 C ATOM 273 O VAL A 53 -4.111 -91.594 -5.784 1.00 10.65 O ATOM 274 CB VAL A 53 -1.799 -93.288 -4.361 1.00 13.03 C ATOM 275 CG1 VAL A 53 -2.360 -92.232 -3.432 1.00 14.39 C ATOM 276 CG2 VAL A 53 -2.346 -94.676 -4.017 1.00 15.00 C ATOM 277 N SER A 54 -4.336 -93.722 -6.473 1.00 10.68 N ATOM 278 CA SER A 54 -5.771 -93.603 -6.703 1.00 10.48 C ATOM 279 C SER A 54 -6.429 -94.955 -6.443 1.00 10.23 C ATOM 280 O SER A 54 -5.828 -95.832 -5.820 1.00 10.68 O ATOM 281 CB SER A 54 -6.013 -93.145 -8.148 1.00 10.85 C ATOM 282 OG SER A 54 -7.377 -92.852 -8.401 1.00 10.35 O ATOM 283 N ALA A 55 -7.662 -95.120 -6.910 1.00 9.41 N ATOM 284 CA ALA A 55 -8.390 -96.376 -6.730 1.00 9.60 C ATOM 285 C ALA A 55 -8.221 -97.241 -7.969 1.00 9.59 C ATOM 286 O ALA A 55 -8.198 -96.724 -9.084 1.00 9.96 O ATOM 287 CB ALA A 55 -9.862 -96.098 -6.496 1.00 9.48 C ATOM 288 N ALA A 56 -8.105 -98.552 -7.773 1.00 9.51 N ATOM 289 CA ALA A 56 -7.937 -99.460 -8.904 1.00 9.15 C ATOM 290 C ALA A 56 -9.144 -99.462 -9.838 1.00 9.41 C ATOM 291 O ALA A 56 -8.988 -99.684 -11.036 1.00 9.97 O ATOM 292 CB ALA A 56 -7.651-100.879 -8.411 1.00 9.42 C ATOM 293 N HIS A 57 -10.348 -99.219 -9.321 1.00 9.42 N ATOM 294 CA HIS A 57 -11.497 -99.218 -10.223 1.00 10.14 C ATOM 295 C HIS A 57 -11.542 -97.963 -11.089 1.00 10.65 C ATOM 296 O HIS A 57 -12.438 -97.799 -11.921 1.00 11.76 O ATOM 297 CB HIS A 57 -12.824 -99.421 -9.471 1.00 10.07 C ATOM 298 CG HIS A 57 -13.269 -98.247 -8.656 1.00 10.09 C ATOM 299 ND1 HIS A 57 -12.961 -98.112 -7.320 1.00 10.81 N ATOM 300 CD2 HIS A 57 -14.039 -97.179 -8.975 1.00 9.90 C ATOM 301 CE1 HIS A 57 -13.526 -97.013 -6.849 1.00 10.94 C ATOM 302 NE2 HIS A 57 -14.186 -96.429 -7.833 1.00 10.82 N ATOM 303 N CYS A 58 -10.562 -97.086 -10.902 1.00 10.72 N ATOM 304 CA CYS A 58 -10.458 -95.871 -11.700 1.00 11.25 C ATOM 305 C CYS A 58 -9.534 -96.120 -12.889 1.00 12.41 C ATOM 306 O CYS A 58 -9.182 -95.190 -13.613 1.00 13.06 O ATOM 307 CB CYS A 58 -9.889 -94.719 -10.875 1.00 10.41 C ATOM 308 SG CYS A 58 -10.995 -93.989 -9.624 1.00 10.82 S ATOM 309 N TYR A 59 -9.129 -97.370 -13.087 1.00 12.85 N ATOM 310 CA TYR A 59 -8.248 -97.700 -14.203 1.00 14.20 C ATOM 311 C TYR A 59 -8.833 -97.366 -15.576 1.00 14.52 C ATOM 312 O TYR A 59 -10.012 -97.591 -15.837 1.00 14.58 O ATOM 313 CB TYR A 59 -7.896 -99.191 -14.195 1.00 14.86 C ATOM 314 CG TYR A 59 -7.191 -99.621 -15.466 1.00 15.66 C ATOM 315 CD1 TYR A 59 -5.825 -99.409 -15.635 1.00 16.63 C ATOM 316 CD2 TYR A 59 -7.911-100.163 -16.530 1.00 16.43 C ATOM 317 CE1 TYR A 59 -5.191 -99.723 -16.840 1.00 17.81 C ATOM 318 CE2 TYR A 59 -7.292-100.476 -17.734 1.00 17.60 C ATOM 319 CZ TYR A 59 -5.934-100.252 -17.883 1.00 17.94 C ATOM 320 OH TYR A 59 -5.326-100.548 -19.082 1.00 19.76 O ATOM 321 N LYS A 60 -7.974 -96.838 -16.443 1.00 16.10 N ATOM 322 CA LYS A 60 -8.309 -96.500 -17.824 1.00 17.66 C ATOM 323 C LYS A 60 -6.961 -96.625 -18.530 1.00 17.67 C ATOM 324 O LYS A 60 -5.933 -96.327 -17.928 1.00 17.66 O ATOM 325 CB LYS A 60 -8.811 -95.063 -17.935 1.00 19.21 C ATOM 326 CG LYS A 60 -10.318 -94.934 -18.018 1.00 22.87 C ATOM 327 CD LYS A 60 -10.708 -93.526 -18.430 1.00 24.49 C ATOM 328 CE LYS A 60 -12.205 -93.441 -18.680 1.00 24.72 C ATOM 329 NZ LYS A 60 -12.622 -92.079 -19.101 1.00 26.16 N ATOM 330 N SER A 61 -6.951 -97.055 -19.790 1.00 18.41 N ATOM 331 CA SER A 61 -5.690 -97.218 -20.510 1.00 19.04 C ATOM 332 C SER A 61 -4.955 -95.900 -20.748 1.00 18.56 C ATOM 333 O SER A 61 -3.727 -95.871 -20.832 1.00 19.66 O ATOM 334 CB SER A 61 -5.925 -97.938 -21.844 1.00 19.71 C ATOM 335 OG SER A 61 -6.816 -97.212 -22.669 1.00 22.20 O ATOM 336 N ARG A 62 -5.709 -94.812 -20.851 1.00 17.99 N ATOM 337 CA ARG A 62 -5.130 -93.488 -21.060 1.00 17.93 C ATOM 338 C ARG A 62 -5.688 -92.537 -20.010 1.00 16.28 C ATOM 339 O ARG A 62 -6.904 -92.379 -19.886 1.00 16.21 O ATOM 340 CB ARG A 62 -5.466 -92.968 -22.460 1.00 19.92 C ATOM 341 CG ARG A 62 -4.621 -93.562 -23.577 1.00 23.44 C ATOM 342 CD ARG A 62 -5.045 -92.994 -24.924 1.00 25.87 C ATOM 343 NE ARG A 62 -6.105 -93.782 -25.547 1.00 29.24 N ATOM 344 CZ ARG A 62 -5.886 -94.832 -26.332 1.00 30.18 C ATOM 345 NH1 ARG A 62 -4.645 -95.217 -26.595 1.00 31.35 N ATOM 346 NH2 ARG A 62 -6.906 -95.502 -26.853 1.00 31.41 N ATOM 347 N ILE A 63 -4.793 -91.911 -19.253 1.00 14.73 N ATOM 348 CA ILE A 63 -5.204 -90.982 -18.207 1.00 13.69 C ATOM 349 C ILE A 63 -4.329 -89.741 -18.162 1.00 13.16 C ATOM 350 O ILE A 63 -3.105 -89.829 -18.247 1.00 13.53 O ATOM 351 CB ILE A 63 -5.119 -91.628 -16.805 1.00 13.49 C ATOM 352 CG1 ILE A 63 -6.060 -92.827 -16.717 1.00 13.46 C ATOM 353 CG2 ILE A 63 -5.466 -90.597 -15.737 1.00 13.67 C ATOM 354 CD1 ILE A 63 -5.972 -93.565 -15.389 1.00 14.02 C ATOM 355 N GLN A 64 -4.965 -88.584 -18.030 1.00 12.44 N ATOM 356 CA GLN A 64 -4.233 -87.336 -17.906 1.00 12.47 C ATOM 357 C GLN A 64 -4.470 -86.869 -16.477 1.00 11.96 C ATOM 358 O GLN A 64 -5.609 -86.837 -16.014 1.00 11.94 O ATOM 359 CB GLN A 64 -4.763 -86.277 -18.869 1.00 12.76 C ATOM 360 CG GLN A 64 -4.000 -84.967 -18.767 1.00 13.89 C ATOM 361 CD GLN A 64 -4.565 -83.896 -19.666 1.00 14.71 C ATOM 362 OE1 GLN A 64 -5.683 -83.431 -19.466 1.00 15.15 O ATOM 363 NE2 GLN A 64 -3.796 -83.506 -20.674 1.00 15.49 N ATOM 364 N VAL A 66 -3.396 -86.529 -15.778 1.00 11.39 N ATOM 365 CA VAL A 66 -3.509 -86.065 -14.402 1.00 11.59 C ATOM 366 C VAL A 66 -3.482 -84.546 -14.392 1.00 11.18 C ATOM 367 O VAL A 66 -2.631 -83.933 -15.033 1.00 11.81 O ATOM 368 CB VAL A 66 -2.346 -86.597 -13.541 1.00 11.81 C ATOM 369 CG1 VAL A 66 -2.494 -86.110 -12.109 1.00 12.87 C ATOM 370 CG2 VAL A 66 -2.322 -88.119 -13.585 1.00 12.42 C ATOM 371 N ARG A 67 -4.424 -83.938 -13.681 1.00 10.27 N ATOM 372 CA ARG A 67 -4.471 -82.488 -13.604 1.00 10.95 C ATOM 373 C ARG A 67 -4.238 -82.044 -12.165 1.00 10.93 C ATOM 374 O ARG A 67 -5.014 -82.368 -11.260 1.00 11.17 O ATOM 375 CB ARG A 67 -5.807 -81.983 -14.151 1.00 10.53 C ATOM 376 CG ARG A 67 -5.996 -82.362 -15.625 1.00 10.99 C ATOM 377 CD ARG A 67 -7.243 -81.747 -16.242 1.00 10.73 C ATOM 378 NE ARG A 67 -7.314 -82.054 -17.672 1.00 10.87 N ATOM 379 CZ ARG A 67 -8.216 -81.547 -18.508 1.00 11.92 C ATOM 380 NH1 ARG A 67 -9.141 -80.703 -18.068 1.00 11.92 N ATOM 381 NH2 ARG A 67 -8.178 -81.873 -19.797 1.00 12.35 N ATOM 382 N LEU A 68 -3.146 -81.313 -11.961 1.00 11.36 N ATOM 383 CA LEU A 68 -2.776 -80.845 -10.630 1.00 12.33 C ATOM 384 C LEU A 68 -2.981 -79.345 -10.467 1.00 12.39 C ATOM 385 O LEU A 68 -3.088 -78.617 -11.450 1.00 12.98 O ATOM 386 CB LEU A 68 -1.316 -81.201 -10.344 1.00 13.14 C ATOM 387 CG LEU A 68 -0.951 -82.673 -10.573 1.00 13.51 C ATOM 388 CD1 LEU A 68 -0.420 -82.862 -11.985 1.00 15.23 C ATOM 389 CD2 LEU A 68 0.087 -83.111 -9.555 1.00 14.84 C ATOM 390 N GLY A 69 -3.049 -78.892 -9.217 1.00 12.27 N ATOM 391 CA GLY A 69 -3.233 -77.476 -8.940 1.00 12.73 C ATOM 392 C GLY A 69 -4.594 -76.923 -9.325 1.00 13.01 C ATOM 393 O GLY A 69 -4.740 -75.726 -9.569 1.00 14.00 O ATOM 394 N GLU A 70 -5.591 -77.798 -9.361 1.00 12.61 N ATOM 395 CA GLU A 70 -6.951 -77.430 -9.727 1.00 13.33 C ATOM 396 C GLU A 70 -7.837 -76.981 -8.576 1.00 13.92 C ATOM 397 O GLU A 70 -7.662 -77.404 -7.436 1.00 14.52 O ATOM 398 CB GLU A 70 -7.639 -78.630 -10.388 1.00 13.04 C ATOM 399 CG GLU A 70 -7.125 -78.969 -11.763 1.00 13.39 C ATOM 400 CD GLU A 70 -7.804 -78.153 -12.839 1.00 13.53 C ATOM 401 OE1 GLU A 70 -8.319 -77.060 -12.523 1.00 13.26 O ATOM 402 OE2 GLU A 70 -7.813 -78.604 -14.004 1.00 13.75 O ATOM 403 N HIS A 71 -8.778 -76.097 -8.888 1.00 13.86 N ATOM 404 CA HIS A 71 -9.780 -75.680 -7.922 1.00 14.10 C ATOM 405 C HIS A 71 -11.075 -75.786 -8.715 1.00 13.89 C ATOM 406 O HIS A 71 -11.935 -76.603 -8.399 1.00 13.97 O ATOM 407 CB HIS A 71 -9.592 -74.255 -7.416 1.00 15.30 C ATOM 408 CG HIS A 71 -10.562 -73.894 -6.333 1.00 16.34 C ATOM 409 ND1 HIS A 71 -10.699 -74.646 -5.186 1.00 17.65 N ATOM 410 CD2 HIS A 71 -11.468 -72.894 -6.237 1.00 17.33 C ATOM 411 CE1 HIS A 71 -11.650 -74.125 -4.430 1.00 17.75 C ATOM 412 NE2 HIS A 71 -12.133 -73.061 -5.046 1.00 17.98 N ATOM 413 N ASN A 72 -11.198 -74.970 -9.762 1.00 13.51 N ATOM 414 CA ASN A 72 -12.367 -75.023 -10.634 1.00 13.33 C ATOM 415 C ASN A 72 -11.932 -75.856 -11.836 1.00 13.43 C ATOM 416 O ASN A 72 -11.087 -75.435 -12.621 1.00 12.43 O ATOM 417 CB ASN A 72 -12.780 -73.628 -11.111 1.00 13.88 C ATOM 418 CG ASN A 72 -14.047 -73.654 -11.949 1.00 14.66 C ATOM 419 OD1 ASN A 72 -14.420 -74.694 -12.502 1.00 15.41 O ATOM 420 ND2 ASN A 72 -14.709 -72.503 -12.058 1.00 15.71 N ATOM 421 N ILE A 73 -12.507 -77.044 -11.956 1.00 13.87 N ATOM 422 CA ILE A 73 -12.175 -77.970 -13.027 1.00 15.06 C ATOM 423 C ILE A 73 -12.609 -77.505 -14.418 1.00 14.28 C ATOM 424 O ILE A 73 -12.106 -78.000 -15.428 1.00 13.49 O ATOM 425 CB ILE A 73 -12.805 -79.357 -12.716 1.00 16.71 C ATOM 426 CG1 ILE A 73 -11.719 -80.419 -12.761 1.00 19.13 C ATOM 427 CG2 ILE A 73 -13.959 -79.658 -13.658 1.00 19.26 C ATOM 428 CD1 ILE A 73 -10.665 -80.222 -11.705 1.00 18.97 C ATOM 429 N ASN A 74 -13.533 -76.552 -14.466 1.00 14.12 N ATOM 430 CA ASN A 74 -14.041 -76.062 -15.743 1.00 14.43 C ATOM 431 C ASN A 74 -13.461 -74.748 -16.241 1.00 14.18 C ATOM 432 O ASN A 74 -13.894 -74.229 -17.276 1.00 14.12 O ATOM 433 CB ASN A 74 -15.563 -75.939 -15.686 1.00 15.48 C ATOM 434 CG ASN A 74 -16.243 -77.272 -15.506 1.00 16.81 C ATOM 435 OD1 ASN A 74 -15.733 -78.302 -15.940 1.00 18.16 O ATOM 436 ND2 ASN A 74 -17.412 -77.260 -14.878 1.00 18.27 N ATOM 437 N VAL A 75 -12.488 -74.207 -15.521 1.00 13.58 N ATOM 438 CA VAL A 75 -11.876 -72.949 -15.924 1.00 14.10 C ATOM 439 C VAL A 75 -10.366 -72.993 -15.783 1.00 14.31 C ATOM 440 O VAL A 75 -9.833 -73.518 -14.796 1.00 13.55 O ATOM 441 CB VAL A 75 -12.410 -71.770 -15.080 1.00 15.04 C ATOM 442 CG1 VAL A 75 -11.834 -70.458 -15.595 1.00 16.05 C ATOM 443 CG2 VAL A 75 -13.922 -71.739 -15.130 1.00 15.75 C ATOM 444 N LEU A 76 -9.674 -72.459 -16.782 1.00 14.13 N ATOM 445 CA LEU A 76 -8.221 -72.407 -16.761 1.00 15.56 C ATOM 446 C LEU A 76 -7.875 -71.253 -15.834 1.00 16.74 C ATOM 447 O LEU A 76 -8.076 -70.087 -16.171 1.00 17.28 O ATOM 448 CB LEU A 76 -7.677 -72.146 -18.168 1.00 15.32 C ATOM 449 CG LEU A 76 -6.157 -72.096 -18.298 1.00 15.43 C ATOM 450 CD1 LEU A 76 -5.569 -73.437 -17.891 1.00 16.37 C ATOM 451 CD2 LEU A 76 -5.781 -71.752 -19.733 1.00 16.22 C ATOM 452 N GLU A 77 -7.357 -71.595 -14.661 1.00 17.45 N ATOM 453 CA GLU A 77 -7.021 -70.614 -13.640 1.00 18.65 C ATOM 454 C GLU A 77 -5.594 -70.091 -13.687 1.00 19.33 C ATOM 455 O GLU A 77 -5.332 -68.967 -13.254 1.00 20.19 O ATOM 456 CB GLU A 77 -7.331 -71.216 -12.269 1.00 19.01 C ATOM 457 CG GLU A 77 -8.807 -71.536 -12.107 1.00 18.88 C ATOM 458 CD GLU A 77 -9.074 -72.696 -11.164 1.00 19.42 C ATOM 459 OE1 GLU A 77 -8.630 -73.828 -11.460 1.00 18.73 O ATOM 460 OE2 GLU A 77 -9.736 -72.475 -10.130 1.00 19.64 O ATOM 461 N GLY A 78 -4.676 -70.897 -14.209 1.00 19.79 N ATOM 462 CA GLY A 78 -3.292 -70.469 -14.298 1.00 20.67 C ATOM 463 C GLY A 78 -2.315 -71.209 -13.402 1.00 20.98 C ATOM 464 O GLY A 78 -1.107 -71.113 -13.601 1.00 22.40 O ATOM 465 N ASN A 79 -2.822 -71.948 -12.420 1.00 20.79 N ATOM 466 CA ASN A 79 -1.947 -72.684 -11.505 1.00 20.50 C ATOM 467 C ASN A 79 -1.880 -74.167 -11.846 1.00 19.43 C ATOM 468 O ASN A 79 -1.132 -74.919 -11.222 1.00 19.50 O ATOM 469 CB ASN A 79 -2.441 -72.547 -10.061 1.00 22.34 C ATOM 470 CG ASN A 79 -2.622 -71.105 -9.638 1.00 23.63 C ATOM 471 OD1 ASN A 79 -1.684 -70.313 -9.677 1.00 25.40 O ATOM 472 ND2 ASN A 79 -3.835 -70.760 -9.224 1.00 24.82 N ATOM 473 N GLU A 80 -2.652 -74.584 -12.842 1.00 18.02 N ATOM 474 CA GLU A 80 -2.701 -75.990 -13.220 1.00 16.56 C ATOM 475 C GLU A 80 -1.500 -76.556 -13.957 1.00 16.34 C ATOM 476 O GLU A 80 -0.774 -75.850 -14.654 1.00 16.86 O ATOM 477 CB GLU A 80 -3.946 -76.270 -14.067 1.00 15.91 C ATOM 478 CG GLU A 80 -5.232 -75.760 -13.459 1.00 15.56 C ATOM 479 CD GLU A 80 -5.638 -74.412 -14.012 1.00 14.99 C ATOM 480 OE1 GLU A 80 -4.743 -73.635 -14.401 1.00 15.70 O ATOM 481 OE2 GLU A 80 -6.851 -74.131 -14.046 1.00 14.79 O ATOM 482 N GLN A 81 -1.308 -77.855 -13.781 1.00 15.69 N ATOM 483 CA GLN A 81 -0.259 -78.593 -14.459 1.00 15.34 C ATOM 484 C GLN A 81 -0.956 -79.827 -15.010 1.00 15.33 C ATOM 485 O GLN A 81 -1.655 -80.528 -14.277 1.00 15.11 O ATOM 486 CB GLN A 81 0.853 -79.002 -13.492 1.00 15.97 C ATOM 487 CG GLN A 81 1.777 -77.863 -13.103 1.00 16.98 C ATOM 488 CD GLN A 81 2.871 -78.308 -12.154 1.00 17.46 C ATOM 489 OE1 GLN A 81 3.645 -79.217 -12.460 1.00 18.35 O ATOM 490 NE2 GLN A 81 2.941 -77.667 -10.996 1.00 18.51 N ATOM 491 N PHE A 82 -0.796 -80.061 -16.308 1.00 15.39 N ATOM 492 CA PHE A 82 -1.404 -81.209 -16.972 1.00 16.09 C ATOM 493 C PHE A 82 -0.275 -82.164 -17.315 1.00 16.55 C ATOM 494 O PHE A 82 0.678 -81.789 -18.005 1.00 16.67 O ATOM 495 CB PHE A 82 -2.113 -80.786 -18.268 1.00 16.70 C ATOM 496 CG PHE A 82 -3.189 -79.748 -18.077 1.00 18.17 C ATOM 497 CD1 PHE A 82 -2.873 -78.470 -17.614 1.00 18.49 C ATOM 498 CD2 PHE A 82 -4.513 -80.035 -18.398 1.00 18.35 C ATOM 499 CE1 PHE A 82 -3.864 -77.493 -17.475 1.00 19.21 C ATOM 500 CE2 PHE A 82 -5.514 -79.064 -18.262 1.00 18.56 C ATOM 501 CZ PHE A 82 -5.186 -77.793 -17.800 1.00 19.40 C ATOM 502 N VAL A 83 -0.379 -83.398 -16.836 1.00 16.87 N ATOM 503 CA VAL A 83 0.655 -84.394 -17.087 1.00 17.74 C ATOM 504 C VAL A 83 0.032 -85.748 -17.410 1.00 17.90 C ATOM 505 O VAL A 83 -0.879 -86.200 -16.722 1.00 17.84 O ATOM 506 CB VAL A 83 1.579 -84.554 -15.854 1.00 18.11 C ATOM 507 CG1 VAL A 83 2.789 -85.399 -16.215 1.00 18.74 C ATOM 508 CG2 VAL A 83 2.009 -83.185 -15.338 1.00 19.03 C ATOM 509 N ASN A 84 0.525 -86.393 -18.460 1.00 18.64 N ATOM 510 CA ASN A 84 0.009 -87.698 -18.850 1.00 19.26 C ATOM 511 C ASN A 84 0.591 -88.823 -18.007 1.00 18.71 C ATOM 512 O ASN A 84 1.718 -88.731 -17.517 1.00 18.56 O ATOM 513 CB ASN A 84 0.302 -87.956 -20.330 1.00 21.28 C ATOM 514 CG ASN A 84 -0.821 -87.488 -21.228 1.00 22.63 C ATOM 515 OD1 ASN A 84 -1.459 -86.474 -20.957 1.00 24.34 O ATOM 516 ND2 ASN A 84 -1.069 -88.225 -22.307 1.00 24.81 N ATOM 517 N ALA A 85 -0.194 -89.879 -17.831 1.00 17.79 N ATOM 518 CA ALA A 85 0.243 -91.040 -17.070 1.00 17.75 C ATOM 519 C ALA A 85 1.149 -91.868 -17.970 1.00 18.02 C ATOM 520 O ALA A 85 0.801 -92.142 -19.118 1.00 18.75 O ATOM 521 CB ALA A 85 -0.959 -91.865 -16.641 1.00 17.64 C ATOM 522 N ALA A 86 2.307 -92.262 -17.450 1.00 17.91 N ATOM 523 CA ALA A 86 3.260 -93.062 -18.212 1.00 18.14 C ATOM 524 C ALA A 86 3.070 -94.540 -17.905 1.00 18.29 C ATOM 525 O ALA A 86 3.184 -95.391 -18.789 1.00 18.61 O ATOM 526 CB ALA A 86 4.684 -92.638 -17.872 1.00 18.49 C ATOM 527 N LYS A 87 2.780 -94.838 -16.643 1.00 17.96 N ATOM 528 CA LYS A 87 2.575 -96.212 -16.210 1.00 18.36 C ATOM 529 C LYS A 87 1.423 -96.254 -15.218 1.00 17.75 C ATOM 530 O LYS A 87 1.303 -95.385 -14.358 1.00 17.44 O ATOM 531 CB LYS A 87 3.851 -96.750 -15.554 1.00 19.66 C ATOM 532 CG LYS A 87 5.106 -96.472 -16.371 1.00 22.12 C ATOM 533 CD LYS A 87 6.379 -96.935 -15.680 1.00 24.34 C ATOM 534 CE LYS A 87 6.596 -98.428 -15.831 1.00 25.48 C ATOM 535 NZ LYS A 87 7.967 -98.821 -15.384 1.00 26.86 N ATOM 536 N ILE A 88 0.563 -97.254 -15.356 1.00 17.19 N ATOM 537 CA ILE A 88 -0.572 -97.402 -14.458 1.00 17.21 C ATOM 538 C ILE A 88 -0.466 -98.801 -13.866 1.00 16.96 C ATOM 539 O ILE A 88 -0.508 -99.798 -14.590 1.00 17.69 O ATOM 540 CB ILE A 88 -1.905 -97.244 -15.216 1.00 17.47 C ATOM 541 CG1 ILE A 88 -1.935 -95.890 -15.932 1.00 17.96 C ATOM 542 CG2 ILE A 88 -3.071 -97.338 -14.243 1.00 18.56 C ATOM 543 CD1 ILE A 88 -3.126 -95.708 -16.859 1.00 19.93 C ATOM 544 N ILE A 89 -0.316 -98.871 -12.550 1.00 16.37 N ATOM 545 CA ILE A 89 -0.154-100.149 -11.872 1.00 15.98 C ATOM 546 C ILE A 89 -1.196-100.399 -10.793 1.00 15.49 C ATOM 547 O ILE A 89 -1.207 -99.729 -9.759 1.00 14.87 O ATOM 548 CB ILE A 89 1.236-100.227 -11.219 1.00 16.49 C ATOM 549 CG1 ILE A 89 2.315 -99.989 -12.274 1.00 17.16 C ATOM 550 CG2 ILE A 89 1.427-101.572 -10.537 1.00 17.00 C ATOM 551 CD1 ILE A 89 3.707 -99.881 -11.694 1.00 18.13 C ATOM 552 N LYS A 90 -2.072-101.366 -11.035 1.00 15.47 N ATOM 553 CA LYS A 90 -3.092-101.723 -10.056 1.00 15.09 C ATOM 554 C LYS A 90 -2.521-102.763 -9.100 1.00 15.13 C ATOM 555 O LYS A 90 -1.618-103.522 -9.462 1.00 15.56 O ATOM 556 CB LYS A 90 -4.329-102.311 -10.742 1.00 15.75 C ATOM 557 CG LYS A 90 -5.164-101.302 -11.515 1.00 16.11 C ATOM 558 CD LYS A 90 -6.475-101.915 -11.995 1.00 17.62 C ATOM 559 CE LYS A 90 -6.252-102.982 -13.051 1.00 17.72 C ATOM 560 NZ LYS A 90 -7.551-103.584 -13.477 1.00 17.56 N ATOM 561 N HIS A 91 -3.038-102.799 -7.877 1.00 14.93 N ATOM 562 CA HIS A 91 -2.568-103.789 -6.920 1.00 15.20 C ATOM 563 C HIS A 91 -2.841-105.153 -7.560 1.00 15.73 C ATOM 564 O HIS A 91 -3.914-105.381 -8.122 1.00 15.52 O ATOM 565 CB HIS A 91 -3.326-103.650 -5.600 1.00 15.33 C ATOM 566 CG HIS A 91 -2.743-104.464 -4.487 1.00 15.15 C ATOM 567 ND1 HIS A 91 -2.955-105.820 -4.372 1.00 15.71 N ATOM 568 CD2 HIS A 91 -1.906-104.121 -3.482 1.00 15.57 C ATOM 569 CE1 HIS A 91 -2.268-106.281 -3.341 1.00 15.62 C ATOM 570 NE2 HIS A 91 -1.622-105.274 -2.784 1.00 15.84 N ATOM 571 N PRO A 92 -1.867-106.074 -7.495 1.00 16.53 N ATOM 572 CA PRO A 92 -2.032-107.406 -8.088 1.00 17.21 C ATOM 573 C PRO A 92 -3.178-108.244 -7.531 1.00 17.25 C ATOM 574 O PRO A 92 -3.636-109.185 -8.180 1.00 18.22 O ATOM 575 CB PRO A 92 -0.668-108.053 -7.858 1.00 17.66 C ATOM 576 CG PRO A 92 -0.210-107.425 -6.587 1.00 17.98 C ATOM 577 CD PRO A 92 -0.570-105.971 -6.805 1.00 17.19 C ATOM 578 N ASN A 93 -3.652-107.901 -6.338 1.00 16.98 N ATOM 579 CA ASN A 93 -4.736-108.652 -5.722 1.00 17.03 C ATOM 580 C ASN A 93 -6.085-107.934 -5.750 1.00 15.74 C ATOM 581 O ASN A 93 -7.004-108.301 -5.020 1.00 15.14 O ATOM 582 CB ASN A 93 -4.363-109.003 -4.279 1.00 18.92 C ATOM 583 CG ASN A 93 -3.148-109.914 -4.191 1.00 20.87 C ATOM 584 OD1 ASN A 93 -2.547-110.061 -3.126 1.00 23.72 O ATOM 585 ND2 ASN A 93 -2.786-110.535 -5.308 1.00 21.79 N ATOM 586 N PHE A 94 -6.210-106.916 -6.596 1.00 15.05 N ATOM 587 CA PHE A 94 -7.468-106.185 -6.700 1.00 14.50 C ATOM 588 C PHE A 94 -8.590-107.103 -7.176 1.00 14.79 C ATOM 589 O PHE A 94 -8.418-107.870 -8.127 1.00 14.70 O ATOM 590 CB PHE A 94 -7.322-105.005 -7.671 1.00 14.15 C ATOM 591 CG PHE A 94 -8.619-104.307 -7.981 1.00 14.13 C ATOM 592 CD1 PHE A 94 -9.400-103.772 -6.960 1.00 14.10 C ATOM 593 CD2 PHE A 94 -9.057-104.173 -9.295 1.00 14.22 C ATOM 594 CE1 PHE A 94 -10.593-103.115 -7.243 1.00 14.53 C ATOM 595 CE2 PHE A 94 -10.248-103.517 -9.585 1.00 14.05 C ATOM 596 CZ PHE A 94 -11.018-102.988 -8.557 1.00 14.08 C ATOM 597 N ASP A 95 -9.734-107.023 -6.502 1.00 14.89 N ATOM 598 CA ASP A 95 -10.902-107.828 -6.846 1.00 15.87 C ATOM 599 C ASP A 95 -12.009-106.879 -7.305 1.00 16.46 C ATOM 600 O ASP A 95 -12.506-106.071 -6.520 1.00 15.52 O ATOM 601 CB ASP A 95 -11.372-108.625 -5.625 1.00 16.35 C ATOM 602 CG ASP A 95 -12.447-109.636 -5.967 1.00 17.52 C ATOM 603 OD1 ASP A 95 -13.468-109.249 -6.574 1.00 17.66 O ATOM 604 OD2 ASP A 95 -12.273-110.823 -5.618 1.00 19.77 O ATOM 605 N ARG A 96 -12.387-106.991 -8.577 1.00 17.34 N ATOM 606 CA ARG A 96 -13.411-106.141 -9.188 1.00 18.94 C ATOM 607 C ARG A 96 -14.815-106.317 -8.625 1.00 19.12 C ATOM 608 O ARG A 96 -15.690-105.478 -8.857 1.00 19.80 O ATOM 609 CB ARG A 96 -13.468-106.401 -10.697 1.00 20.14 C ATOM 610 CG ARG A 96 -12.202-106.067 -11.452 1.00 22.23 C ATOM 611 CD ARG A 96 -12.241-106.705 -12.834 1.00 23.93 C ATOM 612 NE ARG A 96 -11.046-106.407 -13.614 1.00 25.80 N ATOM 613 CZ ARG A 96 -10.874-105.301 -14.330 1.00 26.25 C ATOM 614 NH1 ARG A 96 -11.825-104.377 -14.375 1.00 27.47 N ATOM 615 NH2 ARG A 96 -9.747-105.121 -15.001 1.00 27.36 N ATOM 616 N LYS A 97 -15.035-107.405 -7.897 1.00 19.24 N ATOM 617 CA LYS A 97 -16.349-107.692 -7.336 1.00 19.62 C ATOM 618 C LYS A 97 -16.475-107.299 -5.863 1.00 18.78 C ATOM 619 O LYS A 97 -17.455-106.674 -5.464 1.00 18.69 O ATOM 620 CB LYS A 97 -16.656-109.185 -7.509 1.00 21.36 C ATOM 621 CG LYS A 97 -18.037-109.618 -7.052 1.00 24.04 C ATOM 622 CD LYS A 97 -18.147-111.133 -7.072 1.00 25.55 C ATOM 623 CE LYS A 97 -19.509-111.604 -6.596 1.00 26.95 C ATOM 624 NZ LYS A 97 -19.556-113.090 -6.472 1.00 28.45 N ATOM 625 N THR A 98 -15.480-107.657 -5.059 1.00 17.58 N ATOM 626 CA THR A 98 -15.512-107.344 -3.631 1.00 16.78 C ATOM 627 C THR A 98 -14.866-105.997 -3.330 1.00 16.15 C ATOM 628 O THR A 98 -15.073-105.430 -2.255 1.00 16.13 O ATOM 629 CB THR A 98 -14.771-108.410 -2.809 1.00 16.91 C ATOM 630 OG1 THR A 98 -13.378-108.373 -3.137 1.00 16.36 O ATOM 631 CG2 THR A 98 -15.318-109.804 -3.113 1.00 17.38 C ATOM 632 N LEU A 99 -14.075-105.506 -4.281 1.00 15.34 N ATOM 633 CA LEU A 99 -13.370-104.232 -4.162 1.00 14.86 C ATOM 634 C LEU A 99 -12.240-104.281 -3.138 1.00 14.09 C ATOM 635 O LEU A 99 -11.765-103.253 -2.658 1.00 13.75 O ATOM 636 CB LEU A 99 -14.356-103.108 -3.832 1.00 16.15 C ATOM 637 CG LEU A 99 -15.404-102.921 -4.935 1.00 17.46 C ATOM 638 CD1 LEU A 99 -16.483-101.967 -4.469 1.00 18.88 C ATOM 639 CD2 LEU A 99 -14.722-102.423 -6.209 1.00 18.13 C ATOM 640 N ASN A 100 -11.806-105.491 -2.809 1.00 13.15 N ATOM 641 CA ASN A 100 -10.703-105.670 -1.877 1.00 13.01 C ATOM 642 C ASN A 100 -9.426-105.249 -2.610 1.00 12.69 C ATOM 643 O ASN A 100 -9.254-105.560 -3.791 1.00 13.06 O ATOM 644 CB ASN A 100 -10.630-107.141 -1.451 1.00 13.41 C ATOM 645 CG ASN A 100 -9.684-107.369 -0.285 1.00 14.09 C ATOM 646 OD1 ASN A 100 -9.578-106.536 0.617 1.00 14.48 O ATOM 647 ND2 ASN A 100 -9.008-108.514 -0.286 1.00 15.61 N ATOM 648 N ASN A 101 -8.544-104.531 -1.915 1.00 12.15 N ATOM 649 CA ASN A 101 -7.283-104.054 -2.488 1.00 12.09 C ATOM 650 C ASN A 101 -7.513-103.042 -3.616 1.00 11.50 C ATOM 651 O ASN A 101 -6.819-103.073 -4.638 1.00 11.69 O ATOM 652 CB ASN A 101 -6.451-105.224 -3.032 1.00 12.50 C ATOM 653 CG ASN A 101 -6.199-106.302 -1.992 1.00 12.55 C ATOM 654 OD1 ASN A 101 -6.609-107.453 -2.163 1.00 14.55 O ATOM 655 ND2 ASN A 101 -5.519-105.940 -0.914 1.00 12.18 N ATOM 656 N ASP A 102 -8.482-102.149 -3.421 1.00 11.39 N ATOM 657 CA ASP A 102 -8.815-101.127 -4.415 1.00 10.67 C ATOM 658 C ASP A 102 -7.826 -99.960 -4.341 1.00 10.88 C ATOM 659 O ASP A 102 -8.134 -98.889 -3.811 1.00 10.57 O ATOM 660 CB ASP A 102 -10.255-100.653 -4.177 1.00 10.59 C ATOM 661 CG ASP A 102 -10.792 -99.794 -5.305 1.00 10.37 C ATOM 662 OD1 ASP A 102 -10.174 -99.758 -6.391 1.00 10.05 O ATOM 663 OD2 ASP A 102 -11.851 -99.164 -5.100 1.00 11.82 O ATOM 664 N ILE A 103 -6.632-100.182 -4.876 1.00 10.40 N ATOM 665 CA ILE A 103 -5.583 -99.173 -4.875 1.00 10.74 C ATOM 666 C ILE A 103 -4.764 -99.303 -6.153 1.00 11.15 C ATOM 667 O ILE A 103 -4.533-100.404 -6.657 1.00 11.25 O ATOM 668 CB ILE A 103 -4.676 -99.311 -3.621 1.00 11.07 C ATOM 669 CG1 ILE A 103 -3.676 -98.156 -3.575 1.00 10.91 C ATOM 670 CG2 ILE A 103 -3.971-100.665 -3.617 1.00 11.52 C ATOM 671 CD1 ILE A 103 -2.917 -98.060 -2.256 1.00 12.81 C ATOM 672 N MET A 104 -4.325 -98.166 -6.671 1.00 11.32 N ATOM 673 CA MET A 104 -3.578 -98.136 -7.919 1.00 11.56 C ATOM 674 C MET A 104 -2.547 -97.015 -7.908 1.00 11.58 C ATOM 675 O MET A 104 -2.777 -95.964 -7.321 1.00 11.88 O ATOM 676 CB MET A 104 -4.584 -97.936 -9.055 1.00 13.51 C ATOM 677 CG MET A 104 -4.032 -97.599 -10.412 1.00 14.69 C ATOM 678 SD MET A 104 -5.409 -97.434 -11.592 1.00 15.62 S ATOM 679 CE MET A 104 -5.858 -95.736 -11.368 1.00 16.20 C ATOM 680 N LEU A 105 -1.407 -97.249 -8.548 1.00 11.68 N ATOM 681 CA LEU A 105 -0.366 -96.236 -8.627 1.00 12.16 C ATOM 682 C LEU A 105 -0.218 -95.763 -10.062 1.00 12.06 C ATOM 683 O LEU A 105 -0.289 -96.562 -11.002 1.00 12.25 O ATOM 684 CB LEU A 105 0.973 -96.790 -8.144 1.00 13.02 C ATOM 685 CG LEU A 105 1.117 -97.018 -6.639 1.00 13.56 C ATOM 686 CD1 LEU A 105 2.387 -97.801 -6.379 1.00 14.11 C ATOM 687 CD2 LEU A 105 1.148 -95.683 -5.903 1.00 14.84 C ATOM 688 N ILE A 106 -0.021 -94.461 -10.221 1.00 12.18 N ATOM 689 CA ILE A 106 0.154 -93.862 -11.534 1.00 12.91 C ATOM 690 C ILE A 106 1.487 -93.129 -11.553 1.00 13.34 C ATOM 691 O ILE A 106 1.741 -92.272 -10.705 1.00 13.14 O ATOM 692 CB ILE A 106 -0.952 -92.830 -11.842 1.00 12.69 C ATOM 693 CG1 ILE A 106 -2.325 -93.501 -11.819 1.00 13.72 C ATOM 694 CG2 ILE A 106 -0.691 -92.178 -13.201 1.00 13.59 C ATOM 695 CD1 ILE A 106 -3.483 -92.522 -11.891 1.00 13.45 C ATOM 696 N LYS A 107 2.346 -93.476 -12.504 1.00 13.85 N ATOM 697 CA LYS A 107 3.624 -92.796 -12.622 1.00 15.29 C ATOM 698 C LYS A 107 3.441 -91.770 -13.732 1.00 15.79 C ATOM 699 O LYS A 107 2.937 -92.099 -14.809 1.00 15.93 O ATOM 700 CB LYS A 107 4.743 -93.771 -12.990 1.00 16.31 C ATOM 701 CG LYS A 107 6.108 -93.104 -12.998 1.00 17.65 C ATOM 702 CD LYS A 107 7.203 -94.038 -13.472 1.00 19.13 C ATOM 703 CE LYS A 107 8.555 -93.350 -13.400 1.00 20.29 C ATOM 704 NZ LYS A 107 9.653 -94.213 -13.923 1.00 21.30 N ATOM 705 N LEU A 108 3.835 -90.530 -13.463 1.00 16.40 N ATOM 706 CA LEU A 108 3.691 -89.451 -14.433 1.00 17.52 C ATOM 707 C LEU A 108 4.782 -89.477 -15.497 1.00 18.36 C ATOM 708 O LEU A 108 5.888 -89.958 -15.251 1.00 18.47 O ATOM 709 CB LEU A 108 3.706 -88.102 -13.711 1.00 17.92 C ATOM 710 CG LEU A 108 2.676 -87.972 -12.585 1.00 18.43 C ATOM 711 CD1 LEU A 108 2.837 -86.637 -11.882 1.00 18.61 C ATOM 712 CD2 LEU A 108 1.281 -88.115 -13.157 1.00 18.79 C ATOM 713 N SER A 109 4.459 -88.953 -16.677 1.00 19.43 N ATOM 714 CA SER A 109 5.402 -88.909 -17.794 1.00 21.05 C ATOM 715 C SER A 109 6.647 -88.102 -17.456 1.00 21.76 C ATOM 716 O SER A 109 7.737 -88.386 -17.953 1.00 22.09 O ATOM 717 CB SER A 109 4.726 -88.316 -19.033 1.00 21.59 C ATOM 718 OG SER A 109 3.707 -89.173 -19.521 1.00 24.19 O ATOM 719 N SER A 110 6.479 -87.084 -16.621 1.00 21.99 N ATOM 720 CA SER A 110 7.597 -86.249 -16.201 1.00 22.68 C ATOM 721 C SER A 110 7.308 -85.708 -14.809 1.00 22.58 C ATOM 722 O SER A 110 6.151 -85.604 -14.403 1.00 22.33 O ATOM 723 CB SER A 110 7.807 -85.092 -17.187 1.00 23.36 C ATOM 724 OG SER A 110 6.648 -84.287 -17.291 1.00 25.06 O ATOM 725 N PRO A 111 8.356 -85.361 -14.052 1.00 22.64 N ATOM 726 CA PRO A 111 8.137 -84.837 -12.701 1.00 22.62 C ATOM 727 C PRO A 111 7.376 -83.515 -12.745 1.00 22.92 C ATOM 728 O PRO A 111 7.553 -82.721 -13.669 1.00 23.07 O ATOM 729 CB PRO A 111 9.557 -84.662 -12.160 1.00 22.81 C ATOM 730 CG PRO A 111 10.372 -85.628 -12.979 1.00 22.92 C ATOM 731 CD PRO A 111 9.793 -85.459 -14.349 1.00 22.75 C ATOM 732 N VAL A 112 6.526 -83.284 -11.752 1.00 23.02 N ATOM 733 CA VAL A 112 5.763 -82.047 -11.692 1.00 23.26 C ATOM 734 C VAL A 112 6.539 -81.023 -10.878 1.00 23.28 C ATOM 735 O VAL A 112 7.454 -81.376 -10.131 1.00 23.39 O ATOM 736 CB VAL A 112 4.385 -82.262 -11.033 1.00 23.72 C ATOM 737 CG1 VAL A 112 3.610 -83.328 -11.794 1.00 23.88 C ATOM 738 CG2 VAL A 112 4.557 -82.665 -9.576 1.00 23.62 C ATOM 739 N LYS A 113 6.181 -79.754 -11.032 1.00 23.39 N ATOM 740 CA LYS A 113 6.841 -78.690 -10.290 1.00 23.79 C ATOM 741 C LYS A 113 6.091 -78.453 -8.986 1.00 23.62 C ATOM 742 O LYS A 113 4.920 -78.075 -8.989 1.00 23.80 O ATOM 743 CB LYS A 113 6.876 -77.403 -11.114 1.00 24.87 C ATOM 744 CG LYS A 113 7.702 -77.504 -12.389 1.00 26.65 C ATOM 745 CD LYS A 113 7.790 -76.153 -13.086 1.00 28.14 C ATOM 746 CE LYS A 113 8.651 -76.220 -14.343 1.00 29.30 C ATOM 747 NZ LYS A 113 8.074 -77.130 -15.375 1.00 30.43 N ATOM 748 N LEU A 114 6.774 -78.677 -7.868 1.00 23.32 N ATOM 749 CA LEU A 114 6.168 -78.500 -6.556 1.00 23.33 C ATOM 750 C LEU A 114 6.199 -77.051 -6.078 1.00 23.68 C ATOM 751 O LEU A 114 7.246 -76.402 -6.081 1.00 24.07 O ATOM 752 CB LEU A 114 6.875 -79.393 -5.533 1.00 23.22 C ATOM 753 CG LEU A 114 6.822 -80.896 -5.817 1.00 22.97 C ATOM 754 CD1 LEU A 114 7.714 -81.639 -4.837 1.00 23.53 C ATOM 755 CD2 LEU A 114 5.381 -81.387 -5.712 1.00 22.97 C ATOM 756 N ASN A 115 5.038 -76.556 -5.666 1.00 23.70 N ATOM 757 CA ASN A 115 4.900 -75.197 -5.161 1.00 23.91 C ATOM 758 C ASN A 115 3.780 -75.181 -4.124 1.00 23.84 C ATOM 759 O ASN A 115 3.369 -76.237 -3.643 1.00 23.75 O ATOM 760 CB ASN A 115 4.603 -74.225 -6.313 1.00 24.42 C ATOM 761 CG ASN A 115 3.400 -74.641 -7.138 1.00 25.12 C ATOM 762 OD1 ASN A 115 2.298 -74.792 -6.613 1.00 26.00 O ATOM 763 ND2 ASN A 115 3.604 -74.820 -8.440 1.00 25.31 N ATOM 764 N ALA A 116 3.287 -73.999 -3.773 1.00 23.52 N ATOM 765 CA ALA A 116 2.225 -73.891 -2.778 1.00 23.83 C ATOM 766 C ALA A 116 0.905 -74.508 -3.235 1.00 23.50 C ATOM 767 O ALA A 116 0.104 -74.945 -2.407 1.00 24.12 O ATOM 768 CB ALA A 116 2.009 -72.429 -2.403 1.00 24.23 C ATOM 769 N ARG A 117 0.684 -74.540 -4.546 1.00 23.18 N ATOM 770 CA ARG A 117 -0.544 -75.091 -5.118 1.00 22.51 C ATOM 771 C ARG A 117 -0.435 -76.572 -5.477 1.00 21.01 C ATOM 772 O ARG A 117 -1.446 -77.241 -5.678 1.00 20.74 O ATOM 773 CB ARG A 117 -0.947 -74.314 -6.380 1.00 24.47 C ATOM 774 CG ARG A 117 -1.418 -72.877 -6.158 1.00 27.19 C ATOM 775 CD ARG A 117 -0.292 -71.956 -5.719 1.00 29.43 C ATOM 776 NE ARG A 117 -0.166 -70.780 -6.580 1.00 31.54 N ATOM 777 CZ ARG A 117 0.423 -70.782 -7.773 1.00 32.48 C ATOM 778 NH1 ARG A 117 0.949 -71.899 -8.259 1.00 33.08 N ATOM 779 NH2 ARG A 117 0.495 -69.661 -8.480 1.00 33.27 N ATOM 780 N VAL A 118 0.790 -77.076 -5.574 1.00 19.09 N ATOM 781 CA VAL A 118 1.017 -78.475 -5.922 1.00 17.39 C ATOM 782 C VAL A 118 2.030 -79.059 -4.951 1.00 16.97 C ATOM 783 O VAL A 118 3.220 -78.750 -5.024 1.00 16.75 O ATOM 784 CB VAL A 118 1.550 -78.606 -7.365 1.00 17.40 C ATOM 785 CG1 VAL A 118 1.769 -80.074 -7.717 1.00 16.82 C ATOM 786 CG2 VAL A 118 0.567 -77.970 -8.333 1.00 17.20 C ATOM 787 N ALA A 119 1.554 -79.904 -4.041 1.00 16.14 N ATOM 788 CA ALA A 119 2.422 -80.509 -3.039 1.00 15.85 C ATOM 789 C ALA A 119 2.061 -81.964 -2.776 1.00 15.64 C ATOM 790 O ALA A 119 0.992 -82.429 -3.161 1.00 15.93 O ATOM 791 CB ALA A 119 2.342 -79.713 -1.745 1.00 16.34 C ATOM 792 N THR A 120 2.959 -82.678 -2.107 1.00 15.22 N ATOM 793 CA THR A 120 2.732 -84.084 -1.801 1.00 15.24 C ATOM 794 C THR A 120 2.092 -84.283 -0.431 1.00 15.04 C ATOM 795 O THR A 120 2.121 -83.395 0.422 1.00 15.72 O ATOM 796 CB THR A 120 4.054 -84.876 -1.813 1.00 15.28 C ATOM 797 OG1 THR A 120 4.941 -84.336 -0.821 1.00 15.94 O ATOM 798 CG2 THR A 120 4.723 -84.790 -3.184 1.00 16.58 C ATOM 799 N VAL A 121 1.495 -85.452 -0.237 1.00 14.06 N ATOM 800 CA VAL A 121 0.890 -85.793 1.041 1.00 13.67 C ATOM 801 C VAL A 121 1.690 -86.987 1.546 1.00 13.29 C ATOM 802 O VAL A 121 2.116 -87.836 0.761 1.00 13.21 O ATOM 803 CB VAL A 121 -0.611 -86.156 0.893 1.00 13.71 C ATOM 804 CG1 VAL A 121 -0.780 -87.386 0.032 1.00 14.33 C ATOM 805 CG2 VAL A 121 -1.231 -86.366 2.264 1.00 14.14 C ATOM 806 N ALA A 122 1.919 -87.036 2.852 1.00 13.35 N ATOM 807 CA ALA A 122 2.695 -88.115 3.439 1.00 13.58 C ATOM 808 C ALA A 122 1.924 -89.421 3.539 1.00 13.91 C ATOM 809 O ALA A 122 0.705 -89.424 3.711 1.00 13.61 O ATOM 810 CB ALA A 122 3.184 -87.701 4.822 1.00 14.12 C ATOM 811 N LEU A 123 2.649 -90.529 3.420 1.00 14.21 N ATOM 812 CA LEU A 123 2.048 -91.844 3.550 1.00 14.65 C ATOM 813 C LEU A 123 1.954 -92.080 5.054 1.00 14.89 C ATOM 814 O LEU A 123 2.725 -91.511 5.829 1.00 15.02 O ATOM 815 CB LEU A 123 2.924 -92.910 2.889 1.00 15.35 C ATOM 816 CG LEU A 123 2.981 -92.891 1.358 1.00 16.17 C ATOM 817 CD1 LEU A 123 3.917 -93.986 0.875 1.00 17.03 C ATOM 818 CD2 LEU A 123 1.588 -93.095 0.784 1.00 16.67 C ATOM 819 N PRO A 124 1.008 -92.920 5.490 1.00 14.84 N ATOM 820 CA PRO A 124 0.851 -93.187 6.921 1.00 15.02 C ATOM 821 C PRO A 124 2.045 -93.826 7.622 1.00 14.95 C ATOM 822 O PRO A 124 2.719 -94.691 7.061 1.00 14.97 O ATOM 823 CB PRO A 124 -0.394 -94.065 6.971 1.00 15.88 C ATOM 824 CG PRO A 124 -0.355 -94.786 5.668 1.00 15.65 C ATOM 825 CD PRO A 124 0.061 -93.719 4.693 1.00 15.08 C ATOM 826 N SER A 125 2.292 -93.377 8.852 1.00 15.46 N ATOM 827 CA SER A 125 3.382 -93.889 9.683 1.00 16.34 C ATOM 828 C SER A 125 2.857 -95.125 10.399 1.00 16.01 C ATOM 829 O SER A 125 3.623 -95.972 10.862 1.00 16.18 O ATOM 830 CB SER A 125 3.788 -92.853 10.736 1.00 17.23 C ATOM 831 OG SER A 125 4.067 -91.594 10.155 1.00 21.59 O ATOM 832 N SER A 127 1.534 -95.201 10.492 1.00 16.15 N ATOM 833 CA SER A 127 0.842 -96.304 11.142 1.00 16.08 C ATOM 834 C SER A 127 -0.638 -96.162 10.818 1.00 16.08 C ATOM 835 O SER A 127 -1.043 -95.189 10.188 1.00 16.04 O ATOM 836 CB SER A 127 1.037 -96.240 12.658 1.00 16.53 C ATOM 837 OG SER A 127 0.436 -95.075 13.192 1.00 18.21 O ATOM 838 N CYS A 128 -1.442 -97.130 11.240 1.00 15.62 N ATOM 839 CA CYS A 128 -2.872 -97.069 10.987 1.00 15.40 C ATOM 840 C CYS A 128 -3.534 -96.198 12.045 1.00 15.87 C ATOM 841 O CYS A 128 -3.379 -96.434 13.244 1.00 16.42 O ATOM 842 CB CYS A 128 -3.483 -98.469 11.021 1.00 14.76 C ATOM 843 SG CYS A 128 -2.837 -99.637 9.784 1.00 14.28 S ATOM 844 N ALA A 129 -4.263 -95.183 11.597 1.00 15.54 N ATOM 845 CA ALA A 129 -4.948 -94.281 12.513 1.00 16.26 C ATOM 846 C ALA A 129 -6.109 -94.994 13.198 1.00 16.47 C ATOM 847 O ALA A 129 -6.849 -95.754 12.567 1.00 17.00 O ATOM 848 CB ALA A 129 -5.451 -93.062 11.759 1.00 16.07 C ATOM 849 N PRO A 130 -6.287 -94.753 14.506 1.00 16.61 N ATOM 850 CA PRO A 130 -7.363 -95.377 15.276 1.00 16.42 C ATOM 851 C PRO A 130 -8.732 -94.778 14.994 1.00 16.12 C ATOM 852 O PRO A 130 -8.846 -93.648 14.517 1.00 15.32 O ATOM 853 CB PRO A 130 -6.918 -95.154 16.717 1.00 17.14 C ATOM 854 CG PRO A 130 -6.262 -93.818 16.643 1.00 17.41 C ATOM 855 CD PRO A 130 -5.428 -93.931 15.376 1.00 16.94 C ATOM 856 N ALA A 132 -9.771 -95.550 15.284 1.00 16.12 N ATOM 857 CA ALA A 132 -11.130 -95.092 15.080 1.00 16.09 C ATOM 858 C ALA A 132 -11.324 -93.828 15.910 1.00 16.31 C ATOM 859 O ALA A 132 -10.782 -93.709 17.014 1.00 16.52 O ATOM 860 CB ALA A 132 -12.117 -96.172 15.515 1.00 16.40 C ATOM 861 N GLY A 133 -12.079 -92.880 15.368 1.00 15.66 N ATOM 862 CA GLY A 133 -12.327 -91.640 16.077 1.00 16.02 C ATOM 863 C GLY A 133 -11.469 -90.500 15.573 1.00 15.73 C ATOM 864 O GLY A 133 -11.753 -89.338 15.855 1.00 16.82 O ATOM 865 N THR A 134 -10.416 -90.827 14.833 1.00 14.81 N ATOM 866 CA THR A 134 -9.525 -89.811 14.289 1.00 14.36 C ATOM 867 C THR A 134 -10.263 -88.967 13.251 1.00 14.21 C ATOM 868 O THR A 134 -10.897 -89.506 12.340 1.00 14.28 O ATOM 869 CB THR A 134 -8.288 -90.452 13.629 1.00 14.04 C ATOM 870 OG1 THR A 134 -7.597 -91.262 14.591 1.00 13.47 O ATOM 871 CG2 THR A 134 -7.343 -89.378 13.116 1.00 14.35 C ATOM 872 N GLN A 135 -10.199 -87.646 13.408 1.00 14.06 N ATOM 873 CA GLN A 135 -10.846 -86.720 12.479 1.00 14.64 C ATOM 874 C GLN A 135 -10.025 -86.614 11.203 1.00 13.89 C ATOM 875 O GLN A 135 -8.805 -86.497 11.257 1.00 14.28 O ATOM 876 CB GLN A 135 -10.972 -85.331 13.107 1.00 16.26 C ATOM 877 CG GLN A 135 -12.297 -85.049 13.792 1.00 20.24 C ATOM 878 CD GLN A 135 -13.480 -85.094 12.837 1.00 21.13 C ATOM 879 OE1 GLN A 135 -13.999 -86.164 12.531 1.00 23.94 O ATOM 880 NE2 GLN A 135 -13.905 -83.929 12.356 1.00 22.21 N ATOM 881 N CYS A 136 -10.692 -86.638 10.054 1.00 13.07 N ATOM 882 CA CYS A 136 -9.978 -86.565 8.787 1.00 12.98 C ATOM 883 C CYS A 136 -10.637 -85.603 7.818 1.00 12.75 C ATOM 884 O CYS A 136 -11.737 -85.113 8.060 1.00 13.33 O ATOM 885 CB CYS A 136 -9.925 -87.944 8.137 1.00 13.13 C ATOM 886 SG CYS A 136 -9.359 -89.291 9.225 1.00 14.98 S ATOM 887 N LEU A 137 -9.946 -85.347 6.713 1.00 12.24 N ATOM 888 CA LEU A 137 -10.443 -84.463 5.673 1.00 11.85 C ATOM 889 C LEU A 137 -10.578 -85.238 4.369 1.00 11.60 C ATOM 890 O LEU A 137 -9.602 -85.815 3.879 1.00 11.03 O ATOM 891 CB LEU A 137 -9.486 -83.292 5.451 1.00 12.60 C ATOM 892 CG LEU A 137 -9.930 -82.329 4.342 1.00 13.44 C ATOM 893 CD1 LEU A 137 -11.238 -81.661 4.732 1.00 13.99 C ATOM 894 CD2 LEU A 137 -8.852 -81.291 4.099 1.00 14.42 C ATOM 895 N ILE A 138 -11.788 -85.241 3.818 1.00 10.92 N ATOM 896 CA ILE A 138 -12.072 -85.917 2.554 1.00 11.81 C ATOM 897 C ILE A 138 -12.319 -84.837 1.507 1.00 11.43 C ATOM 898 O ILE A 138 -13.005 -83.855 1.774 1.00 12.53 O ATOM 899 CB ILE A 138 -13.336 -86.785 2.654 1.00 12.59 C ATOM 900 CG1 ILE A 138 -13.211 -87.754 3.831 1.00 13.69 C ATOM 901 CG2 ILE A 138 -13.544 -87.542 1.346 1.00 13.56 C ATOM 902 CD1 ILE A 138 -14.488 -88.492 4.130 1.00 15.73 C ATOM 903 N SER A 139 -11.764 -85.011 0.317 1.00 11.13 N ATOM 904 CA SER A 139 -11.948 -84.010 -0.727 1.00 11.16 C ATOM 905 C SER A 139 -12.189 -84.620 -2.103 1.00 11.45 C ATOM 906 O SER A 139 -11.781 -85.751 -2.372 1.00 11.75 O ATOM 907 CB SER A 139 -10.728 -83.086 -0.767 1.00 11.92 C ATOM 908 OG SER A 139 -9.524 -83.832 -0.821 1.00 10.93 O ATOM 909 N GLY A 140 -12.861 -83.861 -2.966 1.00 11.13 N ATOM 910 CA GLY A 140 -13.152 -84.340 -4.308 1.00 11.70 C ATOM 911 C GLY A 140 -14.144 -83.448 -5.028 1.00 12.78 C ATOM 912 O GLY A 140 -14.739 -82.559 -4.422 1.00 12.11 O ATOM 913 N TRP A 141 -14.326 -83.683 -6.326 1.00 13.15 N ATOM 914 CA TRP A 141 -15.255 -82.886 -7.124 1.00 14.54 C ATOM 915 C TRP A 141 -16.605 -83.578 -7.304 1.00 16.55 C ATOM 916 O TRP A 141 -17.458 -83.108 -8.060 1.00 17.63 O ATOM 917 CB TRP A 141 -14.632 -82.587 -8.489 1.00 13.22 C ATOM 918 CG TRP A 141 -13.601 -81.496 -8.453 1.00 12.20 C ATOM 919 CD1 TRP A 141 -13.831 -80.152 -8.528 1.00 11.27 C ATOM 920 CD2 TRP A 141 -12.182 -81.651 -8.325 1.00 11.16 C ATOM 921 NE1 TRP A 141 -12.648 -79.462 -8.457 1.00 11.55 N ATOM 922 CE2 TRP A 141 -11.617 -80.356 -8.330 1.00 11.32 C ATOM 923 CE3 TRP A 141 -11.330 -82.758 -8.204 1.00 11.34 C ATOM 924 CZ2 TRP A 141 -10.240 -80.134 -8.223 1.00 11.28 C ATOM 925 CZ3 TRP A 141 -9.961 -82.541 -8.097 1.00 11.60 C ATOM 926 CH2 TRP A 141 -9.428 -81.234 -8.105 1.00 11.33 C ATOM 927 N GLY A 142 -16.795 -84.684 -6.591 1.00 17.89 N ATOM 928 CA GLY A 142 -18.031 -85.446 -6.674 1.00 20.58 C ATOM 929 C GLY A 142 -19.303 -84.704 -6.307 1.00 22.19 C ATOM 930 O GLY A 142 -20.290 -84.818 -7.068 1.00 23.99 O ATOM 931 N ASP A 153 -17.399 -75.896 -11.135 1.00 18.95 N ATOM 932 CA ASP A 153 -17.099 -77.222 -10.505 1.00 18.24 C ATOM 933 C ASP A 153 -15.908 -77.058 -9.564 1.00 17.12 C ATOM 934 O ASP A 153 -14.760 -77.269 -9.954 1.00 16.32 O ATOM 935 CB ASP A 153 -16.763 -78.248 -11.586 1.00 20.72 C ATOM 936 CG ASP A 153 -17.222 -79.641 -11.222 1.00 22.78 C ATOM 937 OD1 ASP A 153 -17.068 -80.032 -10.045 1.00 23.92 O ATOM 938 OD2 ASP A 153 -17.731 -80.350 -12.117 1.00 25.11 O ATOM 939 N LEU A 154 -16.196 -76.692 -8.318 1.00 16.42 N ATOM 940 CA LEU A 154 -15.163 -76.449 -7.321 1.00 15.40 C ATOM 941 C LEU A 154 -14.910 -77.627 -6.385 1.00 14.79 C ATOM 942 O LEU A 154 -15.819 -78.389 -6.070 1.00 14.93 O ATOM 943 CB LEU A 154 -15.545 -75.218 -6.501 1.00 16.07 C ATOM 944 CG LEU A 154 -16.004 -74.024 -7.346 1.00 16.70 C ATOM 945 CD1 LEU A 154 -16.432 -72.892 -6.433 1.00 17.16 C ATOM 946 CD2 LEU A 154 -14.886 -73.573 -8.265 1.00 16.90 C ATOM 947 N LEU A 155 -13.664 -77.756 -5.940 1.00 14.02 N ATOM 948 CA LEU A 155 -13.274 -78.841 -5.045 1.00 13.48 C ATOM 949 C LEU A 155 -14.037 -78.764 -3.727 1.00 13.58 C ATOM 950 O LEU A 155 -14.088 -77.711 -3.084 1.00 13.73 O ATOM 951 CB LEU A 155 -11.769 -78.787 -4.777 1.00 13.39 C ATOM 952 CG LEU A 155 -11.181 -79.939 -3.958 1.00 13.10 C ATOM 953 CD1 LEU A 155 -11.277 -81.237 -4.753 1.00 13.07 C ATOM 954 CD2 LEU A 155 -9.732 -79.631 -3.613 1.00 13.85 C ATOM 955 N GLN A 156 -14.623 -79.888 -3.331 1.00 13.01 N ATOM 956 CA GLN A 156 -15.400 -79.968 -2.099 1.00 13.11 C ATOM 957 C GLN A 156 -14.621 -80.642 -0.978 1.00 13.16 C ATOM 958 O GLN A 156 -13.810 -81.539 -1.215 1.00 12.97 O ATOM 959 CB GLN A 156 -16.705 -80.727 -2.348 1.00 14.01 C ATOM 960 CG GLN A 156 -17.582 -80.090 -3.406 1.00 15.91 C ATOM 961 CD GLN A 156 -18.021 -78.695 -3.025 1.00 16.96 C ATOM 962 OE1 GLN A 156 -18.786 -78.510 -2.078 1.00 18.55 O ATOM 963 NE2 GLN A 156 -17.534 -77.701 -3.756 1.00 17.79 N ATOM 964 N CYS A 157 -14.890 -80.195 0.244 1.00 12.92 N ATOM 965 CA CYS A 157 -14.226 -80.699 1.437 1.00 12.87 C ATOM 966 C CYS A 157 -15.223 -81.223 2.461 1.00 13.01 C ATOM 967 O CYS A 157 -16.362 -80.768 2.524 1.00 14.02 O ATOM 968 CB CYS A 157 -13.378 -79.581 2.061 1.00 12.96 C ATOM 969 SG CYS A 157 -11.699 -79.487 1.369 1.00 12.86 S ATOM 970 N LEU A 158 -14.784 -82.187 3.263 1.00 12.90 N ATOM 971 CA LEU A 158 -15.638 -82.763 4.289 1.00 13.12 C ATOM 972 C LEU A 158 -14.804 -83.236 5.466 1.00 13.10 C ATOM 973 O LEU A 158 -13.832 -83.966 5.292 1.00 12.80 O ATOM 974 CB LEU A 158 -16.431 -83.947 3.729 1.00 14.48 C ATOM 975 CG LEU A 158 -17.360 -84.665 4.716 1.00 15.88 C ATOM 976 CD1 LEU A 158 -18.454 -83.709 5.175 1.00 16.92 C ATOM 977 CD2 LEU A 158 -17.971 -85.892 4.051 1.00 16.90 C ATOM 978 N ASP A 159 -15.181 -82.806 6.665 1.00 12.88 N ATOM 979 CA ASP A 159 -14.478 -83.224 7.868 1.00 13.56 C ATOM 980 C ASP A 159 -15.287 -84.376 8.443 1.00 13.33 C ATOM 981 O ASP A 159 -16.478 -84.231 8.723 1.00 13.58 O ATOM 982 CB ASP A 159 -14.395 -82.068 8.865 1.00 14.22 C ATOM 983 CG ASP A 159 -13.609 -80.893 8.323 1.00 15.68 C ATOM 984 OD1 ASP A 159 -12.394 -81.043 8.083 1.00 17.24 O ATOM 985 OD2 ASP A 159 -14.206 -79.817 8.131 1.00 16.97 O ATOM 986 N ALA A 160 -14.645 -85.527 8.599 1.00 12.92 N ATOM 987 CA ALA A 160 -15.331 -86.706 9.106 1.00 13.15 C ATOM 988 C ALA A 160 -14.353 -87.637 9.802 1.00 13.03 C ATOM 989 O ALA A 160 -13.168 -87.668 9.473 1.00 13.30 O ATOM 990 CB ALA A 160 -16.024 -87.436 7.961 1.00 13.01 C ATOM 991 N PRO A 161 -14.849 -88.426 10.765 1.00 13.67 N ATOM 992 CA PRO A 161 -14.011 -89.360 11.516 1.00 13.79 C ATOM 993 C PRO A 161 -13.977 -90.782 10.982 1.00 14.01 C ATOM 994 O PRO A 161 -14.907 -91.237 10.312 1.00 13.75 O ATOM 995 CB PRO A 161 -14.645 -89.326 12.892 1.00 14.45 C ATOM 996 CG PRO A 161 -16.104 -89.329 12.538 1.00 14.25 C ATOM 997 CD PRO A 161 -16.189 -88.334 11.372 1.00 14.15 C ATOM 998 N LEU A 162 -12.896 -91.481 11.303 1.00 14.50 N ATOM 999 CA LEU A 162 -12.760 -92.879 10.932 1.00 15.20 C ATOM 1000 C LEU A 162 -13.693 -93.574 11.917 1.00 15.72 C ATOM 1001 O LEU A 162 -13.678 -93.265 13.110 1.00 16.11 O ATOM 1002 CB LEU A 162 -11.326 -93.359 11.156 1.00 15.78 C ATOM 1003 CG LEU A 162 -10.224 -92.644 10.375 1.00 17.06 C ATOM 1004 CD1 LEU A 162 -8.877 -93.249 10.728 1.00 17.57 C ATOM 1005 CD2 LEU A 162 -10.488 -92.771 8.885 1.00 17.83 C ATOM 1006 N LEU A 163 -14.516 -94.489 11.423 1.00 15.47 N ATOM 1007 CA LEU A 163 -15.459 -95.201 12.277 1.00 16.16 C ATOM 1008 C LEU A 163 -14.910 -96.532 12.780 1.00 16.62 C ATOM 1009 O LEU A 163 -14.001 -97.115 12.183 1.00 16.43 O ATOM 1010 CB LEU A 163 -16.762 -95.447 11.513 1.00 16.55 C ATOM 1011 CG LEU A 163 -17.532 -94.197 11.081 1.00 17.07 C ATOM 1012 CD1 LEU A 163 -18.664 -94.589 10.148 1.00 17.42 C ATOM 1013 CD2 LEU A 163 -18.070 -93.477 12.306 1.00 18.20 C ATOM 1014 N PRO A 164 -15.442 -97.020 13.911 1.00 17.08 N ATOM 1015 CA PRO A 164 -14.981 -98.300 14.455 1.00 17.81 C ATOM 1016 C PRO A 164 -15.292 -99.392 13.433 1.00 18.17 C ATOM 1017 O PRO A 164 -16.342 -99.363 12.795 1.00 18.63 O ATOM 1018 CB PRO A 164 -15.816 -98.456 15.721 1.00 17.80 C ATOM 1019 CG PRO A 164 -16.051 -97.052 16.151 1.00 17.82 C ATOM 1020 CD PRO A 164 -16.363 -96.350 14.845 1.00 17.82 C ATOM 1021 N GLN A 165 -14.387-100.351 13.283 1.00 19.11 N ATOM 1022 CA GLN A 165 -14.587-101.432 12.323 1.00 19.96 C ATOM 1023 C GLN A 165 -15.893-102.171 12.607 1.00 19.97 C ATOM 1024 O GLN A 165 -16.584-102.607 11.687 1.00 19.57 O ATOM 1025 CB GLN A 165 -13.405-102.402 12.376 1.00 21.16 C ATOM 1026 CG GLN A 165 -13.201-103.225 11.111 1.00 22.78 C ATOM 1027 CD GLN A 165 -12.923-102.369 9.882 1.00 23.60 C ATOM 1028 OE1 GLN A 165 -12.575-101.191 9.992 1.00 24.10 O ATOM 1029 NE2 GLN A 165 -13.062-102.965 8.704 1.00 24.55 N ATOM 1030 N ALA A 166 -16.233-102.304 13.886 1.00 20.33 N ATOM 1031 CA ALA A 166 -17.462-102.984 14.273 1.00 20.89 C ATOM 1032 C ALA A 166 -18.691-102.324 13.650 1.00 21.13 C ATOM 1033 O ALA A 166 -19.597-103.011 13.183 1.00 21.14 O ATOM 1034 CB ALA A 166 -17.592-103.006 15.791 1.00 21.35 C ATOM 1035 N ASP A 167 -18.722-100.994 13.635 1.00 20.81 N ATOM 1036 CA ASP A 167 -19.859-100.277 13.058 1.00 21.05 C ATOM 1037 C ASP A 167 -19.868-100.381 11.536 1.00 20.34 C ATOM 1038 O ASP A 167 -20.929-100.446 10.911 1.00 20.35 O ATOM 1039 CB ASP A 167 -19.836 -98.801 13.471 1.00 22.50 C ATOM 1040 CG ASP A 167 -20.054 -98.608 14.961 1.00 23.90 C ATOM 1041 OD1 ASP A 167 -20.972 -99.248 15.515 1.00 25.34 O ATOM 1042 OD2 ASP A 167 -19.317 -97.806 15.575 1.00 25.12 O ATOM 1043 N CYS A 168 -18.679-100.387 10.948 1.00 19.43 N ATOM 1044 CA CYS A 168 -18.531-100.498 9.501 1.00 18.74 C ATOM 1045 C CYS A 168 -19.115-101.837 9.083 1.00 19.43 C ATOM 1046 O CYS A 168 -19.925-101.918 8.163 1.00 19.36 O ATOM 1047 CB CYS A 168 -17.055-100.453 9.140 1.00 17.68 C ATOM 1048 SG CYS A 168 -16.629-100.162 7.395 1.00 15.73 S ATOM 1049 N GLU A 169 -18.694-102.886 9.776 1.00 20.10 N ATOM 1050 CA GLU A 169 -19.165-104.234 9.492 1.00 21.37 C ATOM 1051 C GLU A 169 -20.670-104.373 9.695 1.00 21.08 C ATOM 1052 O GLU A 169 -21.336-105.077 8.938 1.00 21.74 O ATOM 1053 CB GLU A 169 -18.415-105.237 10.372 1.00 22.69 C ATOM 1054 CG GLU A 169 -17.046-105.624 9.819 1.00 25.80 C ATOM 1055 CD GLU A 169 -16.177-106.344 10.831 1.00 27.26 C ATOM 1056 OE1 GLU A 169 -16.729-107.058 11.695 1.00 28.92 O ATOM 1057 OE2 GLU A 169 -14.936-106.207 10.755 1.00 28.73 O ATOM 1058 N ALA A 170 -21.203-103.699 10.709 1.00 20.61 N ATOM 1059 CA ALA A 170 -22.632-103.760 11.000 1.00 20.37 C ATOM 1060 C ALA A 170 -23.457-103.084 9.903 1.00 20.34 C ATOM 1061 O ALA A 170 -24.603-103.462 9.654 1.00 20.98 O ATOM 1062 CB ALA A 170 -22.916-103.109 12.348 1.00 20.84 C ATOM 1063 N SER A 171 -22.865-102.092 9.246 1.00 19.53 N ATOM 1064 CA SER A 171 -23.538-101.364 8.174 1.00 18.71 C ATOM 1065 C SER A 171 -23.471-102.131 6.857 1.00 17.98 C ATOM 1066 O SER A 171 -24.376-102.038 6.029 1.00 17.50 O ATOM 1067 CB SER A 171 -22.898 -99.987 7.987 1.00 18.78 C ATOM 1068 OG SER A 171 -23.110 -99.160 9.119 1.00 19.57 O ATOM 1069 N TYR A 172 -22.389-102.881 6.675 1.00 17.43 N ATOM 1070 CA TYR A 172 -22.183-103.666 5.461 1.00 17.34 C ATOM 1071 C TYR A 172 -21.906-105.128 5.799 1.00 17.80 C ATOM 1072 O TYR A 172 -20.804-105.630 5.584 1.00 17.56 O ATOM 1073 CB TYR A 172 -21.009-103.100 4.652 1.00 16.38 C ATOM 1074 CG TYR A 172 -21.223-101.700 4.125 1.00 15.31 C ATOM 1075 CD1 TYR A 172 -20.875-100.579 4.884 1.00 14.75 C ATOM 1076 CD2 TYR A 172 -21.770-101.491 2.859 1.00 14.91 C ATOM 1077 CE1 TYR A 172 -21.065 -99.286 4.389 1.00 14.49 C ATOM 1078 CE2 TYR A 172 -21.962-100.208 2.359 1.00 14.69 C ATOM 1079 CZ TYR A 172 -21.609 -99.111 3.125 1.00 14.07 C ATOM 1080 OH TYR A 172 -21.797 -97.850 2.614 1.00 13.70 O ATOM 1081 N PRO A 173 -22.919-105.834 6.324 1.00 18.52 N ATOM 1082 CA PRO A 173 -22.817-107.244 6.705 1.00 19.18 C ATOM 1083 C PRO A 173 -22.079-108.146 5.718 1.00 19.29 C ATOM 1084 O PRO A 173 -22.532-108.352 4.590 1.00 19.95 O ATOM 1085 CB PRO A 173 -24.276-107.655 6.872 1.00 19.38 C ATOM 1086 CG PRO A 173 -24.905-106.412 7.395 1.00 19.58 C ATOM 1087 CD PRO A 173 -24.295-105.342 6.515 1.00 18.97 C ATOM 1088 N GLY A 174 -20.943-108.679 6.162 1.00 19.39 N ATOM 1089 CA GLY A 174 -20.141-109.580 5.349 1.00 19.71 C ATOM 1090 C GLY A 174 -19.482-109.015 4.104 1.00 19.71 C ATOM 1091 O GLY A 174 -19.042-109.775 3.240 1.00 20.68 O ATOM 1092 N LYS A 175 -19.384-107.694 4.007 1.00 19.10 N ATOM 1093 CA LYS A 175 -18.778-107.077 2.828 1.00 18.62 C ATOM 1094 C LYS A 175 -17.494-106.308 3.116 1.00 18.23 C ATOM 1095 O LYS A 175 -16.836-105.826 2.193 1.00 17.95 O ATOM 1096 CB LYS A 175 -19.783-106.130 2.165 1.00 19.39 C ATOM 1097 CG LYS A 175 -21.118-106.764 1.806 1.00 20.55 C ATOM 1098 CD LYS A 175 -20.946-107.901 0.821 1.00 22.20 C ATOM 1099 CE LYS A 175 -22.286-108.501 0.428 1.00 23.32 C ATOM 1100 NZ LYS A 175 -22.123-109.613 -0.554 1.00 24.78 N ATOM 1101 N ILE A 176 -17.133-106.196 4.388 1.00 17.51 N ATOM 1102 CA ILE A 176 -15.940-105.452 4.775 1.00 17.24 C ATOM 1103 C ILE A 176 -14.726-106.326 5.076 1.00 17.48 C ATOM 1104 O ILE A 176 -14.806-107.263 5.872 1.00 18.37 O ATOM 1105 CB ILE A 176 -16.235-104.577 6.019 1.00 17.14 C ATOM 1106 CG1 ILE A 176 -17.423-103.656 5.730 1.00 17.05 C ATOM 1107 CG2 ILE A 176 -14.998-103.775 6.409 1.00 17.48 C ATOM 1108 CD1 ILE A 176 -17.201-102.698 4.574 1.00 17.05 C ATOM 1109 N THR A 177 -13.599-106.015 4.439 1.00 16.44 N ATOM 1110 CA THR A 177 -12.368-106.765 4.671 1.00 16.32 C ATOM 1111 C THR A 177 -11.434-105.922 5.534 1.00 16.59 C ATOM 1112 O THR A 177 -11.720-104.756 5.810 1.00 16.27 O ATOM 1113 CB THR A 177 -11.638-107.102 3.353 1.00 16.33 C ATOM 1114 OG1 THR A 177 -11.027-105.919 2.824 1.00 15.27 O ATOM 1115 CG2 THR A 177 -12.615-107.658 2.333 1.00 16.23 C ATOM 1116 N ASP A 178 -10.318-106.507 5.955 1.00 17.27 N ATOM 1117 CA ASP A 178 -9.346-105.795 6.778 1.00 18.15 C ATOM 1118 C ASP A 178 -8.661-104.663 6.011 1.00 17.43 C ATOM 1119 O ASP A 178 -7.973-103.837 6.608 1.00 17.11 O ATOM 1120 CB ASP A 178 -8.273-106.757 7.299 1.00 21.22 C ATOM 1121 CG ASP A 178 -8.828-107.792 8.257 1.00 23.72 C ATOM 1122 OD1 ASP A 178 -9.423-107.399 9.285 1.00 25.90 O ATOM 1123 OD2 ASP A 178 -8.664-109.001 7.983 1.00 26.23 O ATOM 1124 N ASN A 179 -8.848-104.625 4.695 1.00 15.74 N ATOM 1125 CA ASN A 179 -8.223-103.583 3.883 1.00 14.73 C ATOM 1126 C ASN A 179 -9.157-102.419 3.605 1.00 13.92 C ATOM 1127 O ASN A 179 -8.894-101.597 2.723 1.00 13.53 O ATOM 1128 CB ASN A 179 -7.727-104.171 2.561 1.00 14.86 C ATOM 1129 CG ASN A 179 -6.688-105.253 2.766 1.00 15.35 C ATOM 1130 OD1 ASN A 179 -5.737-105.074 3.526 1.00 15.41 O ATOM 1131 ND2 ASN A 179 -6.862-106.381 2.086 1.00 16.58 N ATOM 1132 N MET A 180 -10.246-102.354 4.363 1.00 13.38 N ATOM 1133 CA MET A 180 -11.229-101.295 4.204 1.00 12.57 C ATOM 1134 C MET A 180 -11.538-100.645 5.540 1.00 12.91 C ATOM 1135 O MET A 180 -11.424-101.276 6.595 1.00 13.32 O ATOM 1136 CB MET A 180 -12.528-101.857 3.640 1.00 12.48 C ATOM 1137 CG MET A 180 -12.390-102.621 2.344 1.00 12.39 C ATOM 1138 SD MET A 180 -13.964-103.380 1.912 1.00 12.56 S ATOM 1139 CE MET A 180 -13.465-104.334 0.481 1.00 13.07 C ATOM 1140 N VAL A 181 -11.937 -99.382 5.483 1.00 12.32 N ATOM 1141 CA VAL A 181 -12.308 -98.641 6.673 1.00 12.68 C ATOM 1142 C VAL A 181 -13.460 -97.729 6.295 1.00 12.85 C ATOM 1143 O VAL A 181 -13.527 -97.230 5.168 1.00 13.06 O ATOM 1144 CB VAL A 181 -11.135 -97.786 7.222 1.00 12.82 C ATOM 1145 CG1 VAL A 181 -10.677 -96.773 6.182 1.00 12.77 C ATOM 1146 CG2 VAL A 181 -11.574 -97.071 8.485 1.00 14.32 C ATOM 1147 N CYS A 182 -14.389 -97.533 7.221 1.00 12.37 N ATOM 1148 CA CYS A 182 -15.513 -96.647 6.964 1.00 12.49 C ATOM 1149 C CYS A 182 -15.157 -95.290 7.548 1.00 12.47 C ATOM 1150 O CYS A 182 -14.507 -95.204 8.591 1.00 12.80 O ATOM 1151 CB CYS A 182 -16.788 -97.143 7.642 1.00 13.36 C ATOM 1152 SG CYS A 182 -17.699 -98.522 6.877 1.00 14.29 S ATOM 1153 N VAL A 183 -15.582 -94.237 6.864 1.00 12.34 N ATOM 1154 CA VAL A 183 -15.339 -92.871 7.302 1.00 13.03 C ATOM 1155 C VAL A 183 -16.641 -92.123 7.060 1.00 13.19 C ATOM 1156 O VAL A 183 -17.262 -92.274 6.006 1.00 13.42 O ATOM 1157 CB VAL A 183 -14.212 -92.201 6.483 1.00 12.74 C ATOM 1158 CG1 VAL A 183 -13.966 -90.785 6.994 1.00 13.70 C ATOM 1159 CG2 VAL A 183 -12.938 -93.025 6.575 1.00 12.88 C ATOM 1160 N GLY A 184 -17.066 -91.331 8.037 1.00 13.73 N ATOM 1161 CA GLY A 184 -18.300 -90.589 7.877 1.00 14.99 C ATOM 1162 C GLY A 184 -19.196 -90.606 9.098 1.00 16.01 C ATOM 1163 O GLY A 184 -18.721 -90.594 10.235 1.00 16.18 O ATOM 1164 N PHE A 184A -20.502 -90.646 8.856 1.00 16.98 N ATOM 1165 CA PHE A 184A -21.481 -90.636 9.933 1.00 18.56 C ATOM 1166 C PHE A 184A -22.563 -91.689 9.722 1.00 19.19 C ATOM 1167 O PHE A 184A -23.077 -91.858 8.616 1.00 19.35 O ATOM 1168 CB PHE A 184A -22.123 -89.250 10.033 1.00 19.34 C ATOM 1169 CG PHE A 184A -21.131 -88.123 9.984 1.00 20.00 C ATOM 1170 CD1 PHE A 184A -20.605 -87.690 8.769 1.00 20.19 C ATOM 1171 CD2 PHE A 184A -20.690 -87.522 11.156 1.00 20.31 C ATOM 1172 CE1 PHE A 184A -19.649 -86.672 8.724 1.00 20.57 C ATOM 1173 CE2 PHE A 184A -19.735 -86.504 11.123 1.00 20.83 C ATOM 1174 CZ PHE A 184A -19.214 -86.081 9.904 1.00 20.64 C ATOM 1175 N LEU A 185 -22.911 -92.387 10.796 1.00 20.00 N ATOM 1176 CA LEU A 185 -23.925 -93.430 10.729 1.00 21.11 C ATOM 1177 C LEU A 185 -25.319 -92.872 10.462 1.00 21.80 C ATOM 1178 O LEU A 185 -26.212 -93.606 10.031 1.00 22.04 O ATOM 1179 CB LEU A 185 -23.918 -94.252 12.022 1.00 21.38 C ATOM 1180 CG LEU A 185 -22.640 -95.049 12.306 1.00 21.70 C ATOM 1181 CD1 LEU A 185 -22.758 -95.756 13.650 1.00 22.54 C ATOM 1182 CD2 LEU A 185 -22.408 -96.062 11.193 1.00 21.98 C ATOM 1183 N GLU A 186 -25.510 -91.578 10.712 1.00 22.91 N ATOM 1184 CA GLU A 186 -26.809 -90.956 10.473 1.00 23.79 C ATOM 1185 C GLU A 186 -26.885 -90.444 9.039 1.00 23.77 C ATOM 1186 O GLU A 186 -27.923 -89.946 8.605 1.00 24.08 O ATOM 1187 CB GLU A 186 -27.049 -89.784 11.432 1.00 25.13 C ATOM 1188 CG GLU A 186 -26.328 -89.885 12.760 1.00 27.23 C ATOM 1189 CD GLU A 186 -24.898 -89.394 12.671 1.00 28.09 C ATOM 1190 OE1 GLU A 186 -24.700 -88.189 12.400 1.00 29.96 O ATOM 1191 OE2 GLU A 186 -23.972 -90.209 12.867 1.00 28.68 O ATOM 1192 N GLY A 187 -25.782 -90.571 8.306 1.00 23.11 N ATOM 1193 CA GLY A 187 -25.751 -90.107 6.930 1.00 22.91 C ATOM 1194 C GLY A 187 -25.716 -88.593 6.858 1.00 22.46 C ATOM 1195 O GLY A 187 -25.317 -87.939 7.820 1.00 23.10 O ATOM 1196 N GLY A 188 -26.127 -88.035 5.721 1.00 22.06 N ATOM 1197 CA GLY A 188 -26.140 -86.590 5.559 1.00 21.75 C ATOM 1198 C GLY A 188 -24.880 -86.024 4.926 1.00 21.52 C ATOM 1199 O GLY A 188 -24.939 -85.075 4.143 1.00 22.03 O ATOM 1200 N LYS A 188A -23.738 -86.606 5.273 1.00 20.93 N ATOM 1201 CA LYS A 188A -22.445 -86.175 4.750 1.00 20.71 C ATOM 1202 C LYS A 188A -21.689 -87.403 4.254 1.00 19.45 C ATOM 1203 O LYS A 188A -21.578 -88.400 4.966 1.00 19.85 O ATOM 1204 CB LYS A 188A -21.655 -85.456 5.846 1.00 21.92 C ATOM 1205 CG LYS A 188A -22.192 -84.063 6.157 1.00 23.99 C ATOM 1206 CD LYS A 188A -21.983 -83.683 7.618 1.00 25.73 C ATOM 1207 CE LYS A 188A -22.193 -82.188 7.830 1.00 27.12 C ATOM 1208 NZ LYS A 188A -23.476 -81.699 7.247 1.00 28.30 N ATOM 1209 N ASP A 189 -21.161 -87.330 3.036 1.00 18.02 N ATOM 1210 CA ASP A 189 -20.472 -88.480 2.462 1.00 16.53 C ATOM 1211 C ASP A 189 -19.785 -88.085 1.157 1.00 15.81 C ATOM 1212 O ASP A 189 -19.998 -86.990 0.635 1.00 16.27 O ATOM 1213 CB ASP A 189 -21.519 -89.563 2.166 1.00 16.27 C ATOM 1214 CG ASP A 189 -20.953 -90.976 2.158 1.00 15.97 C ATOM 1215 OD1 ASP A 189 -19.718 -91.170 2.190 1.00 16.25 O ATOM 1216 OD2 ASP A 189 -21.781 -91.911 2.111 1.00 16.26 O ATOM 1217 N SER A 190 -18.942 -88.978 0.650 1.00 14.59 N ATOM 1218 CA SER A 190 -18.276 -88.772 -0.630 1.00 13.97 C ATOM 1219 C SER A 190 -19.253 -89.418 -1.609 1.00 13.71 C ATOM 1220 O SER A 190 -20.098 -90.216 -1.198 1.00 13.64 O ATOM 1221 CB SER A 190 -16.927 -89.492 -0.657 1.00 13.52 C ATOM 1222 OG SER A 190 -17.065 -90.842 -0.250 1.00 13.62 O ATOM 1223 N CYS A 191 -19.159 -89.089 -2.891 1.00 12.96 N ATOM 1224 CA CYS A 191 -20.103 -89.648 -3.852 1.00 13.23 C ATOM 1225 C CYS A 191 -19.457 -89.850 -5.223 1.00 12.81 C ATOM 1226 O CYS A 191 -18.246 -89.692 -5.366 1.00 12.23 O ATOM 1227 CB CYS A 191 -21.309 -88.711 -3.941 1.00 13.77 C ATOM 1228 SG CYS A 191 -22.869 -89.467 -4.498 1.00 15.23 S ATOM 1229 N GLN A 192 -20.248 -90.213 -6.230 1.00 12.30 N ATOM 1230 CA GLN A 192 -19.679 -90.426 -7.561 1.00 12.23 C ATOM 1231 C GLN A 192 -18.890 -89.213 -8.038 1.00 12.19 C ATOM 1232 O GLN A 192 -19.384 -88.081 -8.025 1.00 13.50 O ATOM 1233 CB GLN A 192 -20.768 -90.770 -8.581 1.00 12.63 C ATOM 1234 CG GLN A 192 -21.215 -92.222 -8.545 1.00 13.08 C ATOM 1235 CD GLN A 192 -21.934 -92.576 -7.261 1.00 13.79 C ATOM 1236 OE1 GLN A 192 -22.841 -91.865 -6.836 1.00 15.19 O ATOM 1237 NE2 GLN A 192 -21.541 -93.683 -6.641 1.00 14.77 N ATOM 1238 N GLY A 193 -17.660 -89.476 -8.469 1.00 11.76 N ATOM 1239 CA GLY A 193 -16.769 -88.427 -8.920 1.00 11.03 C ATOM 1240 C GLY A 193 -15.635 -88.259 -7.919 1.00 10.58 C ATOM 1241 O GLY A 193 -14.623 -87.622 -8.209 1.00 11.03 O ATOM 1242 N ASP A 194 -15.792 -88.849 -6.738 1.00 10.38 N ATOM 1243 CA ASP A 194 -14.769 -88.735 -5.700 1.00 10.29 C ATOM 1244 C ASP A 194 -13.812 -89.918 -5.615 1.00 10.30 C ATOM 1245 O ASP A 194 -12.756 -89.802 -4.996 1.00 9.69 O ATOM 1246 CB ASP A 194 -15.412 -88.548 -4.320 1.00 10.66 C ATOM 1247 CG ASP A 194 -16.092 -87.203 -4.158 1.00 12.18 C ATOM 1248 OD1 ASP A 194 -15.556 -86.191 -4.652 1.00 13.22 O ATOM 1249 OD2 ASP A 194 -17.157 -87.159 -3.508 1.00 12.65 O ATOM 1250 N SER A 195 -14.172 -91.048 -6.223 1.00 9.99 N ATOM 1251 CA SER A 195 -13.324 -92.240 -6.165 1.00 9.78 C ATOM 1252 C SER A 195 -11.857 -91.967 -6.425 1.00 9.61 C ATOM 1253 O SER A 195 -11.510 -91.187 -7.302 1.00 9.20 O ATOM 1254 CB SER A 195 -13.801 -93.306 -7.155 1.00 9.67 C ATOM 1255 N GLY A 196 -11.003 -92.625 -5.649 1.00 9.28 N ATOM 1256 CA GLY A 196 -9.570 -92.471 -5.807 1.00 9.56 C ATOM 1257 C GLY A 196 -9.014 -91.308 -5.016 1.00 10.03 C ATOM 1258 O GLY A 196 -7.798 -91.192 -4.851 1.00 10.69 O ATOM 1259 N GLY A 197 -9.918 -90.462 -4.529 1.00 10.00 N ATOM 1260 CA GLY A 197 -9.549 -89.284 -3.762 1.00 10.38 C ATOM 1261 C GLY A 197 -9.001 -89.572 -2.380 1.00 10.32 C ATOM 1262 O GLY A 197 -9.157 -90.671 -1.855 1.00 10.07 O ATOM 1263 N PRO A 198 -8.379 -88.570 -1.752 1.00 10.26 N ATOM 1264 CA PRO A 198 -7.785 -88.698 -0.423 1.00 10.74 C ATOM 1265 C PRO A 198 -8.642 -88.508 0.817 1.00 10.64 C ATOM 1266 O PRO A 198 -9.620 -87.756 0.829 1.00 11.90 O ATOM 1267 CB PRO A 198 -6.677 -87.663 -0.460 1.00 11.33 C ATOM 1268 CG PRO A 198 -7.346 -86.541 -1.198 1.00 11.49 C ATOM 1269 CD PRO A 198 -8.053 -87.259 -2.344 1.00 10.81 C ATOM 1270 N VAL A 199 -8.237 -89.228 1.858 1.00 10.47 N ATOM 1271 CA VAL A 199 -8.817 -89.128 3.186 1.00 10.52 C ATOM 1272 C VAL A 199 -7.534 -88.898 3.978 1.00 10.78 C ATOM 1273 O VAL A 199 -6.735 -89.815 4.157 1.00 10.95 O ATOM 1274 CB VAL A 199 -9.480 -90.431 3.661 1.00 10.55 C ATOM 1275 CG1 VAL A 199 -9.899 -90.287 5.129 1.00 11.44 C ATOM 1276 CG2 VAL A 199 -10.697 -90.734 2.813 1.00 11.11 C ATOM 1277 N VAL A 200 -7.320 -87.662 4.415 1.00 10.77 N ATOM 1278 CA VAL A 200 -6.110 -87.316 5.149 1.00 11.41 C ATOM 1279 C VAL A 200 -6.400 -87.023 6.611 1.00 12.08 C ATOM 1280 O VAL A 200 -7.287 -86.238 6.940 1.00 11.87 O ATOM 1281 CB VAL A 200 -5.428 -86.097 4.494 1.00 11.44 C ATOM 1282 CG1 VAL A 200 -4.214 -85.659 5.296 1.00 12.21 C ATOM 1283 CG2 VAL A 200 -5.004 -86.461 3.084 1.00 11.78 C ATOM 1284 N CYS A 201 -5.644 -87.673 7.488 1.00 12.43 N ATOM 1285 CA CYS A 201 -5.824 -87.493 8.921 1.00 13.94 C ATOM 1286 C CYS A 201 -4.472 -87.157 9.533 1.00 15.26 C ATOM 1287 O CYS A 201 -3.511 -87.914 9.390 1.00 15.16 O ATOM 1288 CB CYS A 201 -6.363 -88.776 9.550 1.00 14.05 C ATOM 1289 SG CYS A 201 -7.512 -89.745 8.520 1.00 13.82 S ATOM 1290 N ASN A 202 -4.410 -86.017 10.212 1.00 16.84 N ATOM 1291 CA ASN A 202 -3.181 -85.557 10.848 1.00 18.27 C ATOM 1292 C ASN A 202 -2.002 -85.535 9.883 1.00 18.27 C ATOM 1293 O ASN A 202 -0.905 -86.001 10.204 1.00 19.21 O ATOM 1294 CB ASN A 202 -2.850 -86.425 12.065 1.00 20.18 C ATOM 1295 CG ASN A 202 -3.909 -86.336 13.146 1.00 21.61 C ATOM 1296 OD1 ASN A 202 -4.407 -85.253 13.454 1.00 23.77 O ATOM 1297 ND2 ASN A 202 -4.254 -87.475 13.734 1.00 23.08 N ATOM 1298 N GLY A 203 -2.244 -85.002 8.689 1.00 17.42 N ATOM 1299 CA GLY A 203 -1.196 -84.891 7.694 1.00 16.76 C ATOM 1300 C GLY A 203 -0.767 -86.146 6.959 1.00 15.98 C ATOM 1301 O GLY A 203 0.217 -86.108 6.224 1.00 17.07 O ATOM 1302 N GLU A 204 -1.485 -87.250 7.140 1.00 15.59 N ATOM 1303 CA GLU A 204 -1.129 -88.490 6.455 1.00 14.77 C ATOM 1304 C GLU A 204 -2.307 -89.075 5.695 1.00 13.68 C ATOM 1305 O GLU A 204 -3.453 -89.004 6.141 1.00 14.04 O ATOM 1306 CB GLU A 204 -0.621 -89.536 7.449 1.00 15.57 C ATOM 1307 CG GLU A 204 0.499 -89.049 8.344 1.00 17.68 C ATOM 1308 CD GLU A 204 1.044 -90.148 9.232 1.00 18.66 C ATOM 1309 OE1 GLU A 204 0.275 -91.058 9.601 1.00 20.54 O ATOM 1310 OE2 GLU A 204 2.239 -90.087 9.573 1.00 20.36 O ATOM 1311 N LEU A 209 -2.011 -89.659 4.540 1.00 12.95 N ATOM 1312 CA LEU A 209 -3.035 -90.281 3.713 1.00 12.34 C ATOM 1313 C LEU A 209 -3.440 -91.620 4.338 1.00 12.54 C ATOM 1314 O LEU A 209 -2.686 -92.587 4.276 1.00 13.90 O ATOM 1315 CB LEU A 209 -2.480 -90.513 2.306 1.00 12.61 C ATOM 1316 CG LEU A 209 -3.457 -91.083 1.279 1.00 12.56 C ATOM 1317 CD1 LEU A 209 -4.586 -90.092 1.056 1.00 13.61 C ATOM 1318 CD2 LEU A 209 -2.731 -91.372 -0.034 1.00 14.10 C ATOM 1319 N GLN A 210 -4.625 -91.674 4.941 1.00 12.04 N ATOM 1320 CA GLN A 210 -5.098 -92.905 5.572 1.00 11.66 C ATOM 1321 C GLN A 210 -6.122 -93.658 4.729 1.00 11.64 C ATOM 1322 O GLN A 210 -6.319 -94.857 4.916 1.00 12.23 O ATOM 1323 CB GLN A 210 -5.717 -92.606 6.939 1.00 12.22 C ATOM 1324 CG GLN A 210 -4.743 -92.130 8.015 1.00 12.77 C ATOM 1325 CD GLN A 210 -3.875 -93.247 8.570 1.00 14.13 C ATOM 1326 OE1 GLN A 210 -4.255 -94.415 8.552 1.00 14.82 O ATOM 1327 NE2 GLN A 210 -2.708 -92.883 9.091 1.00 14.53 N ATOM 1328 N GLY A 211 -6.786 -92.966 3.809 1.00 10.74 N ATOM 1329 CA GLY A 211 -7.775 -93.653 3.002 1.00 10.29 C ATOM 1330 C GLY A 211 -7.908 -93.167 1.577 1.00 10.01 C ATOM 1331 O GLY A 211 -7.453 -92.080 1.230 1.00 10.00 O ATOM 1332 N ILE A 212 -8.520 -94.009 0.749 1.00 9.81 N ATOM 1333 CA ILE A 212 -8.774 -93.699 -0.654 1.00 10.05 C ATOM 1334 C ILE A 212 -10.269 -93.927 -0.870 1.00 9.76 C ATOM 1335 O ILE A 212 -10.788 -94.983 -0.518 1.00 10.15 O ATOM 1336 CB ILE A 212 -7.986 -94.643 -1.603 1.00 10.80 C ATOM 1337 CG1 ILE A 212 -6.479 -94.460 -1.396 1.00 12.28 C ATOM 1338 CG2 ILE A 212 -8.351 -94.344 -3.056 1.00 12.02 C ATOM 1339 CD1 ILE A 212 -5.629 -95.453 -2.171 1.00 13.83 C ATOM 1340 N VAL A 213 -10.964 -92.937 -1.424 1.00 9.32 N ATOM 1341 CA VAL A 213 -12.400 -93.067 -1.680 1.00 9.20 C ATOM 1342 C VAL A 213 -12.625 -94.286 -2.575 1.00 9.10 C ATOM 1343 O VAL A 213 -12.049 -94.387 -3.657 1.00 9.47 O ATOM 1344 CB VAL A 213 -12.958 -91.808 -2.378 1.00 9.08 C ATOM 1345 CG1 VAL A 213 -14.452 -91.973 -2.636 1.00 10.04 C ATOM 1346 CG2 VAL A 213 -12.694 -90.575 -1.518 1.00 10.48 C ATOM 1347 N SER A 214 -13.463 -95.212 -2.123 1.00 9.28 N ATOM 1348 CA SER A 214 -13.701 -96.426 -2.890 1.00 9.86 C ATOM 1349 C SER A 214 -15.162 -96.716 -3.231 1.00 10.14 C ATOM 1350 O SER A 214 -15.559 -96.633 -4.396 1.00 10.71 O ATOM 1351 CB SER A 214 -13.088 -97.617 -2.143 1.00 10.08 C ATOM 1352 OG SER A 214 -13.236 -98.826 -2.865 1.00 11.11 O ATOM 1353 N TRP A 215 -15.972 -97.053 -2.231 1.00 10.22 N ATOM 1354 CA TRP A 215 -17.368 -97.383 -2.499 1.00 10.95 C ATOM 1355 C TRP A 215 -18.332 -97.150 -1.347 1.00 11.75 C ATOM 1356 O TRP A 215 -17.951 -96.688 -0.274 1.00 12.06 O ATOM 1357 CB TRP A 215 -17.481 -98.850 -2.931 1.00 11.25 C ATOM 1358 CG TRP A 215 -17.053 -99.847 -1.877 1.00 11.12 C ATOM 1359 CD1 TRP A 215 -15.772-100.193 -1.541 1.00 11.37 C ATOM 1360 CD2 TRP A 215 -17.911-100.634 -1.038 1.00 11.52 C ATOM 1361 NE1 TRP A 215 -15.782-101.147 -0.552 1.00 11.52 N ATOM 1362 CE2 TRP A 215 -17.081-101.435 -0.224 1.00 11.79 C ATOM 1363 CE3 TRP A 215 -19.302-100.738 -0.897 1.00 11.90 C ATOM 1364 CZ2 TRP A 215 -17.597-102.335 0.721 1.00 12.13 C ATOM 1365 CZ3 TRP A 215 -19.816-101.634 0.043 1.00 12.31 C ATOM 1366 CH2 TRP A 215 -18.962-102.420 0.839 1.00 11.78 C ATOM 1367 N GLY A 216 -19.596 -97.478 -1.600 1.00 12.42 N ATOM 1368 CA GLY A 216 -20.634 -97.339 -0.598 1.00 13.65 C ATOM 1369 C GLY A 216 -21.982 -97.571 -1.247 1.00 14.68 C ATOM 1370 O GLY A 216 -22.079 -97.571 -2.473 1.00 15.32 O ATOM 1371 N TYR A 217 -23.018 -97.798 -0.448 1.00 15.25 N ATOM 1372 CA TYR A 217 -24.351 -97.989 -1.012 1.00 16.09 C ATOM 1373 C TYR A 217 -25.005 -96.621 -1.012 1.00 16.50 C ATOM 1374 O TYR A 217 -25.360 -96.089 0.043 1.00 16.93 O ATOM 1375 CB TYR A 217 -25.176 -98.969 -0.177 1.00 16.06 C ATOM 1376 CG TYR A 217 -24.605-100.370 -0.107 1.00 16.30 C ATOM 1377 CD1 TYR A 217 -23.725-100.844 -1.084 1.00 15.83 C ATOM 1378 CD2 TYR A 217 -24.954-101.227 0.932 1.00 16.36 C ATOM 1379 CE1 TYR A 217 -23.209-102.138 -1.020 1.00 16.39 C ATOM 1380 CE2 TYR A 217 -24.446-102.522 1.004 1.00 16.74 C ATOM 1381 CZ TYR A 217 -23.570-102.970 0.029 1.00 16.85 C ATOM 1382 OH TYR A 217 -23.038-104.236 0.122 1.00 18.07 O ATOM 1383 N GLY A 219 -25.157 -96.045 -2.199 1.00 16.55 N ATOM 1384 CA GLY A 219 -25.730 -94.718 -2.291 1.00 16.95 C ATOM 1385 C GLY A 219 -24.737 -93.722 -1.714 1.00 17.06 C ATOM 1386 O GLY A 219 -23.552 -94.034 -1.565 1.00 17.38 O ATOM 1387 N CYS A 220 -25.216 -92.528 -1.386 1.00 16.64 N ATOM 1388 CA CYS A 220 -24.369 -91.491 -0.815 1.00 16.92 C ATOM 1389 C CYS A 220 -25.077 -90.772 0.318 1.00 17.18 C ATOM 1390 O CYS A 220 -26.205 -90.307 0.162 1.00 17.68 O ATOM 1391 CB CYS A 220 -23.991 -90.454 -1.871 1.00 16.38 C ATOM 1392 SG CYS A 220 -23.095 -91.100 -3.313 1.00 16.11 S ATOM 1393 N ALA A 221 -24.402 -90.682 1.456 1.00 17.14 N ATOM 1394 CA ALA A 221 -24.940 -89.990 2.618 1.00 17.85 C ATOM 1395 C ALA A 221 -26.225 -90.599 3.153 1.00 18.23 C ATOM 1396 O ALA A 221 -27.045 -89.896 3.740 1.00 18.82 O ATOM 1397 CB ALA A 221 -25.163 -88.522 2.280 1.00 18.13 C ATOM 1398 N LEU A 221A -26.401 -91.900 2.955 1.00 18.40 N ATOM 1399 CA LEU A 221A -27.594 -92.576 3.445 1.00 18.69 C ATOM 1400 C LEU A 221A -27.363 -93.073 4.861 1.00 19.00 C ATOM 1401 O LEU A 221A -26.261 -93.490 5.214 1.00 19.17 O ATOM 1402 CB LEU A 221A -27.953 -93.767 2.555 1.00 19.04 C ATOM 1403 CG LEU A 221A -28.276 -93.479 1.089 1.00 19.82 C ATOM 1404 CD1 LEU A 221A -28.672 -94.780 0.409 1.00 20.74 C ATOM 1405 CD2 LEU A 221A -29.396 -92.455 0.984 1.00 20.53 C ATOM 1406 N PRO A 222 -28.402 -93.021 5.701 1.00 19.12 N ATOM 1407 CA PRO A 222 -28.241 -93.494 7.075 1.00 19.07 C ATOM 1408 C PRO A 222 -27.880 -94.982 7.089 1.00 18.88 C ATOM 1409 O PRO A 222 -28.420 -95.769 6.308 1.00 19.04 O ATOM 1410 CB PRO A 222 -29.614 -93.229 7.689 1.00 19.37 C ATOM 1411 CG PRO A 222 -30.081 -92.019 6.946 1.00 20.28 C ATOM 1412 CD PRO A 222 -29.704 -92.354 5.523 1.00 19.35 C ATOM 1413 N ASP A 223 -26.959 -95.346 7.976 1.00 18.33 N ATOM 1414 CA ASP A 223 -26.497 -96.722 8.144 1.00 18.39 C ATOM 1415 C ASP A 223 -25.647 -97.264 6.996 1.00 17.77 C ATOM 1416 O ASP A 223 -25.441 -98.472 6.885 1.00 17.65 O ATOM 1417 CB ASP A 223 -27.683 -97.662 8.400 1.00 19.60 C ATOM 1418 CG ASP A 223 -27.248 -98.999 8.979 1.00 20.69 C ATOM 1419 OD1 ASP A 223 -26.477 -98.992 9.965 1.00 22.47 O ATOM 1420 OD2 ASP A 223 -27.677-100.054 8.462 1.00 21.47 O ATOM 1421 N ASN A 224 -25.158 -96.371 6.142 1.00 16.89 N ATOM 1422 CA ASN A 224 -24.301 -96.775 5.032 1.00 16.69 C ATOM 1423 C ASN A 224 -23.251 -95.711 4.755 1.00 15.97 C ATOM 1424 O ASN A 224 -23.287 -95.032 3.733 1.00 15.96 O ATOM 1425 CB ASN A 224 -25.119 -97.051 3.767 1.00 17.42 C ATOM 1426 CG ASN A 224 -25.785 -98.412 3.794 1.00 18.36 C ATOM 1427 OD1 ASN A 224 -26.991 -98.524 4.007 1.00 19.43 O ATOM 1428 ND2 ASN A 224 -24.993 -99.460 3.593 1.00 18.45 N ATOM 1429 N PRO A 225 -22.302 -95.543 5.684 1.00 15.64 N ATOM 1430 CA PRO A 225 -21.251 -94.544 5.498 1.00 14.82 C ATOM 1431 C PRO A 225 -20.322 -95.003 4.384 1.00 14.02 C ATOM 1432 O PRO A 225 -20.325 -96.176 4.014 1.00 13.91 O ATOM 1433 CB PRO A 225 -20.563 -94.521 6.858 1.00 15.05 C ATOM 1434 CG PRO A 225 -20.675 -95.947 7.299 1.00 15.95 C ATOM 1435 CD PRO A 225 -22.100 -96.295 6.936 1.00 15.66 C ATOM 1436 N GLY A 226 -19.528 -94.084 3.851 1.00 13.19 N ATOM 1437 CA GLY A 226 -18.615 -94.452 2.789 1.00 12.21 C ATOM 1438 C GLY A 226 -17.529 -95.420 3.232 1.00 12.10 C ATOM 1439 O GLY A 226 -17.075 -95.384 4.378 1.00 12.02 O ATOM 1440 N VAL A 227 -17.124 -96.297 2.318 1.00 11.35 N ATOM 1441 CA VAL A 227 -16.075 -97.274 2.583 1.00 11.20 C ATOM 1442 C VAL A 227 -14.838 -96.824 1.816 1.00 10.67 C ATOM 1443 O VAL A 227 -14.929 -96.413 0.658 1.00 11.29 O ATOM 1444 CB VAL A 227 -16.484 -98.681 2.117 1.00 11.14 C ATOM 1445 CG1 VAL A 227 -15.449 -99.700 2.573 1.00 12.04 C ATOM 1446 CG2 VAL A 227 -17.864 -99.029 2.675 1.00 12.72 C ATOM 1447 N TYR A 228 -13.684 -96.916 2.468 1.00 10.50 N ATOM 1448 CA TYR A 228 -12.430 -96.465 1.887 1.00 10.13 C ATOM 1449 C TYR A 228 -11.314 -97.495 1.971 1.00 10.41 C ATOM 1450 O TYR A 228 -11.294 -98.325 2.872 1.00 10.85 O ATOM 1451 CB TYR A 228 -11.979 -95.188 2.608 1.00 9.67 C ATOM 1452 CG TYR A 228 -12.984 -94.066 2.535 1.00 9.39 C ATOM 1453 CD1 TYR A 228 -14.144 -94.081 3.309 1.00 9.99 C ATOM 1454 CD2 TYR A 228 -12.790 -92.999 1.663 1.00 10.06 C ATOM 1455 CE1 TYR A 228 -15.086 -93.059 3.212 1.00 10.01 C ATOM 1456 CE2 TYR A 228 -13.721 -91.976 1.556 1.00 10.62 C ATOM 1457 CZ TYR A 228 -14.865 -92.008 2.329 1.00 10.16 C ATOM 1458 OH TYR A 228 -15.784 -90.994 2.215 1.00 10.68 O ATOM 1459 N THR A 229 -10.377 -97.438 1.030 1.00 10.33 N ATOM 1460 CA THR A 229 -9.253 -98.364 1.056 1.00 10.67 C ATOM 1461 C THR A 229 -8.356 -97.919 2.203 1.00 10.97 C ATOM 1462 O THR A 229 -8.051 -96.739 2.327 1.00 11.07 O ATOM 1463 CB THR A 229 -8.459 -98.320 -0.250 1.00 10.87 C ATOM 1464 OG1 THR A 229 -9.343 -98.605 -1.338 1.00 12.04 O ATOM 1465 CG2 THR A 229 -7.333 -99.357 -0.230 1.00 11.74 C ATOM 1466 N LYS A 230 -7.952 -98.870 3.041 1.00 10.50 N ATOM 1467 CA LYS A 230 -7.106 -98.586 4.200 1.00 11.88 C ATOM 1468 C LYS A 230 -5.645 -98.532 3.753 1.00 12.00 C ATOM 1469 O LYS A 230 -4.961 -99.550 3.688 1.00 12.62 O ATOM 1470 CB LYS A 230 -7.317 -99.683 5.244 1.00 12.95 C ATOM 1471 CG LYS A 230 -6.761 -99.377 6.620 1.00 14.66 C ATOM 1472 CD LYS A 230 -7.136-100.497 7.577 1.00 16.44 C ATOM 1473 CE LYS A 230 -6.669-100.213 8.988 1.00 18.60 C ATOM 1474 NZ LYS A 230 -7.153-101.261 9.933 1.00 20.77 N ATOM 1475 N VAL A 231 -5.172 -97.325 3.464 1.00 11.26 N ATOM 1476 CA VAL A 231 -3.821 -97.115 2.956 1.00 11.72 C ATOM 1477 C VAL A 231 -2.663 -97.649 3.795 1.00 11.80 C ATOM 1478 O VAL A 231 -1.650 -98.090 3.248 1.00 12.36 O ATOM 1479 CB VAL A 231 -3.590 -95.610 2.675 1.00 11.50 C ATOM 1480 CG1 VAL A 231 -2.202 -95.385 2.084 1.00 11.55 C ATOM 1481 CG2 VAL A 231 -4.653 -95.104 1.706 1.00 12.03 C ATOM 1482 N CYS A 232 -2.811 -97.629 5.115 1.00 12.26 N ATOM 1483 CA CYS A 232 -1.737 -98.088 5.988 1.00 13.27 C ATOM 1484 C CYS A 232 -1.341 -99.553 5.770 1.00 13.98 C ATOM 1485 O CYS A 232 -0.266 -99.975 6.200 1.00 15.07 O ATOM 1486 CB CYS A 232 -2.118 -97.845 7.449 1.00 13.80 C ATOM 1487 SG CYS A 232 -3.500 -98.861 8.031 1.00 13.53 S ATOM 1488 N ASN A 233 -2.190-100.330 5.105 1.00 14.02 N ATOM 1489 CA ASN A 233 -1.862-101.732 4.847 1.00 14.43 C ATOM 1490 C ASN A 233 -1.052-101.879 3.561 1.00 14.57 C ATOM 1491 O ASN A 233 -0.629-102.983 3.213 1.00 15.51 O ATOM 1492 CB ASN A 233 -3.137-102.575 4.703 1.00 14.55 C ATOM 1493 CG ASN A 233 -3.834-102.831 6.023 1.00 16.03 C ATOM 1494 OD1 ASN A 233 -3.317-102.508 7.095 1.00 17.45 O ATOM 1495 ND2 ASN A 233 -5.016-103.434 5.951 1.00 17.28 N ATOM 1496 N TYR A 234 -0.820-100.771 2.863 1.00 13.79 N ATOM 1497 CA TYR A 234 -0.117-100.817 1.588 1.00 13.72 C ATOM 1498 C TYR A 234 1.159 -99.995 1.473 1.00 14.03 C ATOM 1499 O TYR A 234 1.716 -99.877 0.380 1.00 14.51 O ATOM 1500 CB TYR A 234 -1.081-100.378 0.484 1.00 13.46 C ATOM 1501 CG TYR A 234 -2.323-101.230 0.396 1.00 13.42 C ATOM 1502 CD1 TYR A 234 -2.293-102.465 -0.248 1.00 13.42 C ATOM 1503 CD2 TYR A 234 -3.521-100.819 0.981 1.00 13.48 C ATOM 1504 CE1 TYR A 234 -3.421-103.271 -0.312 1.00 13.66 C ATOM 1505 CE2 TYR A 234 -4.661-101.622 0.929 1.00 14.05 C ATOM 1506 CZ TYR A 234 -4.603-102.847 0.278 1.00 13.63 C ATOM 1507 OH TYR A 234 -5.723-103.644 0.212 1.00 13.92 O ATOM 1508 N VAL A 235 1.638 -99.435 2.579 1.00 14.28 N ATOM 1509 CA VAL A 235 2.840 -98.614 2.510 1.00 15.24 C ATOM 1510 C VAL A 235 4.031 -99.336 1.887 1.00 15.14 C ATOM 1511 O VAL A 235 4.726 -98.776 1.040 1.00 14.98 O ATOM 1512 CB VAL A 235 3.231 -98.075 3.900 1.00 15.60 C ATOM 1513 CG1 VAL A 235 4.543 -97.301 3.806 1.00 16.70 C ATOM 1514 CG2 VAL A 235 2.129 -97.165 4.429 1.00 16.17 C ATOM 1515 N ASP A 236 4.266-100.581 2.284 1.00 15.67 N ATOM 1516 CA ASP A 236 5.392-101.314 1.721 1.00 16.16 C ATOM 1517 C ASP A 236 5.205-101.621 0.238 1.00 16.20 C ATOM 1518 O ASP A 236 6.157-101.523 -0.542 1.00 16.48 O ATOM 1519 CB ASP A 236 5.637-102.602 2.504 1.00 17.38 C ATOM 1520 CG ASP A 236 6.129-102.333 3.911 1.00 18.09 C ATOM 1521 OD1 ASP A 236 7.008-101.462 4.070 1.00 19.82 O ATOM 1522 OD2 ASP A 236 5.647-102.995 4.849 1.00 20.43 O ATOM 1523 N TRP A 237 3.988-101.985 -0.158 1.00 16.11 N ATOM 1524 CA TRP A 237 3.728-102.274 -1.564 1.00 15.68 C ATOM 1525 C TRP A 237 3.947-101.012 -2.394 1.00 15.34 C ATOM 1526 O TRP A 237 4.499-101.063 -3.493 1.00 15.02 O ATOM 1527 CB TRP A 237 2.293-102.763 -1.776 1.00 16.26 C ATOM 1528 CG TRP A 237 1.982-102.972 -3.227 1.00 16.22 C ATOM 1529 CD1 TRP A 237 2.447-103.972 -4.030 1.00 16.64 C ATOM 1530 CD2 TRP A 237 1.205-102.111 -4.069 1.00 16.49 C ATOM 1531 NE1 TRP A 237 2.012-103.787 -5.322 1.00 17.07 N ATOM 1532 CE2 TRP A 237 1.246-102.651 -5.373 1.00 16.45 C ATOM 1533 CE3 TRP A 237 0.478-100.934 -3.847 1.00 16.22 C ATOM 1534 CZ2 TRP A 237 0.589-102.050 -6.455 1.00 16.80 C ATOM 1535 CZ3 TRP A 237 -0.174-100.337 -4.924 1.00 16.63 C ATOM 1536 CH2 TRP A 237 -0.113-100.899 -6.210 1.00 16.18 C ATOM 1537 N ILE A 238 3.510 -99.876 -1.863 1.00 14.92 N ATOM 1538 CA ILE A 238 3.669 -98.612 -2.567 1.00 15.41 C ATOM 1539 C ILE A 238 5.147 -98.284 -2.745 1.00 16.22 C ATOM 1540 O ILE A 238 5.607 -98.026 -3.857 1.00 16.06 O ATOM 1541 CB ILE A 238 2.967 -97.461 -1.807 1.00 15.16 C ATOM 1542 CG1 ILE A 238 1.451 -97.672 -1.846 1.00 15.43 C ATOM 1543 CG2 ILE A 238 3.344 -96.114 -2.418 1.00 15.49 C ATOM 1544 CD1 ILE A 238 0.662 -96.675 -1.026 1.00 15.29 C ATOM 1545 N GLN A 239 5.893 -98.310 -1.648 1.00 17.25 N ATOM 1546 CA GLN A 239 7.316 -98.002 -1.702 1.00 18.62 C ATOM 1547 C GLN A 239 8.112 -98.972 -2.567 1.00 18.88 C ATOM 1548 O GLN A 239 8.974 -98.551 -3.338 1.00 19.00 O ATOM 1549 CB GLN A 239 7.895 -97.962 -0.289 1.00 20.14 C ATOM 1550 CG GLN A 239 7.364 -96.811 0.543 1.00 22.83 C ATOM 1551 CD GLN A 239 7.963 -96.769 1.933 1.00 24.56 C ATOM 1552 OE1 GLN A 239 7.753 -95.815 2.682 1.00 26.55 O ATOM 1553 NE2 GLN A 239 8.713 -97.807 2.288 1.00 25.99 N ATOM 1554 N ASP A 240 7.823-100.264 -2.449 1.00 19.22 N ATOM 1555 CA ASP A 240 8.540-101.258 -3.238 1.00 19.75 C ATOM 1556 C ASP A 240 8.234-101.098 -4.725 1.00 20.02 C ATOM 1557 O ASP A 240 9.123-101.239 -5.567 1.00 20.32 O ATOM 1558 CB ASP A 240 8.183-102.680 -2.781 1.00 20.53 C ATOM 1559 CG ASP A 240 8.677-102.987 -1.370 1.00 21.39 C ATOM 1560 OD1 ASP A 240 9.636-102.328 -0.918 1.00 21.92 O ATOM 1561 OD2 ASP A 240 8.115-103.896 -0.719 1.00 22.10 O ATOM 1562 N THR A 241 6.982-100.789 -5.044 1.00 19.77 N ATOM 1563 CA THR A 241 6.576-100.617 -6.434 1.00 20.06 C ATOM 1564 C THR A 241 7.244 -99.396 -7.055 1.00 20.24 C ATOM 1565 O THR A 241 7.702 -99.447 -8.194 1.00 20.71 O ATOM 1566 CB THR A 241 5.048-100.476 -6.553 1.00 19.73 C ATOM 1567 OG1 THR A 241 4.425-101.678 -6.083 1.00 19.79 O ATOM 1568 CG2 THR A 241 4.643-100.236 -8.005 1.00 19.76 C ATOM 1569 N ILE A 242 7.309 -98.303 -6.303 1.00 20.43 N ATOM 1570 CA ILE A 242 7.940 -97.088 -6.800 1.00 21.12 C ATOM 1571 C ILE A 242 9.432 -97.315 -7.053 1.00 21.81 C ATOM 1572 O ILE A 242 9.986 -96.815 -8.030 1.00 22.10 O ATOM 1573 CB ILE A 242 7.765 -95.919 -5.799 1.00 20.70 C ATOM 1574 CG1 ILE A 242 6.298 -95.485 -5.766 1.00 20.68 C ATOM 1575 CG2 ILE A 242 8.659 -94.751 -6.188 1.00 20.97 C ATOM 1576 CD1 ILE A 242 5.999 -94.402 -4.756 1.00 21.30 C ATOM 1577 N ALA A 243 10.071 -98.083 -6.176 1.00 22.63 N ATOM 1578 CA ALA A 243 11.501 -98.363 -6.293 1.00 23.55 C ATOM 1579 C ALA A 243 11.850 -99.255 -7.479 1.00 24.29 C ATOM 1580 O ALA A 243 12.970 -99.206 -7.988 1.00 24.83 O ATOM 1581 CB ALA A 243 12.010 -98.998 -5.002 1.00 23.59 C ATOM 1582 N ALA A 244 10.895-100.064 -7.921 1.00 24.57 N ATOM 1583 CA ALA A 244 11.127-100.976 -9.036 1.00 25.34 C ATOM 1584 C ALA A 244 10.664-100.430 -10.381 1.00 25.80 C ATOM 1585 O ALA A 244 10.798-101.102 -11.405 1.00 26.18 O ATOM 1586 CB ALA A 244 10.440-102.305 -8.763 1.00 25.13 C ATOM 1587 N ASN A 245 10.123 -99.216 -10.382 1.00 26.22 N ATOM 1588 CA ASN A 245 9.633 -98.616 -11.618 1.00 26.97 C ATOM 1589 C ASN A 245 10.093 -97.175 -11.794 1.00 27.38 C ATOM 1590 O ASN A 245 9.386 -96.427 -12.498 1.00 28.00 O ATOM 1591 CB ASN A 245 8.104 -98.669 -11.639 1.00 26.94 C ATOM 1592 CG ASN A 245 7.572-100.083 -11.764 1.00 27.03 C ATOM 1593 OD1 ASN A 245 7.550-100.655 -12.854 1.00 27.57 O ATOM 1594 ND2 ASN A 245 7.150-100.661 -10.645 1.00 27.09 N ATOM 1595 OXT ASN A 245 11.160 -96.818 -11.252 1.00 28.13 O TER 1596 ASN A 245 ATOM 1597 N ARG I 1 -38.185-107.306 -26.661 1.00 19.96 N ATOM 1598 CA ARG I 1 -36.729-107.072 -26.418 1.00 20.16 C ATOM 1599 C ARG I 1 -36.332-107.732 -25.091 1.00 20.06 C ATOM 1600 O ARG I 1 -37.197-108.100 -24.298 1.00 19.80 O ATOM 1601 CB ARG I 1 -36.449-105.566 -26.362 1.00 20.69 C ATOM 1602 CG ARG I 1 -36.797-104.915 -25.028 1.00 21.70 C ATOM 1603 CD ARG I 1 -36.805-103.394 -25.106 1.00 22.69 C ATOM 1604 NE ARG I 1 -38.013-102.888 -25.753 1.00 23.96 N ATOM 1605 CZ ARG I 1 -38.048-102.338 -26.963 1.00 24.18 C ATOM 1606 NH1 ARG I 1 -36.935-102.215 -27.673 1.00 24.49 N ATOM 1607 NH2 ARG I 1 -39.200-101.914 -27.464 1.00 25.09 N ATOM 1608 N PRO I 2 -35.019-107.892 -24.838 1.00 20.11 N ATOM 1609 CA PRO I 2 -34.507-108.508 -23.606 1.00 20.52 C ATOM 1610 C PRO I 2 -34.996-107.790 -22.353 1.00 20.50 C ATOM 1611 O PRO I 2 -35.163-106.574 -22.356 1.00 20.12 O ATOM 1612 CB PRO I 2 -32.994-108.405 -23.774 1.00 20.49 C ATOM 1613 CG PRO I 2 -32.817-108.482 -25.252 1.00 20.69 C ATOM 1614 CD PRO I 2 -33.908-107.573 -25.752 1.00 20.13 C ATOM 1615 N ASP I 3 -35.202-108.548 -21.280 1.00 20.86 N ATOM 1616 CA ASP I 3 -35.704-107.999 -20.024 1.00 21.47 C ATOM 1617 C ASP I 3 -34.793-106.991 -19.326 1.00 21.32 C ATOM 1618 O ASP I 3 -35.278-106.076 -18.659 1.00 21.31 O ATOM 1619 CB ASP I 3 -36.035-109.142 -19.059 1.00 23.01 C ATOM 1620 CG ASP I 3 -34.808-109.922 -18.628 1.00 24.34 C ATOM 1621 OD1 ASP I 3 -33.828-109.983 -19.400 1.00 25.37 O ATOM 1622 OD2 ASP I 3 -34.832-110.491 -17.515 1.00 26.36 O ATOM 1623 N PHE I 4 -33.482-107.145 -19.473 1.00 21.23 N ATOM 1624 CA PHE I 4 -32.563-106.223 -18.815 1.00 21.01 C ATOM 1625 C PHE I 4 -32.621-104.816 -19.407 1.00 21.16 C ATOM 1626 O PHE I 4 -32.146-103.856 -18.802 1.00 21.45 O ATOM 1627 CB PHE I 4 -31.130-106.778 -18.854 1.00 20.72 C ATOM 1628 CG PHE I 4 -30.584-106.994 -20.238 1.00 20.58 C ATOM 1629 CD1 PHE I 4 -30.123-105.923 -20.997 1.00 20.88 C ATOM 1630 CD2 PHE I 4 -30.504-108.276 -20.772 1.00 21.09 C ATOM 1631 CE1 PHE I 4 -29.581-106.130 -22.269 1.00 21.05 C ATOM 1632 CE2 PHE I 4 -29.968-108.491 -22.038 1.00 20.96 C ATOM 1633 CZ PHE I 4 -29.506-107.416 -22.788 1.00 20.98 C ATOM 1634 N CYS I 5 -33.231-104.695 -20.582 1.00 20.82 N ATOM 1635 CA CYS I 5 -33.358-103.407 -21.253 1.00 21.02 C ATOM 1636 C CYS I 5 -34.425-102.530 -20.610 1.00 21.37 C ATOM 1637 O CYS I 5 -34.482-101.323 -20.852 1.00 21.02 O ATOM 1638 CB CYS I 5 -33.736-103.616 -22.716 1.00 20.93 C ATOM 1639 SG CYS I 5 -32.542-104.548 -23.719 1.00 20.89 S ATOM 1640 N LEU I 6 -35.273-103.143 -19.794 1.00 21.80 N ATOM 1641 CA LEU I 6 -36.360-102.425 -19.145 1.00 22.78 C ATOM 1642 C LEU I 6 -36.031-102.033 -17.715 1.00 23.13 C ATOM 1643 O LEU I 6 -36.820-101.359 -17.054 1.00 23.50 O ATOM 1644 CB LEU I 6 -37.632-103.277 -19.165 1.00 23.40 C ATOM 1645 CG LEU I 6 -38.124-103.724 -20.545 1.00 23.58 C ATOM 1646 CD1 LEU I 6 -39.355-104.605 -20.379 1.00 24.18 C ATOM 1647 CD2 LEU I 6 -38.441-102.520 -21.412 1.00 24.22 C ATOM 1648 N GLU I 7 -34.866-102.456 -17.240 1.00 23.42 N ATOM 1649 CA GLU I 7 -34.444-102.138 -15.885 1.00 23.78 C ATOM 1650 C GLU I 7 -33.814-100.753 -15.843 1.00 23.03 C ATOM 1651 O GLU I 7 -33.123-100.345 -16.777 1.00 23.19 O ATOM 1652 CB GLU I 7 -33.439-103.180 -15.388 1.00 24.98 C ATOM 1653 CG GLU I 7 -34.033-104.567 -15.192 1.00 27.13 C ATOM 1654 CD GLU I 7 -35.051-104.606 -14.065 1.00 28.46 C ATOM 1655 OE1 GLU I 7 -34.655-104.382 -12.900 1.00 29.52 O ATOM 1656 OE2 GLU I 7 -36.245-104.853 -14.343 1.00 29.44 O ATOM 1657 N PRO I 8 -34.057-100.002 -14.760 1.00 22.47 N ATOM 1658 CA PRO I 8 -33.478 -98.662 -14.656 1.00 21.75 C ATOM 1659 C PRO I 8 -31.955 -98.744 -14.615 1.00 20.84 C ATOM 1660 O PRO I 8 -31.392 -99.768 -14.232 1.00 20.88 O ATOM 1661 CB PRO I 8 -34.074 -98.135 -13.352 1.00 22.05 C ATOM 1662 CG PRO I 8 -34.250 -99.377 -12.538 1.00 22.39 C ATOM 1663 CD PRO I 8 -34.811-100.349 -13.545 1.00 22.58 C ATOM 1664 N PRO I 9 -31.268 -97.667 -15.022 1.00 20.01 N ATOM 1665 CA PRO I 9 -29.803 -97.662 -15.012 1.00 19.55 C ATOM 1666 C PRO I 9 -29.275 -97.890 -13.599 1.00 18.83 C ATOM 1667 O PRO I 9 -29.846 -97.395 -12.627 1.00 19.18 O ATOM 1668 CB PRO I 9 -29.464 -96.280 -15.561 1.00 19.68 C ATOM 1669 CG PRO I 9 -30.612 -95.444 -15.092 1.00 20.09 C ATOM 1670 CD PRO I 9 -31.795 -96.338 -15.378 1.00 19.98 C ATOM 1671 N TYR I 10 -28.187 -98.645 -13.496 1.00 17.99 N ATOM 1672 CA TYR I 10 -27.588 -98.976 -12.208 1.00 17.03 C ATOM 1673 C TYR I 10 -26.211 -98.337 -12.044 1.00 16.04 C ATOM 1674 O TYR I 10 -25.245 -98.745 -12.688 1.00 15.33 O ATOM 1675 CB TYR I 10 -27.475-100.498 -12.087 1.00 17.44 C ATOM 1676 CG TYR I 10 -26.935-101.005 -10.767 1.00 18.00 C ATOM 1677 CD1 TYR I 10 -27.689-100.912 -9.598 1.00 18.92 C ATOM 1678 CD2 TYR I 10 -25.684-101.613 -10.697 1.00 18.00 C ATOM 1679 CE1 TYR I 10 -27.211-101.421 -8.388 1.00 19.36 C ATOM 1680 CE2 TYR I 10 -25.196-102.122 -9.496 1.00 19.00 C ATOM 1681 CZ TYR I 10 -25.963-102.026 -8.349 1.00 19.48 C ATOM 1682 OH TYR I 10 -25.486-102.550 -7.171 1.00 21.05 O ATOM 1683 N THR I 11 -26.130 -97.338 -11.172 1.00 15.25 N ATOM 1684 CA THR I 11 -24.875 -96.644 -10.919 1.00 14.76 C ATOM 1685 C THR I 11 -23.860 -97.552 -10.223 1.00 14.39 C ATOM 1686 O THR I 11 -22.671 -97.511 -10.527 1.00 13.73 O ATOM 1687 CB THR I 11 -25.119 -95.376 -10.070 1.00 15.13 C ATOM 1688 OG1 THR I 11 -25.849 -94.420 -10.850 1.00 16.84 O ATOM 1689 CG2 THR I 11 -23.799 -94.761 -9.622 1.00 15.62 C ATOM 1690 N GLY I 12 -24.329 -98.381 -9.298 1.00 14.26 N ATOM 1691 CA GLY I 12 -23.416 -99.267 -8.603 1.00 14.23 C ATOM 1692 C GLY I 12 -22.840 -98.607 -7.365 1.00 14.13 C ATOM 1693 O GLY I 12 -23.019 -97.407 -7.156 1.00 14.44 O ATOM 1694 N PRO I 13 -22.120 -99.367 -6.531 1.00 14.01 N ATOM 1695 CA PRO I 13 -21.524 -98.843 -5.300 1.00 13.58 C ATOM 1696 C PRO I 13 -20.248 -98.019 -5.433 1.00 12.40 C ATOM 1697 O PRO I 13 -19.926 -97.246 -4.538 1.00 12.69 O ATOM 1698 CB PRO I 13 -21.300-100.103 -4.480 1.00 13.80 C ATOM 1699 CG PRO I 13 -20.877-101.079 -5.534 1.00 14.79 C ATOM 1700 CD PRO I 13 -21.877-100.818 -6.650 1.00 14.47 C ATOM 1701 N CYS I 14 -19.516 -98.181 -6.531 1.00 12.15 N ATOM 1702 CA CYS I 14 -18.278 -97.433 -6.695 1.00 11.76 C ATOM 1703 C CYS I 14 -18.530 -95.958 -6.958 1.00 11.52 C ATOM 1704 O CYS I 14 -19.585 -95.577 -7.463 1.00 11.73 O ATOM 1705 CB CYS I 14 -17.413 -98.073 -7.781 1.00 11.52 C ATOM 1706 SG CYS I 14 -16.733 -99.643 -7.165 1.00 12.40 S ATOM 1707 N LYS I 15 -17.554 -95.127 -6.607 1.00 11.00 N ATOM 1708 CA LYS I 15 -17.720 -93.688 -6.735 1.00 10.82 C ATOM 1709 C LYS I 15 -16.970 -92.947 -7.834 1.00 10.89 C ATOM 1710 O LYS I 15 -16.573 -91.796 -7.659 1.00 11.16 O ATOM 1711 CB LYS I 15 -17.451 -93.044 -5.370 1.00 11.25 C ATOM 1712 CG LYS I 15 -18.455 -93.514 -4.333 1.00 11.35 C ATOM 1713 CD LYS I 15 -18.224 -92.912 -2.960 1.00 11.38 C ATOM 1714 CE LYS I 15 -19.327 -93.363 -2.010 1.00 12.11 C ATOM 1715 NZ LYS I 15 -19.090 -92.908 -0.612 1.00 12.23 N ATOM 1716 N ALA I 16 -16.776 -93.597 -8.974 1.00 10.81 N ATOM 1717 CA ALA I 16 -16.136 -92.921 -10.091 1.00 11.12 C ATOM 1718 C ALA I 16 -17.288 -92.244 -10.825 1.00 11.98 C ATOM 1719 O ALA I 16 -18.455 -92.464 -10.494 1.00 11.90 O ATOM 1720 CB ALA I 16 -15.451 -93.925 -11.009 1.00 11.19 C ATOM 1721 N ARG I 17 -16.966 -91.409 -11.803 1.00 12.98 N ATOM 1722 CA ARG I 17 -17.995 -90.746 -12.591 1.00 14.46 C ATOM 1723 C ARG I 17 -17.699 -91.119 -14.034 1.00 15.06 C ATOM 1724 O ARG I 17 -16.922 -90.452 -14.712 1.00 15.13 O ATOM 1725 CB ARG I 17 -17.921 -89.232 -12.413 1.00 16.02 C ATOM 1726 CG ARG I 17 -18.957 -88.475 -13.216 1.00 19.51 C ATOM 1727 CD ARG I 17 -18.418 -87.117 -13.582 1.00 22.52 C ATOM 1728 NE ARG I 17 -19.299 -86.401 -14.494 1.00 25.49 N ATOM 1729 CZ ARG I 17 -18.911 -85.363 -15.223 1.00 25.95 C ATOM 1730 NH1 ARG I 17 -17.657 -84.932 -15.141 1.00 26.37 N ATOM 1731 NH2 ARG I 17 -19.773 -84.757 -16.028 1.00 27.07 N ATOM 1732 N ILE I 18 -18.311 -92.207 -14.484 1.00 15.47 N ATOM 1733 CA ILE I 18 -18.109 -92.713 -15.835 1.00 15.87 C ATOM 1734 C ILE I 18 -19.431 -92.654 -16.590 1.00 16.23 C ATOM 1735 O ILE I 18 -20.413 -93.271 -16.183 1.00 15.69 O ATOM 1736 CB ILE I 18 -17.602 -94.168 -15.781 1.00 16.54 C ATOM 1737 CG1 ILE I 18 -16.280 -94.220 -15.009 1.00 17.30 C ATOM 1738 CG2 ILE I 18 -17.415 -94.715 -17.186 1.00 16.68 C ATOM 1739 CD1 ILE I 18 -15.809 -95.621 -14.697 1.00 18.43 C ATOM 1740 N ILE I 19 -19.457 -91.908 -17.689 1.00 16.22 N ATOM 1741 CA ILE I 19 -20.683 -91.776 -18.465 1.00 17.32 C ATOM 1742 C ILE I 19 -20.895 -92.986 -19.367 1.00 17.20 C ATOM 1743 O ILE I 19 -20.041 -93.322 -20.189 1.00 17.81 O ATOM 1744 CB ILE I 19 -20.664 -90.497 -19.335 1.00 18.01 C ATOM 1745 CG1 ILE I 19 -20.353 -89.276 -18.462 1.00 18.97 C ATOM 1746 CG2 ILE I 19 -22.009 -90.322 -20.029 1.00 18.82 C ATOM 1747 CD1 ILE I 19 -21.266 -89.114 -17.266 1.00 20.49 C ATOM 1748 N ARG I 20 -22.039 -93.638 -19.193 1.00 17.22 N ATOM 1749 CA ARG I 20 -22.396 -94.812 -19.976 1.00 17.54 C ATOM 1750 C ARG I 20 -23.781 -94.621 -20.571 1.00 17.83 C ATOM 1751 O ARG I 20 -24.481 -93.661 -20.251 1.00 17.61 O ATOM 1752 CB ARG I 20 -22.389 -96.066 -19.094 1.00 17.59 C ATOM 1753 CG ARG I 20 -21.005 -96.510 -18.626 1.00 18.02 C ATOM 1754 CD ARG I 20 -20.141 -96.980 -19.796 1.00 18.26 C ATOM 1755 NE ARG I 20 -18.791 -97.360 -19.377 1.00 19.10 N ATOM 1756 CZ ARG I 20 -18.486 -98.468 -18.708 1.00 19.60 C ATOM 1757 NH1 ARG I 20 -19.433 -99.335 -18.369 1.00 19.49 N ATOM 1758 NH2 ARG I 20 -17.226 -98.706 -18.363 1.00 20.15 N ATOM 1759 N TYR I 21 -24.172 -95.548 -21.436 1.00 18.82 N ATOM 1760 CA TYR I 21 -25.476 -95.494 -22.079 1.00 19.48 C ATOM 1761 C TYR I 21 -26.391 -96.599 -21.570 1.00 19.46 C ATOM 1762 O TYR I 21 -25.932 -97.686 -21.214 1.00 19.01 O ATOM 1763 CB TYR I 21 -25.312 -95.633 -23.594 1.00 20.92 C ATOM 1764 CG TYR I 21 -24.710 -94.420 -24.263 1.00 22.76 C ATOM 1765 CD1 TYR I 21 -25.503 -93.327 -24.605 1.00 23.61 C ATOM 1766 CD2 TYR I 21 -23.347 -94.360 -24.547 1.00 23.60 C ATOM 1767 CE1 TYR I 21 -24.955 -92.202 -25.217 1.00 24.76 C ATOM 1768 CE2 TYR I 21 -22.786 -93.238 -25.156 1.00 24.77 C ATOM 1769 CZ TYR I 21 -23.598 -92.164 -25.488 1.00 24.96 C ATOM 1770 OH TYR I 21 -23.053 -91.051 -26.086 1.00 26.30 O ATOM 1771 N PHE I 22 -27.685 -96.304 -21.518 1.00 19.85 N ATOM 1772 CA PHE I 22 -28.679 -97.280 -21.090 1.00 20.33 C ATOM 1773 C PHE I 22 -29.926 -97.073 -21.939 1.00 20.95 C ATOM 1774 O PHE I 22 -30.168 -95.975 -22.441 1.00 20.37 O ATOM 1775 CB PHE I 22 -29.029 -97.110 -19.606 1.00 20.81 C ATOM 1776 CG PHE I 22 -29.940 -95.949 -19.321 1.00 20.97 C ATOM 1777 CD1 PHE I 22 -29.465 -94.644 -19.362 1.00 21.55 C ATOM 1778 CD2 PHE I 22 -31.282 -96.166 -19.015 1.00 21.47 C ATOM 1779 CE1 PHE I 22 -30.314 -93.567 -19.103 1.00 22.01 C ATOM 1780 CE2 PHE I 22 -32.139 -95.098 -18.755 1.00 21.64 C ATOM 1781 CZ PHE I 22 -31.654 -93.797 -18.799 1.00 22.07 C ATOM 1782 N TYR I 23 -30.708 -98.130 -22.111 1.00 21.60 N ATOM 1783 CA TYR I 23 -31.927 -98.030 -22.897 1.00 22.86 C ATOM 1784 C TYR I 23 -33.079 -97.566 -22.019 1.00 23.74 C ATOM 1785 O TYR I 23 -33.413 -98.210 -21.023 1.00 23.45 O ATOM 1786 CB TYR I 23 -32.284 -99.380 -23.519 1.00 22.86 C ATOM 1787 CG TYR I 23 -33.486 -99.308 -24.436 1.00 23.11 C ATOM 1788 CD1 TYR I 23 -33.387 -98.722 -25.697 1.00 23.48 C ATOM 1789 CD2 TYR I 23 -34.732 -99.789 -24.027 1.00 23.47 C ATOM 1790 CE1 TYR I 23 -34.496 -98.615 -26.530 1.00 23.83 C ATOM 1791 CE2 TYR I 23 -35.849 -99.687 -24.853 1.00 23.70 C ATOM 1792 CZ TYR I 23 -35.721 -99.098 -26.102 1.00 23.93 C ATOM 1793 OH TYR I 23 -36.818 -98.988 -26.926 1.00 24.51 O ATOM 1794 N ASN I 24 -33.677 -96.440 -22.389 1.00 25.36 N ATOM 1795 CA ASN I 24 -34.812 -95.899 -21.653 1.00 27.17 C ATOM 1796 C ASN I 24 -36.063 -96.313 -22.418 1.00 28.32 C ATOM 1797 O ASN I 24 -36.463 -95.645 -23.368 1.00 28.61 O ATOM 1798 CB ASN I 24 -34.739 -94.373 -21.589 1.00 27.88 C ATOM 1799 CG ASN I 24 -35.850 -93.775 -20.750 1.00 28.59 C ATOM 1800 OD1 ASN I 24 -36.988 -94.245 -20.780 1.00 29.38 O ATOM 1801 ND2 ASN I 24 -35.530 -92.724 -20.002 1.00 29.18 N ATOM 1802 N ALA I 25 -36.668 -97.422 -22.008 1.00 29.32 N ATOM 1803 CA ALA I 25 -37.864 -97.930 -22.669 1.00 30.41 C ATOM 1804 C ALA I 25 -38.977 -96.891 -22.714 1.00 31.14 C ATOM 1805 O ALA I 25 -39.662 -96.744 -23.728 1.00 31.41 O ATOM 1806 CB ALA I 25 -38.352 -99.184 -21.962 1.00 30.69 C ATOM 1807 N LYS I 26 -39.152 -96.178 -21.606 1.00 31.84 N ATOM 1808 CA LYS I 26 -40.180 -95.149 -21.485 1.00 32.58 C ATOM 1809 C LYS I 26 -40.057 -94.084 -22.575 1.00 32.57 C ATOM 1810 O LYS I 26 -41.059 -93.513 -23.006 1.00 32.94 O ATOM 1811 CB LYS I 26 -40.086 -94.495 -20.103 1.00 33.31 C ATOM 1812 CG LYS I 26 -41.147 -93.440 -19.810 1.00 34.27 C ATOM 1813 CD LYS I 26 -40.886 -92.776 -18.462 1.00 35.08 C ATOM 1814 CE LYS I 26 -41.877 -91.655 -18.177 1.00 35.62 C ATOM 1815 NZ LYS I 26 -41.553 -90.937 -16.908 1.00 36.10 N ATOM 1816 N ALA I 27 -38.830 -93.824 -23.020 1.00 32.35 N ATOM 1817 CA ALA I 27 -38.582 -92.823 -24.054 1.00 31.88 C ATOM 1818 C ALA I 27 -38.320 -93.462 -25.414 1.00 31.60 C ATOM 1819 O ALA I 27 -38.427 -92.805 -26.450 1.00 31.92 O ATOM 1820 CB ALA I 27 -37.405 -91.944 -23.654 1.00 32.17 C ATOM 1821 N GLY I 28 -37.964 -94.742 -25.408 1.00 31.02 N ATOM 1822 CA GLY I 28 -37.715 -95.444 -26.654 1.00 30.34 C ATOM 1823 C GLY I 28 -36.343 -95.262 -27.276 1.00 29.86 C ATOM 1824 O GLY I 28 -36.159 -95.551 -28.459 1.00 30.10 O ATOM 1825 N LEU I 29 -35.377 -94.780 -26.502 1.00 29.07 N ATOM 1826 CA LEU I 29 -34.031 -94.597 -27.032 1.00 28.38 C ATOM 1827 C LEU I 29 -32.996 -94.744 -25.925 1.00 27.39 C ATOM 1828 O LEU I 29 -33.345 -94.919 -24.758 1.00 27.29 O ATOM 1829 CB LEU I 29 -33.885 -93.223 -27.695 1.00 29.35 C ATOM 1830 CG LEU I 29 -33.498 -92.031 -26.814 1.00 29.70 C ATOM 1831 CD1 LEU I 29 -33.262 -90.816 -27.700 1.00 30.72 C ATOM 1832 CD2 LEU I 29 -34.584 -91.750 -25.788 1.00 30.43 C ATOM 1833 N CYS I 30 -31.726 -94.680 -26.305 1.00 26.49 N ATOM 1834 CA CYS I 30 -30.632 -94.805 -25.352 1.00 25.60 C ATOM 1835 C CYS I 30 -30.147 -93.440 -24.898 1.00 25.30 C ATOM 1836 O CYS I 30 -29.887 -92.555 -25.714 1.00 25.27 O ATOM 1837 CB CYS I 30 -29.476 -95.572 -25.984 1.00 25.37 C ATOM 1838 SG CYS I 30 -29.882 -97.305 -26.353 1.00 24.93 S ATOM 1839 N GLN I 31 -30.026 -93.276 -23.587 1.00 24.64 N ATOM 1840 CA GLN I 31 -29.571 -92.020 -23.016 1.00 24.20 C ATOM 1841 C GLN I 31 -28.347 -92.291 -22.159 1.00 23.55 C ATOM 1842 O GLN I 31 -27.864 -93.422 -22.099 1.00 23.63 O ATOM 1843 CB GLN I 31 -30.683 -91.395 -22.173 1.00 24.92 C ATOM 1844 CG GLN I 31 -31.977 -91.184 -22.946 1.00 26.83 C ATOM 1845 CD GLN I 31 -33.046 -90.506 -22.117 1.00 27.53 C ATOM 1846 OE1 GLN I 31 -33.408 -90.982 -21.041 1.00 28.63 O ATOM 1847 NE2 GLN I 31 -33.558 -89.385 -22.614 1.00 28.55 N ATOM 1848 N THR I 32 -27.842 -91.259 -21.496 1.00 22.56 N ATOM 1849 CA THR I 32 -26.665 -91.436 -20.660 1.00 21.47 C ATOM 1850 C THR I 32 -26.987 -91.378 -19.177 1.00 20.32 C ATOM 1851 O THR I 32 -27.996 -90.806 -18.763 1.00 20.47 O ATOM 1852 CB THR I 32 -25.593 -90.368 -20.965 1.00 21.82 C ATOM 1853 OG1 THR I 32 -26.135 -89.064 -20.728 1.00 22.81 O ATOM 1854 CG2 THR I 32 -25.140 -90.465 -22.412 1.00 22.73 C ATOM 1855 N PHE I 33 -26.128 -92.003 -18.383 1.00 18.70 N ATOM 1856 CA PHE I 33 -26.273 -91.996 -16.937 1.00 17.44 C ATOM 1857 C PHE I 33 -24.874 -92.119 -16.360 1.00 16.48 C ATOM 1858 O PHE I 33 -23.919 -92.384 -17.088 1.00 16.74 O ATOM 1859 CB PHE I 33 -27.173 -93.143 -16.442 1.00 16.97 C ATOM 1860 CG PHE I 33 -26.519 -94.497 -16.445 1.00 16.29 C ATOM 1861 CD1 PHE I 33 -26.336 -95.199 -17.630 1.00 15.58 C ATOM 1862 CD2 PHE I 33 -26.105 -95.080 -15.249 1.00 15.91 C ATOM 1863 CE1 PHE I 33 -25.753 -96.465 -17.629 1.00 16.23 C ATOM 1864 CE2 PHE I 33 -25.521 -96.345 -15.236 1.00 15.95 C ATOM 1865 CZ PHE I 33 -25.344 -97.040 -16.426 1.00 15.81 C ATOM 1866 N VAL I 34 -24.746 -91.910 -15.058 1.00 15.71 N ATOM 1867 CA VAL I 34 -23.442 -92.001 -14.426 1.00 14.69 C ATOM 1868 C VAL I 34 -23.227 -93.372 -13.812 1.00 13.57 C ATOM 1869 O VAL I 34 -23.974 -93.795 -12.931 1.00 14.04 O ATOM 1870 CB VAL I 34 -23.281 -90.934 -13.331 1.00 14.73 C ATOM 1871 CG1 VAL I 34 -21.912 -91.062 -12.673 1.00 15.96 C ATOM 1872 CG2 VAL I 34 -23.451 -89.546 -13.935 1.00 15.75 C ATOM 1873 N TYR I 35 -22.207 -94.065 -14.300 1.00 12.53 N ATOM 1874 CA TYR I 35 -21.852 -95.387 -13.801 1.00 12.60 C ATOM 1875 C TYR I 35 -20.706 -95.196 -12.809 1.00 12.18 C ATOM 1876 O TYR I 35 -19.770 -94.441 -13.076 1.00 12.53 O ATOM 1877 CB TYR I 35 -21.430 -96.280 -14.974 1.00 12.15 C ATOM 1878 CG TYR I 35 -20.831 -97.609 -14.583 1.00 12.11 C ATOM 1879 CD1 TYR I 35 -21.494 -98.469 -13.704 1.00 12.09 C ATOM 1880 CD2 TYR I 35 -19.605 -98.015 -15.105 1.00 12.61 C ATOM 1881 CE1 TYR I 35 -20.945 -99.702 -13.356 1.00 12.62 C ATOM 1882 CE2 TYR I 35 -19.047 -99.243 -14.768 1.00 12.38 C ATOM 1883 CZ TYR I 35 -19.719-100.082 -13.895 1.00 12.44 C ATOM 1884 OH TYR I 35 -19.166-101.301 -13.574 1.00 13.76 O ATOM 1885 N GLY I 36 -20.795 -95.868 -11.663 1.00 12.30 N ATOM 1886 CA GLY I 36 -19.782 -95.739 -10.623 1.00 12.56 C ATOM 1887 C GLY I 36 -18.444 -96.408 -10.859 1.00 12.61 C ATOM 1888 O GLY I 36 -17.480 -96.114 -10.157 1.00 11.98 O ATOM 1889 N GLY I 37 -18.373 -97.321 -11.821 1.00 13.09 N ATOM 1890 CA GLY I 37 -17.105 -97.967 -12.099 1.00 14.17 C ATOM 1891 C GLY I 37 -16.988 -99.435 -11.742 1.00 14.66 C ATOM 1892 O GLY I 37 -15.975-100.055 -12.054 1.00 15.62 O ATOM 1893 N CYS I 38 -17.995 -99.997 -11.080 1.00 14.75 N ATOM 1894 CA CYS I 38 -17.952-101.411 -10.731 1.00 14.87 C ATOM 1895 C CYS I 38 -19.338-102.036 -10.617 1.00 15.79 C ATOM 1896 O CYS I 38 -20.327-101.338 -10.422 1.00 15.22 O ATOM 1897 CB CYS I 38 -17.186-101.625 -9.421 1.00 14.49 C ATOM 1898 SG CYS I 38 -17.994-101.063 -7.884 1.00 13.05 S ATOM 1899 N ARG I 39 -19.387-103.357 -10.768 1.00 16.89 N ATOM 1900 CA ARG I 39 -20.620-104.136 -10.670 1.00 18.44 C ATOM 1901 C ARG I 39 -21.731-103.683 -11.617 1.00 18.27 C ATOM 1902 O ARG I 39 -22.895-103.582 -11.229 1.00 18.61 O ATOM 1903 CB ARG I 39 -21.114-104.122 -9.220 1.00 19.99 C ATOM 1904 CG ARG I 39 -20.097-104.697 -8.234 1.00 22.87 C ATOM 1905 CD ARG I 39 -20.422-104.336 -6.791 1.00 25.88 C ATOM 1906 NE ARG I 39 -21.524-105.116 -6.232 1.00 27.86 N ATOM 1907 CZ ARG I 39 -21.436-106.394 -5.873 1.00 28.86 C ATOM 1908 NH1 ARG I 39 -20.293-107.051 -6.012 1.00 29.72 N ATOM 1909 NH2 ARG I 39 -22.491-107.016 -5.365 1.00 29.64 N ATOM 1910 N ALA I 40 -21.366-103.435 -12.870 1.00 18.35 N ATOM 1911 CA ALA I 40 -22.330-102.997 -13.869 1.00 18.45 C ATOM 1912 C ALA I 40 -23.381-104.062 -14.158 1.00 18.80 C ATOM 1913 O ALA I 40 -23.106-105.265 -14.088 1.00 19.12 O ATOM 1914 CB ALA I 40 -21.608-102.632 -15.164 1.00 18.59 C ATOM 1915 N LYS I 41 -24.592-103.610 -14.462 1.00 18.88 N ATOM 1916 CA LYS I 41 -25.668-104.520 -14.822 1.00 19.37 C ATOM 1917 C LYS I 41 -25.647-104.549 -16.346 1.00 19.33 C ATOM 1918 O LYS I 41 -24.827-103.871 -16.965 1.00 19.48 O ATOM 1919 CB LYS I 41 -27.014-104.016 -14.299 1.00 20.41 C ATOM 1920 CG LYS I 41 -27.174-104.176 -12.791 1.00 22.01 C ATOM 1921 CD LYS I 41 -28.577-103.823 -12.334 1.00 23.58 C ATOM 1922 CE LYS I 41 -28.733-104.019 -10.831 1.00 25.03 C ATOM 1923 NZ LYS I 41 -30.114-103.699 -10.369 1.00 26.76 N ATOM 1924 N ARG I 42 -26.537-105.319 -16.960 1.00 19.37 N ATOM 1925 CA ARG I 42 -26.536-105.418 -18.412 1.00 19.41 C ATOM 1926 C ARG I 42 -27.021-104.201 -19.197 1.00 18.44 C ATOM 1927 O ARG I 42 -26.585-103.992 -20.327 1.00 18.95 O ATOM 1928 CB ARG I 42 -27.297-106.673 -18.840 1.00 20.60 C ATOM 1929 CG ARG I 42 -26.528-107.952 -18.530 1.00 22.85 C ATOM 1930 CD ARG I 42 -27.327-109.199 -18.879 1.00 24.08 C ATOM 1931 NE ARG I 42 -28.459-109.396 -17.979 1.00 25.55 N ATOM 1932 CZ ARG I 42 -29.306-110.419 -18.065 1.00 26.59 C ATOM 1933 NH1 ARG I 42 -29.148-111.334 -19.013 1.00 27.00 N ATOM 1934 NH2 ARG I 42 -30.309-110.528 -17.203 1.00 27.00 N ATOM 1935 N ASN I 43 -27.914-103.402 -18.621 1.00 17.69 N ATOM 1936 CA ASN I 43 -28.389-102.209 -19.319 1.00 17.15 C ATOM 1937 C ASN I 43 -27.343-101.120 -19.085 1.00 17.19 C ATOM 1938 O ASN I 43 -27.603-100.104 -18.439 1.00 16.72 O ATOM 1939 CB ASN I 43 -29.755-101.775 -18.784 1.00 16.99 C ATOM 1940 CG ASN I 43 -30.449-100.784 -19.702 1.00 16.54 C ATOM 1941 OD1 ASN I 43 -29.988-100.528 -20.820 1.00 16.42 O ATOM 1942 ND2 ASN I 43 -31.564-100.229 -19.243 1.00 16.67 N ATOM 1943 N ASN I 44 -26.155-101.355 -19.632 1.00 17.28 N ATOM 1944 CA ASN I 44 -25.014-100.457 -19.480 1.00 18.01 C ATOM 1945 C ASN I 44 -24.117-100.644 -20.705 1.00 18.51 C ATOM 1946 O ASN I 44 -23.510-101.704 -20.877 1.00 18.93 O ATOM 1947 CB ASN I 44 -24.261-100.848 -18.205 1.00 17.74 C ATOM 1948 CG ASN I 44 -23.088 -99.945 -17.909 1.00 17.77 C ATOM 1949 OD1 ASN I 44 -22.368 -99.522 -18.814 1.00 17.29 O ATOM 1950 ND2 ASN I 44 -22.875 -99.660 -16.625 1.00 17.93 N ATOM 1951 N PHE I 45 -24.031 -99.620 -21.552 1.00 19.29 N ATOM 1952 CA PHE I 45 -23.226 -99.710 -22.767 1.00 20.71 C ATOM 1953 C PHE I 45 -22.228 -98.572 -22.913 1.00 21.81 C ATOM 1954 O PHE I 45 -22.470 -97.458 -22.451 1.00 21.63 O ATOM 1955 CB PHE I 45 -24.134 -99.727 -23.999 1.00 20.31 C ATOM 1956 CG PHE I 45 -25.267-100.705 -23.902 1.00 20.53 C ATOM 1957 CD1 PHE I 45 -26.408-100.396 -23.166 1.00 20.51 C ATOM 1958 CD2 PHE I 45 -25.188-101.943 -24.530 1.00 20.95 C ATOM 1959 CE1 PHE I 45 -27.454-101.308 -23.055 1.00 20.59 C ATOM 1960 CE2 PHE I 45 -26.227-102.862 -24.427 1.00 20.82 C ATOM 1961 CZ PHE I 45 -27.363-102.543 -23.687 1.00 20.71 C ATOM 1962 N LYS I 46 -21.114 -98.863 -23.578 1.00 23.44 N ATOM 1963 CA LYS I 46 -20.068 -97.873 -23.795 1.00 25.32 C ATOM 1964 C LYS I 46 -20.361 -96.947 -24.972 1.00 26.39 C ATOM 1965 O LYS I 46 -19.647 -95.970 -25.185 1.00 26.68 O ATOM 1966 CB LYS I 46 -18.718 -98.564 -24.009 1.00 26.16 C ATOM 1967 CG LYS I 46 -18.181 -99.255 -22.769 1.00 27.31 C ATOM 1968 CD LYS I 46 -16.808 -99.856 -23.012 1.00 28.35 C ATOM 1969 CE LYS I 46 -16.278-100.514 -21.750 1.00 29.12 C ATOM 1970 NZ LYS I 46 -17.203-101.577 -21.259 1.00 29.87 N ATOM 1971 N SER I 47 -21.411 -97.252 -25.731 1.00 27.24 N ATOM 1972 CA SER I 47 -21.786 -96.427 -26.875 1.00 27.97 C ATOM 1973 C SER I 47 -23.277 -96.534 -27.172 1.00 28.36 C ATOM 1974 O SER I 47 -23.932 -97.503 -26.783 1.00 28.22 O ATOM 1975 CB SER I 47 -20.991 -96.834 -28.121 1.00 28.53 C ATOM 1976 OG SER I 47 -21.360 -98.125 -28.572 1.00 29.31 O ATOM 1977 N ALA I 48 -23.807 -95.532 -27.864 1.00 28.44 N ATOM 1978 CA ALA I 48 -25.218 -95.514 -28.216 1.00 28.87 C ATOM 1979 C ALA I 48 -25.538 -96.615 -29.224 1.00 29.16 C ATOM 1980 O ALA I 48 -26.598 -97.237 -29.155 1.00 28.99 O ATOM 1981 CB ALA I 48 -25.594 -94.151 -28.786 1.00 28.87 C ATOM 1982 N GLU I 49 -24.613 -96.859 -30.151 1.00 29.59 N ATOM 1983 CA GLU I 49 -24.805 -97.881 -31.179 1.00 30.04 C ATOM 1984 C GLU I 49 -25.028 -99.272 -30.601 1.00 29.51 C ATOM 1985 O GLU I 49 -25.986 -99.953 -30.967 1.00 29.33 O ATOM 1986 CB GLU I 49 -23.608 -97.924 -32.139 1.00 31.04 C ATOM 1987 CG GLU I 49 -22.437 -97.036 -31.752 1.00 32.93 C ATOM 1988 CD GLU I 49 -22.777 -95.560 -31.820 1.00 33.56 C ATOM 1989 OE1 GLU I 49 -23.190 -95.094 -32.904 1.00 34.41 O ATOM 1990 OE2 GLU I 49 -22.629 -94.866 -30.791 1.00 34.38 O ATOM 1991 N ASP I 50 -24.142 -99.698 -29.706 1.00 29.06 N ATOM 1992 CA ASP I 50 -24.272-101.016 -29.096 1.00 28.63 C ATOM 1993 C ASP I 50 -25.539-101.101 -28.258 1.00 27.60 C ATOM 1994 O ASP I 50 -26.179-102.149 -28.190 1.00 27.30 O ATOM 1995 CB ASP I 50 -23.056-101.334 -28.227 1.00 29.93 C ATOM 1996 CG ASP I 50 -22.005-102.131 -28.971 1.00 31.30 C ATOM 1997 OD1 ASP I 50 -21.372-101.577 -29.896 1.00 32.00 O ATOM 1998 OD2 ASP I 50 -21.820-103.323 -28.637 1.00 32.46 O ATOM 1999 N CYS I 51 -25.897 -99.990 -27.625 1.00 26.39 N ATOM 2000 CA CYS I 51 -27.095 -99.941 -26.801 1.00 25.32 C ATOM 2001 C CYS I 51 -28.335-100.154 -27.666 1.00 25.38 C ATOM 2002 O CYS I 51 -29.196-100.969 -27.338 1.00 25.08 O ATOM 2003 CB CYS I 51 -27.178 -98.596 -26.077 1.00 24.39 C ATOM 2004 SG CYS I 51 -28.690 -98.349 -25.090 1.00 22.78 S ATOM 2005 N MET I 52 -28.421 -99.425 -28.775 1.00 25.49 N ATOM 2006 CA MET I 52 -29.560 -99.554 -29.679 1.00 26.01 C ATOM 2007 C MET I 52 -29.586-100.898 -30.404 1.00 25.89 C ATOM 2008 O MET I 52 -30.654-101.411 -30.732 1.00 25.49 O ATOM 2009 CB MET I 52 -29.557 -98.411 -30.698 1.00 26.89 C ATOM 2010 CG MET I 52 -30.024 -97.080 -30.129 1.00 28.24 C ATOM 2011 SD MET I 52 -31.690 -97.182 -29.435 1.00 30.24 S ATOM 2012 CE MET I 52 -32.635 -97.664 -30.898 1.00 30.01 C ATOM 2013 N ARG I 53 -28.413-101.471 -30.651 1.00 25.95 N ATOM 2014 CA ARG I 53 -28.335-102.759 -31.329 1.00 26.18 C ATOM 2015 C ARG I 53 -28.872-103.864 -30.430 1.00 25.83 C ATOM 2016 O ARG I 53 -29.626-104.734 -30.868 1.00 25.91 O ATOM 2017 CB ARG I 53 -26.885-103.079 -31.703 1.00 26.96 C ATOM 2018 CG ARG I 53 -26.705-104.438 -32.367 1.00 28.30 C ATOM 2019 CD ARG I 53 -25.252-104.693 -32.743 1.00 29.39 C ATOM 2020 NE ARG I 53 -24.397-104.940 -31.583 1.00 30.36 N ATOM 2021 CZ ARG I 53 -24.479-106.014 -30.801 1.00 30.80 C ATOM 2022 NH1 ARG I 53 -25.383-106.953 -31.047 1.00 31.28 N ATOM 2023 NH2 ARG I 53 -23.651-106.156 -29.775 1.00 31.33 N ATOM 2024 N THR I 54 -28.482-103.812 -29.162 1.00 25.14 N ATOM 2025 CA THR I 54 -28.885-104.810 -28.183 1.00 24.57 C ATOM 2026 C THR I 54 -30.303-104.635 -27.651 1.00 24.36 C ATOM 2027 O THR I 54 -31.033-105.613 -27.480 1.00 24.43 O ATOM 2028 CB THR I 54 -27.915-104.807 -26.983 1.00 24.41 C ATOM 2029 OG1 THR I 54 -26.582-105.064 -27.445 1.00 24.28 O ATOM 2030 CG2 THR I 54 -28.315-105.867 -25.967 1.00 24.37 C ATOM 2031 N CYS I 55 -30.696-103.392 -27.401 1.00 23.87 N ATOM 2032 CA CYS I 55 -32.014-103.116 -26.844 1.00 23.94 C ATOM 2033 C CYS I 55 -33.014-102.427 -27.765 1.00 24.63 C ATOM 2034 O CYS I 55 -34.167-102.216 -27.379 1.00 24.55 O ATOM 2035 CB CYS I 55 -31.858-102.283 -25.574 1.00 22.90 C ATOM 2036 SG CYS I 55 -31.130-103.157 -24.154 1.00 21.31 S ATOM 2037 N GLY I 56 -32.572-102.077 -28.969 1.00 25.54 N ATOM 2038 CA GLY I 56 -33.435-101.405 -29.929 1.00 26.92 C ATOM 2039 C GLY I 56 -34.746-102.113 -30.220 1.00 27.56 C ATOM 2040 O GLY I 56 -35.786-101.425 -30.321 1.00 28.35 O TER 2041 GLY I 56 HETATM 2042 CA CA A 800 -8.875 -75.174 -13.466 1.00 14.05 CA HETATM 2043 S SO4 I 990 -29.775-107.220 -14.858 1.00 42.53 S HETATM 2044 O1 SO4 I 990 -30.623-106.040 -14.788 1.00 42.39 O HETATM 2045 O2 SO4 I 990 -30.610-108.390 -15.356 1.00 42.18 O HETATM 2046 O3 SO4 I 990 -28.585-107.068 -15.842 1.00 42.11 O HETATM 2047 O4 SO4 I 990 -29.170-107.491 -13.486 1.00 42.43 O HETATM 2048 S SO4 I 991 -17.170-102.502 -16.535 1.00 46.29 S HETATM 2049 O1 SO4 I 991 -18.417-101.996 -17.097 1.00 46.26 O HETATM 2050 O2 SO4 I 991 -16.994-103.956 -16.943 1.00 46.42 O HETATM 2051 O3 SO4 I 991 -15.913-101.745 -17.041 1.00 46.00 O HETATM 2052 O4 SO4 I 991 -17.194-102.325 -15.024 1.00 46.02 O HETATM 2053 O HOH A 501 -14.593-101.922 16.343 1.00 25.83 O HETATM 2054 O HOH A 503 9.711 -79.424 -7.526 1.00 37.03 O HETATM 2055 O HOH A 505 9.601 -81.732 -15.281 1.00 42.19 O HETATM 2056 O HOH A 506 -21.436 -94.118 0.518 1.00 16.11 O HETATM 2057 O HOH A 507 7.214 -90.838 -1.892 1.00 40.38 O HETATM 2058 O HOH A 508 4.650 -72.173 -4.093 1.00 42.44 O HETATM 2059 O HOH A 510 -8.487 -86.288 15.813 1.00 18.00 O HETATM 2060 O HOH A 511 -1.768 -73.744 -1.046 1.00 39.92 O HETATM 2061 O HOH A 512 -9.240 -98.405 -20.673 1.00 22.04 O HETATM 2062 O HOH A 513 -5.769 -80.765 -8.913 1.00 13.31 O HETATM 2063 O HOH A 514 -18.835 -99.063 18.076 1.00 39.08 O HETATM 2064 O HOH A 515 -19.070 -73.610 0.882 1.00 35.65 O HETATM 2065 O HOH A 516 -10.648 -77.849 4.720 1.00 24.03 O HETATM 2066 O HOH A 518 5.415 -94.052 5.950 1.00 35.49 O HETATM 2067 O HOH A 520 -17.069-105.959 -0.503 1.00 24.97 O HETATM 2068 O HOH A 521 -16.720 -79.375 8.986 1.00 22.10 O HETATM 2069 O HOH A 522 9.849 -81.687 -8.880 1.00 35.08 O HETATM 2070 O HOH A 523 -10.462 -82.631 -14.896 1.00 13.40 O HETATM 2071 O HOH A 525 -2.891 -80.440 -6.874 1.00 19.22 O HETATM 2072 O HOH A 526 -10.518 -73.199 4.668 1.00 52.36 O HETATM 2073 O HOH A 528 -23.357 -91.859 4.595 1.00 22.39 O HETATM 2074 O HOH A 529 -22.035 -95.100 -3.925 1.00 19.07 O HETATM 2075 O HOH A 530 -1.878 -92.347 -20.222 1.00 23.35 O HETATM 2076 O HOH A 532 -10.669 -82.701 9.482 1.00 22.34 O HETATM 2077 O HOH A 533 -5.854 -78.960 -5.888 1.00 21.68 O HETATM 2078 O HOH A 534 -8.272 -76.129 -4.895 1.00 19.29 O HETATM 2079 O HOH A 535 -29.126 -96.989 3.992 1.00 25.70 O HETATM 2080 O HOH A 537 -10.805 -75.387 3.396 1.00 26.19 O HETATM 2081 O HOH A 538 -9.924-108.860 -12.872 1.00 22.76 O HETATM 2082 O HOH A 541 -24.706 -93.891 1.627 1.00 16.24 O HETATM 2083 O HOH A 542 -11.618 -87.129 -4.852 1.00 10.37 O HETATM 2084 O HOH A 543 -14.927 -82.659 -16.420 1.00 21.16 O HETATM 2085 O HOH A 544 -15.780 -83.423 -21.916 1.00 39.48 O HETATM 2086 O HOH A 545 10.132 -94.051 -9.386 1.00 31.70 O HETATM 2087 O HOH A 546 -5.816 -91.013 -3.030 1.00 15.80 O HETATM 2088 O HOH A 547 -13.806 -71.035 -4.191 1.00 38.30 O HETATM 2089 O HOH A 548 -4.411 -68.872 -7.410 1.00 47.37 O HETATM 2090 O HOH A 550 -19.338 -90.262 13.070 1.00 22.76 O HETATM 2091 O HOH A 552 -7.798 -84.962 -20.971 1.00 20.07 O HETATM 2092 O HOH A 553 -11.264 -70.001 -1.513 1.00 34.84 O HETATM 2093 O HOH A 556 -8.968 -76.126 -17.999 1.00 24.09 O HETATM 2094 O HOH A 558 -21.811 -91.784 13.391 1.00 27.23 O HETATM 2095 O HOH A 559 2.160-103.237 1.928 1.00 23.56 O HETATM 2096 O HOH A 560 -6.734 -77.670 -3.254 1.00 16.56 O HETATM 2097 O HOH A 561 -9.927-109.338 5.353 1.00 36.31 O HETATM 2098 O HOH A 563 -20.200 -80.542 -0.875 1.00 32.24 O HETATM 2099 O HOH A 564 -4.905-106.215 -10.582 1.00 22.70 O HETATM 2100 O HOH A 565 -9.857 -79.842 -15.356 1.00 11.08 O HETATM 2101 O HOH A 566 -17.176-108.549 6.593 1.00 30.29 O HETATM 2102 O HOH A 567 0.852-102.279 -15.834 1.00 40.20 O HETATM 2103 O HOH A 568 -10.017-101.908 -12.843 1.00 20.09 O HETATM 2104 O HOH A 569 -17.781 -81.073 7.030 1.00 23.22 O HETATM 2105 O HOH A 570 -8.954 -76.098 -14.852 1.00 51.72 O HETATM 2106 O HOH A 571 -9.568-102.416 -0.124 1.00 14.62 O HETATM 2107 O HOH A 573 -12.803 -89.276 -19.114 1.00 19.16 O HETATM 2108 O HOH A 574 -7.472-105.923 -12.005 1.00 25.03 O HETATM 2109 O HOH A 575 4.399 -89.226 0.363 1.00 20.93 O HETATM 2110 O HOH A 576 1.782 -91.400 -21.715 1.00 43.73 O HETATM 2111 O HOH A 577 -11.393 -83.272 -23.176 1.00 21.13 O HETATM 2112 O HOH A 579 4.457 -79.918 -15.044 1.00 32.17 O HETATM 2113 O HOH A 580 8.482 -89.043 -14.463 1.00 32.66 O HETATM 2114 O HOH A 582 -24.403 -89.983 -8.231 1.00 36.75 O HETATM 2115 O HOH A 583 -9.562 -68.528 -18.021 1.00 33.50 O HETATM 2116 O HOH A 585 -4.964 -96.275 6.626 1.00 14.10 O HETATM 2117 O HOH A 588 0.133-105.107 -11.112 1.00 36.02 O HETATM 2118 O HOH A 589 -6.941 -84.461 10.472 1.00 26.75 O HETATM 2119 O HOH A 590 -13.408 -70.216 -10.651 1.00 35.86 O HETATM 2120 O HOH A 592 -14.130 -98.751 9.835 1.00 15.46 O HETATM 2121 O HOH A 593 -4.083 -76.684 -5.458 1.00 19.24 O HETATM 2122 O HOH A 598 -21.173 -92.832 -4.151 1.00 48.20 O HETATM 2123 O HOH A 599 -19.579-108.126 8.766 1.00 31.24 O HETATM 2124 O HOH A 602 -12.626 -85.992 -7.187 1.00 11.37 O HETATM 2125 O HOH A 603 -8.073 -84.450 1.664 1.00 15.71 O HETATM 2126 O HOH A 604 -17.762 -90.685 3.854 1.00 16.64 O HETATM 2127 O HOH A 606 -21.173 -90.774 5.989 1.00 20.16 O HETATM 2128 O HOH A 607 -12.198-101.064 -1.022 1.00 19.02 O HETATM 2129 O HOH A 608 -9.075-107.494 -10.801 1.00 23.81 O HETATM 2130 O HOH A 609 -2.675 -90.093 10.440 1.00 24.47 O HETATM 2131 O HOH A 610 -8.830 -76.497 -15.412 1.00 17.55 O HETATM 2132 O HOH A 611 -12.378 -81.837 -19.368 1.00 19.47 O HETATM 2133 O HOH A 613 -19.025 -75.528 -10.729 1.00 26.86 O HETATM 2134 O HOH A 614 -5.126 -81.967 4.626 1.00 26.59 O HETATM 2135 O HOH A 616 -25.243 -93.190 -5.824 1.00 30.14 O HETATM 2136 O HOH A 617 5.432 -80.988 -1.451 1.00 24.43 O HETATM 2137 O HOH A 618 -18.646 -74.612 -13.968 1.00 29.31 O HETATM 2138 O HOH A 619 1.580 -75.067 -10.663 1.00 26.78 O HETATM 2139 O HOH A 620 -0.659 -99.566 12.617 1.00 29.62 O HETATM 2140 O HOH A 621 1.370 -84.408 4.375 1.00 26.79 O HETATM 2141 O HOH A 622 5.180 -78.151 -2.361 1.00 26.59 O HETATM 2142 O HOH A 623 2.607 -85.073 -20.094 1.00 33.08 O HETATM 2143 O HOH A 624 0.887 -78.410 -17.664 1.00 34.12 O HETATM 2144 O HOH A 626 -17.967 -79.947 -7.337 1.00 33.42 O HETATM 2145 O HOH A 628 0.148-105.423 -0.476 1.00 30.11 O HETATM 2146 O HOH A 629 -5.765 -73.615 -10.577 1.00 32.70 O HETATM 2147 O HOH A 630 -9.140 -98.250 16.349 1.00 34.52 O HETATM 2148 O HOH A 631 -17.520 -83.077 -11.567 1.00 35.34 O HETATM 2149 O HOH A 632 -20.464-105.668 13.910 1.00 31.84 O HETATM 2150 O HOH A 633 10.589 -96.032 -2.762 1.00 29.12 O HETATM 2151 O HOH A 635 4.942-105.476 4.638 1.00 35.32 O HETATM 2152 O HOH A 636 -11.691 -99.927 14.554 1.00 32.15 O HETATM 2153 O HOH A 637 -24.095 -99.695 11.683 1.00 36.14 O HETATM 2154 O HOH A 638 2.734-102.008 4.307 1.00 36.01 O HETATM 2155 O HOH A 639 -11.230 -98.764 -18.154 1.00 31.10 O HETATM 2156 O HOH A 640 -10.496 -79.241 8.483 1.00 34.54 O HETATM 2157 O HOH A 641 -7.629-110.044 -12.324 1.00 32.03 O HETATM 2158 O HOH A 642 -14.673 -93.963 17.851 1.00 33.21 O HETATM 2159 O HOH A 643 -12.481 -96.726 -14.715 1.00 32.95 O HETATM 2160 O HOH A 644 -18.129 -72.411 -10.397 1.00 35.15 O HETATM 2161 O HOH A 647 -13.576 -90.541 -21.735 1.00 33.26 O HETATM 2162 O HOH A 648 -6.499-109.333 -9.464 1.00 31.94 O HETATM 2163 O HOH A 649 -26.969-102.926 8.771 1.00 33.39 O HETATM 2164 O HOH A 651 9.131 -86.046 -4.748 1.00 35.15 O HETATM 2165 O HOH A 652 -16.800 -71.834 -14.276 1.00 35.07 O HETATM 2166 O HOH A 653 -2.415-102.176 -14.111 1.00 35.56 O HETATM 2167 O HOH A 655 -5.868-109.590 -0.347 1.00 34.62 O HETATM 2168 O HOH A 657 -27.840 -92.306 -2.267 1.00 35.69 O HETATM 2169 O HOH A 658 -20.366 -76.458 -1.583 1.00 34.41 O HETATM 2170 O HOH A 659 -12.493-102.174 -12.501 1.00 39.22 O HETATM 2171 O HOH A 660 -12.889 -80.750 -16.498 1.00 38.42 O HETATM 2172 O HOH A 661 -18.739 -82.659 9.074 1.00 37.39 O HETATM 2173 O HOH A 662 -19.842 -80.844 -8.951 1.00 38.67 O HETATM 2174 O HOH A 663 -4.129 -83.020 8.368 1.00 35.17 O HETATM 2175 O HOH A 664 -22.027 -86.976 -6.908 1.00 40.19 O HETATM 2176 O HOH A 666 -19.323 -73.257 -3.799 1.00 41.70 O HETATM 2177 O HOH A 668 -24.209 -93.638 7.062 1.00 33.99 O HETATM 2178 O HOH A 671 5.975 -81.903 -15.626 1.00 36.43 O HETATM 2179 O HOH A 673 -4.796 -72.027 0.282 1.00 37.52 O HETATM 2180 O HOH A 674 -13.200-105.843 8.829 1.00 36.01 O HETATM 2181 O HOH A 675 -13.985-112.396 -6.841 1.00 35.51 O HETATM 2182 O HOH A 676 10.209 -77.723 -9.092 1.00 40.43 O HETATM 2183 O HOH I 500 -27.371-100.287 -15.710 1.00 16.94 O HETATM 2184 O HOH I 536 -34.807-111.526 -21.714 1.00 25.95 O HETATM 2185 O HOH I 540 -28.522 -96.440 -9.582 1.00 34.47 O HETATM 2186 O HOH I 572 -26.733 -98.003 -7.529 1.00 29.32 O HETATM 2187 O HOH I 578 -17.100-104.879 -11.227 1.00 21.75 O HETATM 2188 O HOH I 584 -20.348 -98.781 -9.403 1.00 12.03 O HETATM 2189 O HOH I 587 -24.124-104.904 -6.823 1.00 39.84 O HETATM 2190 O HOH I 595 -29.619-101.761 -15.272 1.00 21.45 O HETATM 2191 O HOH I 601 -16.486 -94.035 -0.042 1.00 14.04 O HETATM 2192 O HOH I 605 -24.848-100.624 -14.689 1.00 16.66 O HETATM 2193 O HOH I 615 -30.198-103.958 -16.602 1.00 23.81 O HETATM 2194 O HOH I 625 -24.426-105.755 -10.170 1.00 35.43 O HETATM 2195 O HOH I 627 -24.153 -95.946 -5.349 1.00 33.38 O HETATM 2196 O HOH I 634 -27.121 -91.129 -13.325 1.00 32.28 O HETATM 2197 O HOH I 645 -21.204-101.282 -24.937 1.00 35.45 O HETATM 2198 O HOH I 646 -22.934-103.964 -18.692 1.00 34.32 O HETATM 2199 O HOH I 650 -18.566-104.714 -13.811 1.00 35.57 O HETATM 2200 O HOH I 654 -22.218-103.753 -22.810 1.00 40.93 O HETATM 2201 O HOH I 656 -37.141-106.109 -16.731 1.00 35.88 O HETATM 2202 O HOH I 665 -35.940 -99.134 -19.985 1.00 38.64 O HETATM 2203 O HOH I 667 -31.074-101.565 -11.969 1.00 34.99 O HETATM 2204 O HOH I 669 -23.735-103.540 -4.339 1.00 33.74 O HETATM 2205 O HOH I 672 -17.444 -95.237 -20.782 1.00 38.00 O CONECT 48 969 CONECT 193 308 CONECT 308 193 CONECT 401 2042 CONECT 416 2042 CONECT 440 2042 CONECT 459 2042 CONECT 481 2042 CONECT 843 1487 CONECT 886 1289 CONECT 969 48 CONECT 1048 1152 CONECT 1152 1048 CONECT 1228 1392 CONECT 1289 886 CONECT 1392 1228 CONECT 1487 843 CONECT 1639 2036 CONECT 1706 1898 CONECT 1838 2004 CONECT 1898 1706 CONECT 2004 1838 CONECT 2036 1639 CONECT 2042 401 416 440 459 CONECT 2042 481 2105 2131 CONECT 2043 2044 2045 2046 2047 CONECT 2044 2043 CONECT 2045 2043 CONECT 2046 2043 CONECT 2047 2043 CONECT 2048 2049 2050 2051 2052 CONECT 2049 2048 CONECT 2050 2048 CONECT 2051 2048 CONECT 2052 2048 CONECT 2105 2042 CONECT 2131 2042 MASTER 329 0 3 5 16 0 4 6 2203 2 37 23 END
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Related entries of code: 1f7z
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PDB Code
Check Database
Protein Sequence Similarity
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PDBbind
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RCSB PDB
PDBbind
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PDBbind
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PDBbind
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PDBbind
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RCSB PDB
PDBbind
58aa, >2TGP_2|Chain... at 100%
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RCSB PDB
PDBbind
58aa, >2TPI_2|Chain... at 100%
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RCSB PDB
PDBbind
58aa, >3FP6_2|Chain... at 100%
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PDBbind
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RCSB PDB
PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1f5r
RCSB PDB
PDBbind
BOVINE PANCREATIC TRYPSIN INHIBITOR (BPTI)
1fy8
RCSB PDB
PDBbind
BOVINE PANCREATIC TRYPSIN INHIBITOR (BPTI)
4dg4
RCSB PDB
PDBbind
bovine pancreatic trypsin inhibitor (BPTI)
Entry Information
PDB ID
1f7z
Complex Type
Protein-Protein
PDBbind Subset
general set
Protein Name
rat K15A trypsinogen
Ligand Name
BOVINE PANCREATIC TRYPSIN INHIBITOR (BPTI)
EC.Number
E.C.3.4.21.4
Resolution
1.55(Å)
Affinity (Kd/Ki/IC50)
Ki=12.4uM
Release Year
2001
Protein/NA Sequence
Check fasta file
Primary Reference
Protein science. (2001) 10, pp. 1331-42
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):
P00763
P00974
Entrez Gene ID
NCBI Entrez Gene ID:
25052
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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