Browse entries in the PDBbind-CN Database
HEADER TRANSFERASE 05-JUN-16 5B75 TITLE CRYSTAL STRUCTURE OF MOZ DOUBLE PHD FINGER IN COMPLEX WITH HISTONE H3 TITLE 2 BUTYRYLATION AT K14 COMPND MOL_ID: 1; COMPND 2 MOLECULE: HISTONE ACETYLTRANSFERASE KAT6A; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: UNP RESIDUES 194-323; COMPND 5 SYNONYM: MOZ; COMPND 6 EC: 2.3.1.48; COMPND 7 ENGINEERED: YES; COMPND 8 MOL_ID: 2; COMPND 9 MOLECULE: HISTONE H3; COMPND 10 CHAIN: B; COMPND 11 FRAGMENT: UNP RESIDUES 2-26; COMPND 12 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: MOZ; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 MOL_ID: 2; SOURCE 9 SYNTHETIC: YES; SOURCE 10 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 11 ORGANISM_COMMON: HUMAN; SOURCE 12 ORGANISM_TAXID: 9606 KEYWDS MOZ DOUBLE PHD FINGER, TRANSFERASE EXPDTA X-RAY DIFFRACTION AUTHOR H.LI,X.XIONG REVDAT 2 30-NOV-16 5B75 1 JRNL REVDAT 1 26-OCT-16 5B75 0 JRNL AUTH X.XIONG,T.PANCHENKO,S.YANG,S.ZHAO,P.YAN,W.ZHANG,W.XIE,Y.LI, JRNL AUTH 2 Y.ZHAO,C.D.ALLIS,H.LI JRNL TITL SELECTIVE RECOGNITION OF HISTONE CROTONYLATION BY DOUBLE PHD JRNL TITL 2 FINGERS OF MOZ AND DPF2 JRNL REF NAT.CHEM.BIOL. V. 12 1111 2016 JRNL REFN ESSN 1552-4469 JRNL PMID 27775714 JRNL DOI 10.1038/NCHEMBIO.2218 REMARK 2 REMARK 2 RESOLUTION. 1.70 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (1.10_2155: ???) REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.70 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 29.87 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.360 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.5 REMARK 3 NUMBER OF REFLECTIONS : 19643 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.171 REMARK 3 R VALUE (WORKING SET) : 0.170 REMARK 3 FREE R VALUE : 0.195 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.080 REMARK 3 FREE R VALUE TEST SET COUNT : 997 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 29.8735 - 3.2592 0.99 2820 138 0.1613 0.1920 REMARK 3 2 3.2592 - 2.5874 1.00 2712 142 0.1810 0.1951 REMARK 3 3 2.5874 - 2.2604 1.00 2648 149 0.1611 0.1958 REMARK 3 4 2.2604 - 2.0538 1.00 2645 151 0.1594 0.1597 REMARK 3 5 2.0538 - 1.9066 1.00 2640 139 0.1750 0.2239 REMARK 3 6 1.9066 - 1.7942 1.00 2643 140 0.1892 0.2162 REMARK 3 7 1.7942 - 1.7044 0.97 2538 138 0.2086 0.2342 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : NULL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : NULL REMARK 3 B_SOL : NULL REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.150 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 18.000 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 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.010 1139 REMARK 3 ANGLE : 1.000 1528 REMARK 3 CHIRALITY : 0.054 162 REMARK 3 PLANARITY : 0.008 200 REMARK 3 DIHEDRAL : 13.922 722 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 NCS DETAILS REMARK 3 NUMBER OF NCS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 5B75 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 09-JUN-16. REMARK 100 THE DEPOSITION ID IS D_1300000653. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 03-JAN-15 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : SSRF REMARK 200 BEAMLINE : BL17U REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.97920 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315R REMARK 200 INTENSITY-INTEGRATION SOFTWARE : NULL REMARK 200 DATA SCALING SOFTWARE : NULL REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 19643 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.700 REMARK 200 RESOLUTION RANGE LOW (A) : 29.900 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.8 REMARK 200 DATA REDUNDANCY : 4.500 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 22.7000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.70 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.73 REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: 4LLB REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 50.37 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.48 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: POLYETHYLENE GLYCOL 4000, LITHIUM REMARK 280 SULFATE, TRIS, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 290K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 23.83850 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 38.09550 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 24.06100 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 38.09550 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 23.83850 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 24.06100 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 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: 2260 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 9010 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -11.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B 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 SER A 193 REMARK 465 ARG A 313 REMARK 465 LYS A 314 REMARK 465 LYS A 315 REMARK 465 GLY A 316 REMARK 465 ARG A 317 REMARK 465 LYS A 318 REMARK 465 LEU A 319 REMARK 465 LEU A 320 REMARK 465 GLN A 321 REMARK 465 LYS A 322 REMARK 465 LYS A 323 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 HD22 ASN A 235 O HOH A 505 1.58 REMARK 500 O HOH A 608 O HOH A 613 1.95 REMARK 500 O HOH A 600 O HOH A 621 1.96 REMARK 500 O1 SO4 B 101 O HOH B 201 2.06 REMARK 500 O HOH A 527 O HOH A 624 2.09 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 O HOH A 568 O HOH A 577 4445 1.98 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 LYS A 198 3.17 -64.53 REMARK 500 PRO A 207 37.45 -83.30 REMARK 500 GLN A 271 -68.61 -102.80 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 ZN A 403 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 209 SG REMARK 620 2 CYS A 212 SG 111.3 REMARK 620 3 HIS A 238 ND1 99.6 98.0 REMARK 620 4 CYS A 241 SG 111.7 113.4 121.4 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 404 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 230 SG REMARK 620 2 CYS A 233 SG 105.6 REMARK 620 3 CYS A 259 SG 112.0 115.8 REMARK 620 4 CYS A 262 SG 108.1 114.0 101.2 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 402 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 265 SG REMARK 620 2 CYS A 268 SG 109.6 REMARK 620 3 HIS A 289 ND1 103.8 98.1 REMARK 620 4 CYS A 292 SG 116.6 115.1 111.4 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 401 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 281 SG REMARK 620 2 CYS A 284 SG 106.4 REMARK 620 3 CYS A 307 SG 108.5 112.2 REMARK 620 4 CYS A 310 SG 112.2 106.0 111.6 REMARK 620 N 1 2 3 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 401 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 402 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 403 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 404 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue SO4 B 101 DBREF 5B75 A 194 323 UNP Q92794 KAT6A_HUMAN 194 323 DBREF 5B75 B 1 25 UNP K7EMV3 K7EMV3_HUMAN 2 26 SEQADV 5B75 SER A 193 UNP Q92794 EXPRESSION TAG SEQRES 1 A 131 SER LEU PRO HIS GLU LYS ASP LYS PRO VAL ALA GLU PRO SEQRES 2 A 131 ILE PRO ILE CYS SER PHE CYS LEU GLY THR LYS GLU GLN SEQRES 3 A 131 ASN ARG GLU LYS LYS PRO GLU GLU LEU ILE SER CYS ALA SEQRES 4 A 131 ASP CYS GLY ASN SER GLY HIS PRO SER CYS LEU LYS PHE SEQRES 5 A 131 SER PRO GLU LEU THR VAL ARG VAL LYS ALA LEU ARG TRP SEQRES 6 A 131 GLN CYS ILE GLU CYS LYS THR CYS SER SER CYS ARG ASP SEQRES 7 A 131 GLN GLY LYS ASN ALA ASP ASN MET LEU PHE CYS ASP SER SEQRES 8 A 131 CYS ASP ARG GLY PHE HIS MET GLU CYS CYS ASP PRO PRO SEQRES 9 A 131 LEU THR ARG MET PRO LYS GLY MET TRP ILE CYS GLN ILE SEQRES 10 A 131 CYS ARG PRO ARG LYS LYS GLY ARG LYS LEU LEU GLN LYS SEQRES 11 A 131 LYS SEQRES 1 B 25 ALA ARG THR LYS GLN THR ALA ARG LYS SER THR GLY GLY SEQRES 2 B 25 BTK ALA PRO ARG LYS GLN LEU ALA THR LYS ALA ALA MODRES 5B75 BTK B 14 LYS MODIFIED RESIDUE HET BTK B 14 32 HET ZN A 401 1 HET ZN A 402 1 HET ZN A 403 1 HET ZN A 404 1 HET SO4 B 101 5 HETNAM BTK N~6~-BUTANOYL-L-LYSINE HETNAM ZN ZINC ION HETNAM SO4 SULFATE ION FORMUL 2 BTK C10 H20 N2 O3 FORMUL 3 ZN 4(ZN 2+) FORMUL 7 SO4 O4 S 2- FORMUL 8 HOH *188(H2 O) HELIX 1 AA1 HIS A 238 LYS A 243 1 6 HELIX 2 AA2 SER A 245 ALA A 254 1 10 HELIX 3 AA3 ASN A 274 ASN A 277 5 4 HELIX 4 AA4 HIS A 289 CYS A 293 5 5 HELIX 5 AA5 LYS B 4 GLY B 12 1 9 HELIX 6 AA6 PRO B 16 ALA B 25 1 10 SHEET 1 AA1 2 ILE A 228 SER A 229 0 SHEET 2 AA1 2 SER A 236 GLY A 237 -1 O GLY A 237 N ILE A 228 SHEET 1 AA2 3 GLY A 287 PHE A 288 0 SHEET 2 AA2 3 LEU A 279 PHE A 280 -1 N LEU A 279 O PHE A 288 SHEET 3 AA2 3 ARG B 2 THR B 3 -1 O ARG B 2 N PHE A 280 LINK SG CYS A 209 ZN ZN A 403 1555 1555 2.32 LINK SG CYS A 212 ZN ZN A 403 1555 1555 2.34 LINK SG CYS A 230 ZN ZN A 404 1555 1555 2.37 LINK SG CYS A 233 ZN ZN A 404 1555 1555 2.31 LINK ND1 HIS A 238 ZN ZN A 403 1555 1555 2.08 LINK SG CYS A 241 ZN ZN A 403 1555 1555 2.29 LINK SG CYS A 259 ZN ZN A 404 1555 1555 2.35 LINK SG CYS A 262 ZN ZN A 404 1555 1555 2.35 LINK SG CYS A 265 ZN ZN A 402 1555 1555 2.35 LINK SG CYS A 268 ZN ZN A 402 1555 1555 2.31 LINK SG CYS A 281 ZN ZN A 401 1555 1555 2.31 LINK SG CYS A 284 ZN ZN A 401 1555 1555 2.37 LINK ND1 HIS A 289 ZN ZN A 402 1555 1555 2.14 LINK SG CYS A 292 ZN ZN A 402 1555 1555 2.31 LINK SG CYS A 307 ZN ZN A 401 1555 1555 2.32 LINK SG CYS A 310 ZN ZN A 401 1555 1555 2.33 LINK C GLY B 13 N BTK B 14 1555 1555 1.32 LINK C BTK B 14 N ALA B 15 1555 1555 1.33 CISPEP 1 ASP A 294 PRO A 295 0 2.59 SITE 1 AC1 4 CYS A 281 CYS A 284 CYS A 307 CYS A 310 SITE 1 AC2 4 CYS A 265 CYS A 268 HIS A 289 CYS A 292 SITE 1 AC3 4 CYS A 209 CYS A 212 HIS A 238 CYS A 241 SITE 1 AC4 4 CYS A 230 CYS A 233 CYS A 259 CYS A 262 SITE 1 AC5 5 PRO B 16 ARG B 17 HOH B 201 HOH B 202 SITE 2 AC5 5 HOH B 206 CRYST1 47.677 48.122 76.191 90.00 90.00 90.00 P 21 21 21 4 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 0.020974 0.000000 0.000000 0.00000 SCALE2 0.000000 0.020781 0.000000 0.00000 SCALE3 0.000000 0.000000 0.013125 0.00000 ATOM 1 N LEU A 194 17.698 0.677 14.056 1.00 61.79 N ATOM 2 CA LEU A 194 17.869 0.057 15.367 1.00 61.76 C ATOM 3 C LEU A 194 18.992 -0.994 15.313 1.00 68.85 C ATOM 4 O LEU A 194 19.129 -1.690 14.304 1.00 65.36 O ATOM 5 CB LEU A 194 16.555 -0.584 15.835 1.00 60.15 C ATOM 6 CG LEU A 194 15.349 0.346 16.025 1.00 55.27 C ATOM 7 CD1 LEU A 194 14.121 -0.444 16.455 1.00 47.45 C ATOM 8 CD2 LEU A 194 15.661 1.441 17.037 1.00 58.24 C ATOM 9 HA LEU A 194 18.121 0.737 16.012 1.00 74.12 H ATOM 10 HB2 LEU A 194 16.298 -1.254 15.181 1.00 72.18 H ATOM 11 HB3 LEU A 194 16.718 -1.017 16.687 1.00 72.18 H ATOM 12 HG LEU A 194 15.146 0.773 15.178 1.00 66.32 H ATOM 13 HD11 LEU A 194 13.376 0.167 16.567 1.00 56.94 H ATOM 14 HD12 LEU A 194 13.912 -1.099 15.770 1.00 56.94 H ATOM 15 HD13 LEU A 194 14.312 -0.892 17.294 1.00 56.94 H ATOM 16 HD21 LEU A 194 14.882 2.011 17.135 1.00 69.89 H ATOM 17 HD22 LEU A 194 15.881 1.031 17.888 1.00 69.89 H ATOM 18 HD23 LEU A 194 16.414 1.962 16.716 1.00 69.89 H ATOM 19 N PRO A 195 19.804 -1.098 16.377 1.00 70.91 N ATOM 20 CA PRO A 195 20.875 -2.116 16.375 1.00 69.77 C ATOM 21 C PRO A 195 20.377 -3.556 16.311 1.00 68.66 C ATOM 22 O PRO A 195 21.117 -4.430 15.835 1.00 67.22 O ATOM 23 CB PRO A 195 21.618 -1.839 17.690 1.00 66.80 C ATOM 24 CG PRO A 195 21.369 -0.405 17.965 1.00 65.55 C ATOM 25 CD PRO A 195 19.970 -0.139 17.487 1.00 68.43 C ATOM 26 HA PRO A 195 21.480 -1.959 15.633 1.00 83.72 H ATOM 27 HB2 PRO A 195 21.253 -2.394 18.397 1.00 80.16 H ATOM 28 HB3 PRO A 195 22.566 -2.009 17.574 1.00 80.16 H ATOM 29 HG2 PRO A 195 21.442 -0.238 18.917 1.00 78.66 H ATOM 30 HG3 PRO A 195 22.007 0.136 17.473 1.00 78.66 H ATOM 31 HD2 PRO A 195 19.331 -0.324 18.192 1.00 82.11 H ATOM 32 HD3 PRO A 195 19.890 0.772 17.163 1.00 82.11 H ATOM 33 N HIS A 196 19.159 -3.839 16.779 1.00 70.44 N ATOM 34 CA HIS A 196 18.637 -5.201 16.759 1.00 70.62 C ATOM 35 C HIS A 196 17.910 -5.550 15.459 1.00 65.28 C ATOM 36 O HIS A 196 17.619 -6.730 15.230 1.00 60.71 O ATOM 37 CB HIS A 196 17.708 -5.425 17.964 1.00 72.52 C ATOM 38 CG HIS A 196 18.438 -5.746 19.239 1.00 79.13 C ATOM 39 ND1 HIS A 196 17.791 -5.929 20.445 1.00 78.05 N ATOM 40 CD2 HIS A 196 19.758 -5.922 19.492 1.00 80.41 C ATOM 41 CE1 HIS A 196 18.680 -6.200 21.384 1.00 78.16 C ATOM 42 NE2 HIS A 196 19.882 -6.201 20.833 1.00 82.45 N ATOM 43 H HIS A 196 18.618 -3.259 17.112 1.00 84.53 H ATOM 44 HA HIS A 196 19.382 -5.815 16.848 1.00 84.75 H ATOM 45 HB2 HIS A 196 17.190 -4.620 18.114 1.00 87.03 H ATOM 46 HB3 HIS A 196 17.115 -6.167 17.768 1.00 87.03 H ATOM 47 HD2 HIS A 196 20.451 -5.862 18.875 1.00 96.49 H ATOM 48 HE1 HIS A 196 18.493 -6.363 22.280 1.00 93.80 H ATOM 49 HE2 HIS A 196 20.621 -6.353 21.246 1.00 98.94 H ATOM 50 N GLU A 197 17.616 -4.559 14.607 1.00 65.51 N ATOM 51 CA GLU A 197 17.121 -4.831 13.255 1.00 56.56 C ATOM 52 C GLU A 197 18.266 -5.149 12.297 1.00 55.56 C ATOM 53 O GLU A 197 18.144 -6.034 11.441 1.00 49.05 O ATOM 54 CB GLU A 197 16.322 -3.632 12.733 1.00 54.04 C ATOM 55 CG GLU A 197 14.974 -3.409 13.422 1.00 49.87 C ATOM 56 CD GLU A 197 14.336 -2.080 13.027 1.00 48.98 C ATOM 57 OE1 GLU A 197 15.049 -1.228 12.444 1.00 48.46 O ATOM 58 OE2 GLU A 197 13.129 -1.892 13.297 1.00 42.20 O ATOM 59 H GLU A 197 17.695 -3.722 14.789 1.00 78.61 H ATOM 60 HA GLU A 197 16.529 -5.599 13.282 1.00 67.87 H ATOM 61 HB2 GLU A 197 16.852 -2.829 12.860 1.00 64.84 H ATOM 62 HB3 GLU A 197 16.150 -3.762 11.788 1.00 64.84 H ATOM 63 HG2 GLU A 197 14.367 -4.122 13.169 1.00 59.85 H ATOM 64 HG3 GLU A 197 15.105 -3.407 14.383 1.00 59.85 H ATOM 65 N LYS A 198 19.391 -4.447 12.425 1.00 62.46 N ATOM 66 CA LYS A 198 20.568 -4.790 11.635 1.00 62.19 C ATOM 67 C LYS A 198 21.129 -6.169 11.971 1.00 60.07 C ATOM 68 O LYS A 198 22.159 -6.547 11.395 1.00 58.64 O ATOM 69 CB LYS A 198 21.665 -3.739 11.833 1.00 58.86 C ATOM 70 CG LYS A 198 21.255 -2.323 11.439 1.00 61.54 C ATOM 71 CD LYS A 198 22.434 -1.348 11.545 1.00 61.63 C ATOM 72 CE LYS A 198 22.187 -0.225 12.550 1.00 63.06 C ATOM 73 NZ LYS A 198 22.429 1.115 11.938 1.00 59.71 N ATOM 74 H LYS A 198 19.496 -3.777 12.954 1.00 74.96 H ATOM 75 HA LYS A 198 20.323 -4.790 10.696 1.00 74.63 H ATOM 76 HB2 LYS A 198 21.916 -3.724 12.769 1.00 70.63 H ATOM 77 HB3 LYS A 198 22.432 -3.985 11.292 1.00 70.63 H ATOM 78 HG2 LYS A 198 20.942 -2.323 10.521 1.00 73.85 H ATOM 79 HG3 LYS A 198 20.552 -2.016 12.034 1.00 73.85 H ATOM 80 HD2 LYS A 198 23.222 -1.837 11.829 1.00 73.96 H ATOM 81 HD3 LYS A 198 22.588 -0.945 10.676 1.00 73.96 H ATOM 82 HE2 LYS A 198 21.266 -0.260 12.851 1.00 75.67 H ATOM 83 HE3 LYS A 198 22.791 -0.329 13.302 1.00 75.67 H ATOM 84 HZ1 LYS A 198 22.280 1.755 12.538 1.00 71.65 H ATOM 85 HZ2 LYS A 198 23.271 1.173 11.656 1.00 71.65 H ATOM 86 HZ3 LYS A 198 21.883 1.236 11.245 1.00 71.65 H ATOM 87 N ASP A 199 20.492 -6.937 12.865 1.00 60.79 N ATOM 88 CA ASP A 199 21.090 -8.156 13.388 1.00 60.12 C ATOM 89 C ASP A 199 20.275 -9.421 13.181 1.00 51.07 C ATOM 90 O ASP A 199 20.849 -10.512 13.284 1.00 53.27 O ATOM 91 CB ASP A 199 21.371 -8.007 14.892 1.00 63.53 C ATOM 92 CG ASP A 199 22.850 -7.915 15.188 1.00 63.39 C ATOM 93 OD1 ASP A 199 23.416 -6.810 15.029 1.00 66.69 O ATOM 94 OD2 ASP A 199 23.448 -8.953 15.556 1.00 63.87 O ATOM 95 H ASP A 199 19.710 -6.766 13.180 1.00 72.95 H ATOM 96 HA ASP A 199 21.943 -8.289 12.946 1.00 72.14 H ATOM 97 HB2 ASP A 199 20.947 -7.196 15.216 1.00 76.24 H ATOM 98 HB3 ASP A 199 21.016 -8.779 15.360 1.00 76.24 H ATOM 99 N LYS A 200 18.984 -9.327 12.932 1.00 46.41 N ATOM 100 CA LYS A 200 18.283 -10.577 12.690 1.00 36.70 C ATOM 101 C LYS A 200 18.279 -10.888 11.189 1.00 31.55 C ATOM 102 O LYS A 200 17.869 -10.033 10.386 1.00 27.73 O ATOM 103 CB LYS A 200 16.853 -10.519 13.208 1.00 42.36 C ATOM 104 CG LYS A 200 16.713 -10.576 14.732 1.00 50.20 C ATOM 105 CD LYS A 200 15.238 -10.453 15.185 1.00 46.92 C ATOM 106 CE LYS A 200 14.638 -9.069 14.812 1.00 47.95 C ATOM 107 NZ LYS A 200 13.208 -8.807 15.292 1.00 40.27 N ATOM 108 H LYS A 200 18.515 -8.607 12.897 1.00 55.69 H ATOM 109 HA LYS A 200 18.744 -11.297 13.148 1.00 44.04 H ATOM 110 HB2 LYS A 200 16.449 -9.690 12.909 1.00 50.83 H ATOM 111 HB3 LYS A 200 16.361 -11.271 12.841 1.00 50.83 H ATOM 112 HG2 LYS A 200 17.058 -11.425 15.052 1.00 60.24 H ATOM 113 HG3 LYS A 200 17.212 -9.843 15.125 1.00 60.24 H ATOM 114 HD2 LYS A 200 14.711 -11.140 14.748 1.00 56.30 H ATOM 115 HD3 LYS A 200 15.189 -10.555 16.149 1.00 56.30 H ATOM 116 HE2 LYS A 200 15.203 -8.379 15.194 1.00 57.54 H ATOM 117 HE3 LYS A 200 14.638 -8.988 13.845 1.00 57.54 H ATOM 118 HZ1 LYS A 200 12.945 -7.996 15.036 1.00 48.32 H ATOM 119 HZ2 LYS A 200 12.656 -9.413 14.946 1.00 48.32 H ATOM 120 HZ3 LYS A 200 13.172 -8.856 16.180 1.00 48.32 H ATOM 121 N PRO A 201 18.738 -12.074 10.780 1.00 32.03 N ATOM 122 CA PRO A 201 18.692 -12.432 9.357 1.00 28.86 C ATOM 123 C PRO A 201 17.280 -12.373 8.799 1.00 29.66 C ATOM 124 O PRO A 201 16.286 -12.488 9.519 1.00 28.47 O ATOM 125 CB PRO A 201 19.248 -13.862 9.334 1.00 32.02 C ATOM 126 CG PRO A 201 20.217 -13.867 10.475 1.00 31.01 C ATOM 127 CD PRO A 201 19.531 -13.049 11.548 1.00 34.59 C ATOM 128 HA PRO A 201 19.272 -11.851 8.841 1.00 34.63 H ATOM 129 HB2 PRO A 201 18.532 -14.500 9.482 1.00 38.43 H ATOM 130 HB3 PRO A 201 19.699 -14.030 8.492 1.00 38.43 H ATOM 131 HG2 PRO A 201 20.367 -14.777 10.777 1.00 37.21 H ATOM 132 HG3 PRO A 201 21.050 -13.451 10.202 1.00 37.21 H ATOM 133 HD2 PRO A 201 18.950 -13.612 12.083 1.00 41.51 H ATOM 134 HD3 PRO A 201 20.188 -12.592 12.097 1.00 41.51 H ATOM 135 N VAL A 202 17.227 -12.191 7.483 1.00 22.44 N ATOM 136 CA VAL A 202 16.005 -12.001 6.706 1.00 17.39 C ATOM 137 C VAL A 202 15.629 -13.309 6.022 1.00 21.74 C ATOM 138 O VAL A 202 16.472 -13.959 5.390 1.00 20.69 O ATOM 139 CB VAL A 202 16.223 -10.876 5.676 1.00 22.64 C ATOM 140 CG1 VAL A 202 15.151 -10.832 4.637 1.00 27.04 C ATOM 141 CG2 VAL A 202 16.334 -9.531 6.420 1.00 24.82 C ATOM 142 H VAL A 202 17.931 -12.173 6.990 1.00 26.92 H ATOM 143 HA VAL A 202 15.280 -11.743 7.297 1.00 20.87 H ATOM 144 HB VAL A 202 17.066 -11.031 5.222 1.00 27.17 H ATOM 145 HG11 VAL A 202 15.340 -10.108 4.020 1.00 32.45 H ATOM 146 HG12 VAL A 202 15.138 -11.678 4.162 1.00 32.45 H ATOM 147 HG13 VAL A 202 14.297 -10.683 5.071 1.00 32.45 H ATOM 148 HG21 VAL A 202 16.471 -8.823 5.771 1.00 29.78 H ATOM 149 HG22 VAL A 202 15.513 -9.375 6.913 1.00 29.78 H ATOM 150 HG23 VAL A 202 17.085 -9.570 7.032 1.00 29.78 H ATOM 151 N ALA A 203 14.358 -13.691 6.128 1.00 17.83 N ATOM 152 CA ALA A 203 13.856 -14.924 5.536 1.00 18.43 C ATOM 153 C ALA A 203 13.810 -14.838 4.007 1.00 17.79 C ATOM 154 O ALA A 203 13.718 -13.757 3.412 1.00 20.39 O ATOM 155 CB ALA A 203 12.452 -15.223 6.067 1.00 22.05 C ATOM 156 H ALA A 203 13.757 -13.242 6.548 1.00 21.39 H ATOM 157 HA ALA A 203 14.438 -15.659 5.783 1.00 22.11 H ATOM 158 HB1 ALA A 203 12.132 -16.046 5.664 1.00 26.46 H ATOM 159 HB2 ALA A 203 12.494 -15.321 7.031 1.00 26.46 H ATOM 160 HB3 ALA A 203 11.864 -14.489 5.833 1.00 26.46 H ATOM 161 N GLU A 204 13.838 -16.019 3.373 1.00 20.88 N ATOM 162 CA GLU A 204 13.710 -16.100 1.921 1.00 18.94 C ATOM 163 C GLU A 204 12.361 -15.525 1.497 1.00 22.12 C ATOM 164 O GLU A 204 11.325 -16.013 1.963 1.00 20.82 O ATOM 165 CB GLU A 204 13.804 -17.531 1.425 1.00 20.49 C ATOM 166 CG GLU A 204 13.701 -17.610 -0.090 1.00 23.99 C ATOM 167 CD GLU A 204 13.874 -19.011 -0.634 1.00 31.76 C ATOM 168 OE1 GLU A 204 14.478 -19.860 0.057 1.00 30.89 O ATOM 169 OE2 GLU A 204 13.379 -19.249 -1.763 1.00 33.37 O ATOM 170 H GLU A 204 13.931 -16.780 3.762 1.00 25.06 H ATOM 171 HA GLU A 204 14.413 -15.580 1.502 1.00 22.73 H ATOM 172 HB2 GLU A 204 14.658 -17.906 1.691 1.00 24.58 H ATOM 173 HB3 GLU A 204 13.078 -18.050 1.806 1.00 24.58 H ATOM 174 HG2 GLU A 204 12.826 -17.291 -0.362 1.00 28.78 H ATOM 175 HG3 GLU A 204 14.391 -17.052 -0.481 1.00 28.78 H ATOM 176 N PRO A 205 12.326 -14.553 0.593 1.00 20.45 N ATOM 177 CA PRO A 205 11.031 -13.988 0.180 1.00 22.52 C ATOM 178 C PRO A 205 10.263 -14.914 -0.749 1.00 25.39 C ATOM 179 O PRO A 205 10.830 -15.565 -1.630 1.00 25.84 O ATOM 180 CB PRO A 205 11.420 -12.693 -0.533 1.00 25.62 C ATOM 181 CG PRO A 205 12.834 -12.902 -0.940 1.00 25.61 C ATOM 182 CD PRO A 205 13.464 -13.801 0.031 1.00 24.52 C ATOM 183 HA PRO A 205 10.487 -13.781 0.956 1.00 27.02 H ATOM 184 HB2 PRO A 205 10.854 -12.563 -1.309 1.00 30.75 H ATOM 185 HB3 PRO A 205 11.345 -11.945 0.080 1.00 30.75 H ATOM 186 HG2 PRO A 205 12.855 -13.299 -1.825 1.00 30.74 H ATOM 187 HG3 PRO A 205 13.292 -12.046 -0.948 1.00 30.74 H ATOM 188 HD2 PRO A 205 14.079 -14.403 -0.416 1.00 29.42 H ATOM 189 HD3 PRO A 205 13.908 -13.290 0.726 1.00 29.42 H ATOM 190 N ILE A 206 8.947 -14.928 -0.573 1.00 21.33 N ATOM 191 CA ILE A 206 8.045 -15.656 -1.463 1.00 20.24 C ATOM 192 C ILE A 206 7.568 -14.679 -2.534 1.00 23.40 C ATOM 193 O ILE A 206 6.988 -13.642 -2.189 1.00 20.88 O ATOM 194 CB ILE A 206 6.871 -16.257 -0.684 1.00 23.55 C ATOM 195 CG1 ILE A 206 7.388 -17.346 0.242 1.00 24.97 C ATOM 196 CG2 ILE A 206 5.829 -16.823 -1.636 1.00 26.15 C ATOM 197 CD1 ILE A 206 7.461 -16.997 1.650 1.00 33.11 C ATOM 198 H ILE A 206 8.544 -14.516 0.066 1.00 25.59 H ATOM 199 HA ILE A 206 8.528 -16.377 -1.896 1.00 24.29 H ATOM 200 HB ILE A 206 6.460 -15.560 -0.148 1.00 28.26 H ATOM 201 HG12 ILE A 206 6.804 -18.116 0.164 1.00 29.96 H ATOM 202 HG13 ILE A 206 8.283 -17.590 -0.043 1.00 29.96 H ATOM 203 HG21 ILE A 206 5.098 -17.197 -1.118 1.00 31.38 H ATOM 204 HG22 ILE A 206 5.501 -16.109 -2.205 1.00 31.38 H ATOM 205 HG23 ILE A 206 6.239 -17.516 -2.177 1.00 31.38 H ATOM 206 HD11 ILE A 206 7.802 -17.758 2.146 1.00 39.73 H ATOM 207 HD12 ILE A 206 8.057 -16.239 1.756 1.00 39.73 H ATOM 208 HD13 ILE A 206 6.573 -16.767 1.964 1.00 39.73 H ATOM 209 N PRO A 207 7.815 -14.943 -3.829 1.00 22.01 N ATOM 210 CA PRO A 207 7.580 -13.910 -4.847 1.00 20.40 C ATOM 211 C PRO A 207 6.129 -13.815 -5.323 1.00 24.44 C ATOM 212 O PRO A 207 5.870 -13.578 -6.508 1.00 24.73 O ATOM 213 CB PRO A 207 8.515 -14.343 -5.985 1.00 26.66 C ATOM 214 CG PRO A 207 8.513 -15.807 -5.900 1.00 25.72 C ATOM 215 CD PRO A 207 8.398 -16.163 -4.410 1.00 27.24 C ATOM 216 HA PRO A 207 7.863 -13.044 -4.516 1.00 24.48 H ATOM 217 HB2 PRO A 207 8.160 -14.044 -6.837 1.00 32.00 H ATOM 218 HB3 PRO A 207 9.405 -13.988 -5.835 1.00 32.00 H ATOM 219 HG2 PRO A 207 7.753 -16.158 -6.391 1.00 30.86 H ATOM 220 HG3 PRO A 207 9.342 -16.153 -6.268 1.00 30.86 H ATOM 221 HD2 PRO A 207 7.802 -16.917 -4.286 1.00 32.68 H ATOM 222 HD3 PRO A 207 9.275 -16.333 -4.033 1.00 32.68 H ATOM 223 N ILE A 208 5.184 -13.998 -4.402 1.00 22.08 N ATOM 224 CA ILE A 208 3.753 -13.958 -4.691 1.00 20.27 C ATOM 225 C ILE A 208 3.089 -13.100 -3.629 1.00 21.76 C ATOM 226 O ILE A 208 3.413 -13.220 -2.444 1.00 21.38 O ATOM 227 CB ILE A 208 3.103 -15.361 -4.700 1.00 22.08 C ATOM 228 CG1 ILE A 208 3.785 -16.278 -5.719 1.00 23.22 C ATOM 229 CG2 ILE A 208 1.590 -15.237 -4.988 1.00 20.49 C ATOM 230 CD1 ILE A 208 3.563 -17.706 -5.416 1.00 27.75 C ATOM 231 H ILE A 208 5.355 -14.154 -3.574 1.00 26.50 H ATOM 232 HA ILE A 208 3.608 -13.545 -5.556 1.00 24.33 H ATOM 233 HB ILE A 208 3.213 -15.752 -3.820 1.00 26.49 H ATOM 234 HG12 ILE A 208 3.424 -16.097 -6.602 1.00 27.86 H ATOM 235 HG13 ILE A 208 4.740 -16.111 -5.708 1.00 27.86 H ATOM 236 HG21 ILE A 208 1.196 -16.123 -4.992 1.00 24.58 H ATOM 237 HG22 ILE A 208 1.181 -14.695 -4.296 1.00 24.58 H ATOM 238 HG23 ILE A 208 1.468 -14.816 -5.854 1.00 24.58 H ATOM 239 HD11 ILE A 208 4.013 -18.244 -6.087 1.00 33.29 H ATOM 240 HD12 ILE A 208 3.925 -17.902 -4.538 1.00 33.29 H ATOM 241 HD13 ILE A 208 2.610 -17.887 -5.430 1.00 33.29 H ATOM 242 N CYS A 209 2.165 -12.238 -4.048 1.00 19.39 N ATOM 243 CA CYS A 209 1.418 -11.442 -3.084 1.00 18.30 C ATOM 244 C CYS A 209 0.400 -12.324 -2.357 1.00 19.29 C ATOM 245 O CYS A 209 -0.429 -12.975 -2.985 1.00 16.78 O ATOM 246 CB CYS A 209 0.711 -10.284 -3.790 1.00 16.50 C ATOM 247 SG CYS A 209 -0.356 -9.305 -2.727 1.00 18.23 S ATOM 248 H CYS A 209 1.956 -12.099 -4.870 1.00 23.26 H ATOM 249 HA CYS A 209 2.029 -11.073 -2.427 1.00 21.96 H ATOM 250 HB2 CYS A 209 1.383 -9.689 -4.160 1.00 19.80 H ATOM 251 HB3 CYS A 209 0.164 -10.644 -4.505 1.00 19.80 H ATOM 252 N SER A 210 0.436 -12.311 -1.019 1.00 18.17 N ATOM 253 CA SER A 210 -0.453 -13.162 -0.244 1.00 17.50 C ATOM 254 C SER A 210 -1.896 -12.704 -0.317 1.00 20.21 C ATOM 255 O SER A 210 -2.798 -13.477 0.034 1.00 19.03 O ATOM 256 CB SER A 210 -0.053 -13.165 1.216 1.00 24.32 C ATOM 257 OG SER A 210 1.141 -13.884 1.378 1.00 23.59 O ATOM 258 H SER A 210 0.962 -11.822 -0.547 1.00 21.80 H ATOM 259 HA SER A 210 -0.402 -14.071 -0.579 1.00 21.00 H ATOM 260 HB2 SER A 210 0.083 -12.251 1.512 1.00 29.18 H ATOM 261 HB3 SER A 210 -0.753 -13.586 1.739 1.00 29.18 H ATOM 262 HG SER A 210 1.367 -13.888 2.188 1.00 28.31 H ATOM 263 N PHE A 211 -2.127 -11.465 -0.720 1.00 17.48 N ATOM 264 CA PHE A 211 -3.500 -10.959 -0.800 1.00 19.35 C ATOM 265 C PHE A 211 -4.160 -11.223 -2.150 1.00 20.65 C ATOM 266 O PHE A 211 -5.327 -11.648 -2.187 1.00 22.09 O ATOM 267 CB PHE A 211 -3.509 -9.465 -0.502 1.00 18.19 C ATOM 268 CG PHE A 211 -2.973 -9.146 0.847 1.00 19.05 C ATOM 269 CD1 PHE A 211 -3.765 -9.299 1.970 1.00 22.32 C ATOM 270 CD2 PHE A 211 -1.656 -8.748 1.001 1.00 23.21 C ATOM 271 CE1 PHE A 211 -3.240 -9.072 3.219 1.00 20.73 C ATOM 272 CE2 PHE A 211 -1.140 -8.492 2.241 1.00 21.04 C ATOM 273 CZ PHE A 211 -1.926 -8.651 3.352 1.00 21.67 C ATOM 274 H PHE A 211 -1.521 -10.899 -0.950 1.00 20.98 H ATOM 275 HA PHE A 211 -4.034 -11.400 -0.120 1.00 23.22 H ATOM 276 HB2 PHE A 211 -2.961 -9.008 -1.159 1.00 21.83 H ATOM 277 HB3 PHE A 211 -4.422 -9.139 -0.547 1.00 21.83 H ATOM 278 HD1 PHE A 211 -4.644 -9.591 1.882 1.00 26.78 H ATOM 279 HD2 PHE A 211 -1.117 -8.648 0.250 1.00 27.85 H ATOM 280 HE1 PHE A 211 -3.777 -9.161 3.973 1.00 24.88 H ATOM 281 HE2 PHE A 211 -0.255 -8.218 2.331 1.00 25.24 H ATOM 282 HZ PHE A 211 -1.578 -8.473 4.196 1.00 26.00 H ATOM 283 N CYS A 212 -3.478 -10.927 -3.261 1.00 18.87 N ATOM 284 CA CYS A 212 -4.091 -11.063 -4.574 1.00 18.67 C ATOM 285 C CYS A 212 -3.508 -12.203 -5.403 1.00 20.31 C ATOM 286 O CYS A 212 -4.059 -12.512 -6.464 1.00 19.74 O ATOM 287 CB CYS A 212 -3.982 -9.751 -5.367 1.00 23.09 C ATOM 288 SG CYS A 212 -2.318 -9.401 -6.032 1.00 19.68 S ATOM 289 H CYS A 212 -2.665 -10.648 -3.276 1.00 22.65 H ATOM 290 HA CYS A 212 -5.035 -11.250 -4.451 1.00 22.41 H ATOM 291 HB2 CYS A 212 -4.596 -9.790 -6.117 1.00 27.71 H ATOM 292 HB3 CYS A 212 -4.226 -9.016 -4.784 1.00 27.71 H ATOM 293 N LEU A 213 -2.422 -12.849 -4.945 1.00 19.17 N ATOM 294 CA LEU A 213 -1.762 -13.964 -5.621 1.00 20.04 C ATOM 295 C LEU A 213 -1.058 -13.545 -6.907 1.00 23.26 C ATOM 296 O LEU A 213 -0.626 -14.404 -7.678 1.00 24.02 O ATOM 297 CB LEU A 213 -2.724 -15.116 -5.938 1.00 21.55 C ATOM 298 CG LEU A 213 -3.447 -15.676 -4.734 1.00 23.28 C ATOM 299 CD1 LEU A 213 -4.272 -16.921 -5.152 1.00 22.49 C ATOM 300 CD2 LEU A 213 -2.493 -16.057 -3.598 1.00 22.96 C ATOM 301 H LEU A 213 -2.036 -12.642 -4.205 1.00 23.01 H ATOM 302 HA LEU A 213 -1.082 -14.316 -5.026 1.00 24.05 H ATOM 303 HB2 LEU A 213 -3.395 -14.797 -6.562 1.00 25.87 H ATOM 304 HB3 LEU A 213 -2.220 -15.839 -6.342 1.00 25.87 H ATOM 305 HG LEU A 213 -4.064 -15.007 -4.396 1.00 27.94 H ATOM 306 HD11 LEU A 213 -4.731 -17.272 -4.372 1.00 26.98 H ATOM 307 HD12 LEU A 213 -4.918 -16.660 -5.827 1.00 26.98 H ATOM 308 HD13 LEU A 213 -3.671 -17.592 -5.511 1.00 26.98 H ATOM 309 HD21 LEU A 213 -3.010 -16.408 -2.857 1.00 27.56 H ATOM 310 HD22 LEU A 213 -1.874 -16.731 -3.920 1.00 27.56 H ATOM 311 HD23 LEU A 213 -2.006 -15.267 -3.318 1.00 27.56 H ATOM 312 N GLY A 214 -0.914 -12.279 -7.141 1.00 20.16 N ATOM 313 CA GLY A 214 -0.134 -11.816 -8.260 1.00 21.47 C ATOM 314 C GLY A 214 1.334 -11.764 -7.903 1.00 28.31 C ATOM 315 O GLY A 214 1.724 -11.951 -6.763 1.00 25.67 O ATOM 316 H GLY A 214 -1.258 -11.651 -6.664 1.00 24.19 H ATOM 317 HA2 GLY A 214 -0.252 -12.416 -9.013 1.00 25.77 H ATOM 318 HA3 GLY A 214 -0.425 -10.928 -8.518 1.00 25.77 H ATOM 319 N THR A 215 2.148 -11.531 -8.909 1.00 27.88 N ATOM 320 CA THR A 215 3.587 -11.420 -8.753 1.00 24.24 C ATOM 321 C THR A 215 3.992 -9.970 -8.913 1.00 24.15 C ATOM 322 O THR A 215 3.159 -9.078 -9.040 1.00 24.86 O ATOM 323 CB THR A 215 4.284 -12.278 -9.794 1.00 27.47 C ATOM 324 OG1 THR A 215 3.993 -11.715 -11.083 1.00 27.14 O ATOM 325 CG2 THR A 215 3.787 -13.717 -9.709 1.00 32.31 C ATOM 326 H THR A 215 1.884 -11.429 -9.722 1.00 33.45 H ATOM 327 HA THR A 215 3.848 -11.724 -7.870 1.00 29.09 H ATOM 328 HB THR A 215 5.241 -12.268 -9.640 1.00 32.97 H ATOM 329 HG1 THR A 215 4.365 -12.168 -11.684 1.00 32.57 H ATOM 330 HG21 THR A 215 4.234 -14.262 -10.375 1.00 38.77 H ATOM 331 HG22 THR A 215 3.972 -14.080 -8.829 1.00 38.77 H ATOM 332 HG23 THR A 215 2.830 -13.747 -9.867 1.00 38.77 H ATOM 333 N LYS A 216 5.307 -9.731 -8.966 1.00 23.59 N ATOM 334 CA LYS A 216 5.764 -8.388 -9.278 1.00 25.53 C ATOM 335 C LYS A 216 5.264 -7.923 -10.636 1.00 26.27 C ATOM 336 O LYS A 216 5.266 -6.719 -10.898 1.00 27.48 O ATOM 337 CB LYS A 216 7.287 -8.325 -9.247 1.00 25.90 C ATOM 338 CG LYS A 216 7.943 -9.136 -10.348 1.00 32.32 C ATOM 339 CD LYS A 216 9.465 -9.176 -10.150 1.00 39.41 C ATOM 340 CE LYS A 216 10.125 -10.215 -11.052 1.00 42.58 C ATOM 341 NZ LYS A 216 11.565 -10.417 -10.682 1.00 51.91 N ATOM 342 H LYS A 216 5.929 -10.309 -8.829 1.00 28.31 H ATOM 343 HA LYS A 216 5.424 -7.775 -8.608 1.00 30.63 H ATOM 344 HB2 LYS A 216 7.566 -7.402 -9.351 1.00 31.08 H ATOM 345 HB3 LYS A 216 7.598 -8.671 -8.396 1.00 31.08 H ATOM 346 HG2 LYS A 216 7.606 -10.046 -10.324 1.00 38.78 H ATOM 347 HG3 LYS A 216 7.755 -8.727 -11.207 1.00 38.78 H ATOM 348 HD2 LYS A 216 9.838 -8.307 -10.365 1.00 47.30 H ATOM 349 HD3 LYS A 216 9.661 -9.406 -9.228 1.00 47.30 H ATOM 350 HE2 LYS A 216 9.664 -11.063 -10.956 1.00 51.09 H ATOM 351 HE3 LYS A 216 10.086 -9.912 -11.972 1.00 51.09 H ATOM 352 HZ1 LYS A 216 11.933 -11.025 -11.217 1.00 62.29 H ATOM 353 HZ2 LYS A 216 12.010 -9.651 -10.764 1.00 62.29 H ATOM 354 HZ3 LYS A 216 11.626 -10.698 -9.840 1.00 62.29 H ATOM 355 N GLU A 217 4.848 -8.851 -11.506 1.00 28.66 N ATOM 356 CA GLU A 217 4.387 -8.484 -12.841 1.00 31.28 C ATOM 357 C GLU A 217 2.951 -7.983 -12.861 1.00 36.31 C ATOM 358 O GLU A 217 2.571 -7.300 -13.820 1.00 33.66 O ATOM 359 CB GLU A 217 4.503 -9.672 -13.796 1.00 35.35 C ATOM 360 CG GLU A 217 5.858 -10.341 -13.830 1.00 38.23 C ATOM 361 CD GLU A 217 6.962 -9.415 -14.284 1.00 52.33 C ATOM 362 OE1 GLU A 217 6.652 -8.339 -14.855 1.00 55.11 O ATOM 363 OE2 GLU A 217 8.146 -9.766 -14.062 1.00 57.44 O ATOM 364 H GLU A 217 4.826 -9.696 -11.345 1.00 34.39 H ATOM 365 HA GLU A 217 4.953 -7.773 -13.181 1.00 37.54 H ATOM 366 HB2 GLU A 217 3.853 -10.343 -13.534 1.00 42.42 H ATOM 367 HB3 GLU A 217 4.307 -9.365 -14.695 1.00 42.42 H ATOM 368 HG2 GLU A 217 6.078 -10.653 -12.938 1.00 45.88 H ATOM 369 HG3 GLU A 217 5.824 -11.091 -14.444 1.00 45.88 H ATOM 370 N GLN A 218 2.144 -8.282 -11.836 1.00 31.82 N ATOM 371 CA GLN A 218 0.722 -7.967 -11.914 1.00 27.53 C ATOM 372 C GLN A 218 0.116 -7.808 -10.527 1.00 25.69 C ATOM 373 O GLN A 218 0.034 -8.792 -9.774 1.00 26.68 O ATOM 374 CB GLN A 218 0.026 -9.077 -12.671 1.00 32.94 C ATOM 375 CG GLN A 218 -1.248 -8.663 -13.349 1.00 42.28 C ATOM 376 CD GLN A 218 -1.922 -9.816 -14.085 1.00 43.08 C ATOM 377 OE1 GLN A 218 -2.970 -9.625 -14.685 1.00 51.38 O ATOM 378 NE2 GLN A 218 -1.322 -11.013 -14.041 1.00 49.51 N ATOM 379 H GLN A 218 2.392 -8.659 -11.104 1.00 38.19 H ATOM 380 HA GLN A 218 0.599 -7.137 -12.402 1.00 33.03 H ATOM 381 HB2 GLN A 218 0.627 -9.411 -13.355 1.00 39.53 H ATOM 382 HB3 GLN A 218 -0.190 -9.789 -12.049 1.00 39.53 H ATOM 383 HG2 GLN A 218 -1.868 -8.330 -12.681 1.00 50.74 H ATOM 384 HG3 GLN A 218 -1.051 -7.967 -13.995 1.00 50.74 H ATOM 385 HE21 GLN A 218 -0.584 -11.110 -13.609 1.00 59.41 H ATOM 386 HE22 GLN A 218 -1.674 -11.686 -14.446 1.00 59.41 H ATOM 387 N ASN A 219 -0.360 -6.617 -10.224 1.00 27.86 N ATOM 388 CA ASN A 219 -1.127 -6.348 -9.019 1.00 31.01 C ATOM 389 C ASN A 219 -2.618 -6.374 -9.358 1.00 28.89 C ATOM 390 O ASN A 219 -3.010 -6.907 -10.398 1.00 27.57 O ATOM 391 CB ASN A 219 -0.686 -5.023 -8.405 1.00 27.63 C ATOM 392 CG ASN A 219 -1.055 -3.815 -9.269 1.00 30.39 C ATOM 393 OD1 ASN A 219 -1.752 -3.947 -10.275 1.00 31.50 O ATOM 394 ND2 ASN A 219 -0.628 -2.638 -8.846 1.00 30.97 N ATOM 395 H ASN A 219 -0.250 -5.922 -10.718 1.00 33.43 H ATOM 396 HA ASN A 219 -0.954 -7.050 -8.372 1.00 37.22 H ATOM 397 HB2 ASN A 219 -1.117 -4.916 -7.542 1.00 33.16 H ATOM 398 HB3 ASN A 219 0.277 -5.030 -8.297 1.00 33.16 H ATOM 399 HD21 ASN A 219 -0.808 -1.928 -9.296 1.00 37.16 H ATOM 400 HD22 ASN A 219 -0.169 -2.582 -8.121 1.00 37.16 H ATOM 401 N ARG A 220 -3.458 -5.805 -8.482 1.00 24.18 N ATOM 402 CA ARG A 220 -4.905 -5.926 -8.676 1.00 31.75 C ATOM 403 C ARG A 220 -5.391 -5.060 -9.827 1.00 35.19 C ATOM 404 O ARG A 220 -6.461 -5.336 -10.390 1.00 34.14 O ATOM 405 CB ARG A 220 -5.666 -5.566 -7.389 1.00 29.43 C ATOM 406 CG ARG A 220 -5.718 -6.732 -6.396 1.00 26.74 C ATOM 407 CD ARG A 220 -6.449 -6.381 -5.108 1.00 22.93 C ATOM 408 NE ARG A 220 -6.617 -7.566 -4.283 1.00 19.71 N ATOM 409 CZ ARG A 220 -6.588 -7.604 -2.959 1.00 19.16 C ATOM 410 NH1 ARG A 220 -6.404 -6.504 -2.248 1.00 22.41 N ATOM 411 NH2 ARG A 220 -6.780 -8.774 -2.352 1.00 20.06 N ATOM 412 H ARG A 220 -3.222 -5.355 -7.788 1.00 29.02 H ATOM 413 HA ARG A 220 -5.113 -6.848 -8.893 1.00 38.10 H ATOM 414 HB2 ARG A 220 -5.222 -4.821 -6.956 1.00 35.32 H ATOM 415 HB3 ARG A 220 -6.577 -5.324 -7.617 1.00 35.32 H ATOM 416 HG2 ARG A 220 -6.181 -7.478 -6.809 1.00 32.09 H ATOM 417 HG3 ARG A 220 -4.812 -6.991 -6.166 1.00 32.09 H ATOM 418 HD2 ARG A 220 -5.932 -5.729 -4.609 1.00 27.51 H ATOM 419 HD3 ARG A 220 -7.327 -6.027 -5.320 1.00 27.51 H ATOM 420 HE ARG A 220 -6.746 -8.311 -4.692 1.00 23.65 H ATOM 421 HH11 ARG A 220 -6.288 -5.750 -2.645 1.00 26.90 H ATOM 422 HH12 ARG A 220 -6.390 -6.545 -1.389 1.00 26.90 H ATOM 423 HH21 ARG A 220 -6.900 -9.486 -2.819 1.00 24.07 H ATOM 424 HH22 ARG A 220 -6.763 -8.821 -1.493 1.00 24.07 H ATOM 425 N GLU A 221 -4.632 -4.036 -10.197 1.00 34.60 N ATOM 426 CA GLU A 221 -4.952 -3.221 -11.358 1.00 40.66 C ATOM 427 C GLU A 221 -4.260 -3.711 -12.626 1.00 38.68 C ATOM 428 O GLU A 221 -4.209 -2.977 -13.614 1.00 44.53 O ATOM 429 CB GLU A 221 -4.588 -1.770 -11.070 1.00 38.65 C ATOM 430 CG GLU A 221 -5.090 -1.311 -9.709 1.00 43.26 C ATOM 431 CD GLU A 221 -5.454 0.163 -9.665 1.00 59.73 C ATOM 432 OE1 GLU A 221 -4.799 0.915 -8.910 1.00 67.40 O ATOM 433 OE2 GLU A 221 -6.398 0.577 -10.378 1.00 64.15 O ATOM 434 H GLU A 221 -3.917 -3.792 -9.787 1.00 41.52 H ATOM 435 HA GLU A 221 -5.909 -3.261 -11.511 1.00 48.79 H ATOM 436 HB2 GLU A 221 -3.623 -1.675 -11.083 1.00 46.38 H ATOM 437 HB3 GLU A 221 -4.988 -1.201 -11.746 1.00 46.38 H ATOM 438 HG2 GLU A 221 -5.882 -1.821 -9.479 1.00 51.91 H ATOM 439 HG3 GLU A 221 -4.395 -1.466 -9.050 1.00 51.91 H ATOM 440 N LYS A 222 -3.735 -4.935 -12.621 1.00 36.11 N ATOM 441 CA LYS A 222 -3.079 -5.524 -13.790 1.00 43.83 C ATOM 442 C LYS A 222 -1.879 -4.696 -14.244 1.00 43.64 C ATOM 443 O LYS A 222 -1.571 -4.626 -15.437 1.00 46.22 O ATOM 444 CB LYS A 222 -4.064 -5.702 -14.949 1.00 49.31 C ATOM 445 CG LYS A 222 -3.571 -6.668 -16.039 1.00 55.96 C ATOM 446 CD LYS A 222 -4.582 -6.775 -17.184 1.00 64.66 C ATOM 447 CE LYS A 222 -4.010 -7.496 -18.399 1.00 67.14 C ATOM 448 NZ LYS A 222 -5.002 -7.546 -19.515 1.00 72.17 N ATOM 449 H LYS A 222 -3.745 -5.456 -11.937 1.00 43.33 H ATOM 450 HA LYS A 222 -2.751 -6.404 -13.548 1.00 52.60 H ATOM 451 HB2 LYS A 222 -4.899 -6.051 -14.599 1.00 59.18 H ATOM 452 HB3 LYS A 222 -4.217 -4.839 -15.365 1.00 59.18 H ATOM 453 HG2 LYS A 222 -2.732 -6.341 -16.402 1.00 67.16 H ATOM 454 HG3 LYS A 222 -3.450 -7.550 -15.655 1.00 67.16 H ATOM 455 HD2 LYS A 222 -5.357 -7.270 -16.877 1.00 77.59 H ATOM 456 HD3 LYS A 222 -4.845 -5.883 -17.460 1.00 77.59 H ATOM 457 HE2 LYS A 222 -3.223 -7.023 -18.711 1.00 80.56 H ATOM 458 HE3 LYS A 222 -3.781 -8.406 -18.153 1.00 80.56 H ATOM 459 HZ1 LYS A 222 -4.651 -7.970 -20.214 1.00 86.60 H ATOM 460 HZ2 LYS A 222 -5.734 -7.978 -19.252 1.00 86.60 H ATOM 461 HZ3 LYS A 222 -5.226 -6.720 -19.759 1.00 86.60 H ATOM 462 N LYS A 223 -1.199 -4.056 -13.296 1.00 37.23 N ATOM 463 CA LYS A 223 0.035 -3.340 -13.567 1.00 37.29 C ATOM 464 C LYS A 223 1.174 -3.944 -12.755 1.00 37.79 C ATOM 465 O LYS A 223 0.944 -4.473 -11.660 1.00 33.63 O ATOM 466 CB LYS A 223 -0.105 -1.857 -13.216 1.00 39.19 C ATOM 467 CG LYS A 223 -1.139 -1.125 -14.065 1.00 44.92 C ATOM 468 CD LYS A 223 -1.436 0.277 -13.520 1.00 45.57 C ATOM 469 CE LYS A 223 -2.301 1.075 -14.490 1.00 58.18 C ATOM 470 NZ LYS A 223 -3.543 1.605 -13.848 1.00 55.38 N ATOM 471 H LYS A 223 -1.441 -4.024 -12.471 1.00 44.67 H ATOM 472 HA LYS A 223 0.253 -3.415 -14.509 1.00 44.75 H ATOM 473 HB2 LYS A 223 -0.374 -1.778 -12.287 1.00 47.03 H ATOM 474 HB3 LYS A 223 0.751 -1.421 -13.350 1.00 47.03 H ATOM 475 HG2 LYS A 223 -0.801 -1.033 -14.970 1.00 53.90 H ATOM 476 HG3 LYS A 223 -1.966 -1.631 -14.067 1.00 53.90 H ATOM 477 HD2 LYS A 223 -1.913 0.200 -12.679 1.00 54.68 H ATOM 478 HD3 LYS A 223 -0.602 0.755 -13.392 1.00 54.68 H ATOM 479 HE2 LYS A 223 -1.790 1.829 -14.824 1.00 69.81 H ATOM 480 HE3 LYS A 223 -2.564 0.500 -15.226 1.00 69.81 H ATOM 481 HZ1 LYS A 223 -4.021 2.063 -14.443 1.00 66.45 H ATOM 482 HZ2 LYS A 223 -4.036 0.932 -13.539 1.00 66.45 H ATOM 483 HZ3 LYS A 223 -3.330 2.143 -13.172 1.00 66.45 H ATOM 484 N PRO A 224 2.408 -3.880 -13.258 1.00 33.02 N ATOM 485 CA PRO A 224 3.549 -4.349 -12.465 1.00 30.41 C ATOM 486 C PRO A 224 3.721 -3.497 -11.218 1.00 29.82 C ATOM 487 O PRO A 224 3.457 -2.297 -11.218 1.00 30.09 O ATOM 488 CB PRO A 224 4.743 -4.194 -13.418 1.00 33.52 C ATOM 489 CG PRO A 224 4.172 -3.968 -14.755 1.00 37.03 C ATOM 490 CD PRO A 224 2.838 -3.332 -14.553 1.00 38.62 C ATOM 491 HA PRO A 224 3.441 -5.281 -12.219 1.00 36.49 H ATOM 492 HB2 PRO A 224 5.279 -3.434 -13.145 1.00 40.23 H ATOM 493 HB3 PRO A 224 5.273 -5.006 -13.408 1.00 40.23 H ATOM 494 HG2 PRO A 224 4.755 -3.379 -15.259 1.00 44.44 H ATOM 495 HG3 PRO A 224 4.075 -4.819 -15.212 1.00 44.44 H ATOM 496 HD2 PRO A 224 2.926 -2.367 -14.501 1.00 46.34 H ATOM 497 HD3 PRO A 224 2.225 -3.598 -15.256 1.00 46.34 H ATOM 498 N GLU A 225 4.147 -4.148 -10.139 1.00 26.14 N ATOM 499 CA GLU A 225 4.388 -3.476 -8.871 1.00 24.19 C ATOM 500 C GLU A 225 5.268 -4.385 -8.036 1.00 25.70 C ATOM 501 O GLU A 225 4.946 -5.564 -7.866 1.00 26.23 O ATOM 502 CB GLU A 225 3.083 -3.169 -8.134 1.00 26.92 C ATOM 503 CG GLU A 225 3.299 -2.386 -6.858 1.00 28.41 C ATOM 504 CD GLU A 225 2.032 -2.104 -6.095 1.00 29.25 C ATOM 505 OE1 GLU A 225 0.982 -2.667 -6.471 1.00 29.50 O ATOM 506 OE2 GLU A 225 2.089 -1.297 -5.130 1.00 29.49 O ATOM 507 H GLU A 225 4.305 -4.993 -10.118 1.00 31.37 H ATOM 508 HA GLU A 225 4.861 -2.643 -9.027 1.00 29.02 H ATOM 509 HB2 GLU A 225 2.509 -2.644 -8.713 1.00 32.31 H ATOM 510 HB3 GLU A 225 2.647 -4.004 -7.903 1.00 32.31 H ATOM 511 HG2 GLU A 225 3.889 -2.892 -6.277 1.00 34.09 H ATOM 512 HG3 GLU A 225 3.707 -1.534 -7.079 1.00 34.09 H ATOM 513 N GLU A 226 6.391 -3.849 -7.547 1.00 25.86 N ATOM 514 CA GLU A 226 7.309 -4.659 -6.770 1.00 24.62 C ATOM 515 C GLU A 226 6.681 -5.024 -5.431 1.00 25.03 C ATOM 516 O GLU A 226 5.954 -4.231 -4.826 1.00 25.75 O ATOM 517 CB GLU A 226 8.636 -3.931 -6.531 1.00 34.73 C ATOM 518 CG GLU A 226 9.578 -3.878 -7.775 1.00 34.93 C ATOM 519 CD GLU A 226 9.884 -5.245 -8.392 1.00 41.57 C ATOM 520 OE1 GLU A 226 10.526 -6.105 -7.738 1.00 36.46 O ATOM 521 OE2 GLU A 226 9.465 -5.460 -9.557 1.00 46.53 O ATOM 522 H GLU A 226 6.634 -3.031 -7.653 1.00 31.04 H ATOM 523 HA GLU A 226 7.496 -5.480 -7.252 1.00 29.54 H ATOM 524 HB2 GLU A 226 8.446 -3.018 -6.266 1.00 41.67 H ATOM 525 HB3 GLU A 226 9.115 -4.385 -5.819 1.00 41.67 H ATOM 526 HG2 GLU A 226 9.158 -3.333 -8.459 1.00 41.91 H ATOM 527 HG3 GLU A 226 10.421 -3.479 -7.510 1.00 41.91 H ATOM 528 N LEU A 227 7.022 -6.216 -4.963 1.00 24.29 N ATOM 529 CA LEU A 227 6.543 -6.744 -3.690 1.00 22.81 C ATOM 530 C LEU A 227 7.390 -6.237 -2.530 1.00 28.76 C ATOM 531 O LEU A 227 8.575 -5.926 -2.680 1.00 24.60 O ATOM 532 CB LEU A 227 6.600 -8.261 -3.695 1.00 19.92 C ATOM 533 CG LEU A 227 5.740 -9.009 -4.724 1.00 21.51 C ATOM 534 CD1 LEU A 227 6.070 -10.446 -4.694 1.00 23.88 C ATOM 535 CD2 LEU A 227 4.272 -8.811 -4.422 1.00 24.29 C ATOM 536 H LEU A 227 7.546 -6.757 -5.378 1.00 29.15 H ATOM 537 HA LEU A 227 5.624 -6.468 -3.548 1.00 27.37 H ATOM 538 HB2 LEU A 227 7.520 -8.524 -3.851 1.00 23.91 H ATOM 539 HB3 LEU A 227 6.326 -8.572 -2.818 1.00 23.91 H ATOM 540 HG LEU A 227 5.923 -8.667 -5.613 1.00 25.81 H ATOM 541 HD11 LEU A 227 5.522 -10.909 -5.347 1.00 28.65 H ATOM 542 HD12 LEU A 227 7.009 -10.559 -4.910 1.00 28.65 H ATOM 543 HD13 LEU A 227 5.891 -10.792 -3.806 1.00 28.65 H ATOM 544 HD21 LEU A 227 3.747 -9.291 -5.082 1.00 29.15 H ATOM 545 HD22 LEU A 227 4.083 -9.156 -3.535 1.00 29.15 H ATOM 546 HD23 LEU A 227 4.067 -7.864 -4.460 1.00 29.15 H ATOM 547 N ILE A 228 6.790 -6.193 -1.354 1.00 22.12 N ATOM 548 CA ILE A 228 7.577 -6.091 -0.131 1.00 22.52 C ATOM 549 C ILE A 228 7.377 -7.382 0.653 1.00 23.18 C ATOM 550 O ILE A 228 6.329 -8.034 0.562 1.00 20.45 O ATOM 551 CB ILE A 228 7.262 -4.839 0.705 1.00 26.71 C ATOM 552 CG1 ILE A 228 5.971 -4.942 1.465 1.00 29.41 C ATOM 553 CG2 ILE A 228 7.248 -3.600 -0.188 1.00 33.17 C ATOM 554 CD1 ILE A 228 5.783 -3.715 2.414 1.00 31.69 C ATOM 555 H ILE A 228 5.939 -6.219 -1.232 1.00 26.54 H ATOM 556 HA ILE A 228 8.514 -6.044 -0.376 1.00 27.03 H ATOM 557 HB ILE A 228 7.977 -4.729 1.351 1.00 32.05 H ATOM 558 HG12 ILE A 228 5.230 -4.962 0.839 1.00 35.29 H ATOM 559 HG13 ILE A 228 5.979 -5.748 2.004 1.00 35.29 H ATOM 560 HG21 ILE A 228 7.048 -2.822 0.356 1.00 39.80 H ATOM 561 HG22 ILE A 228 8.120 -3.500 -0.602 1.00 39.80 H ATOM 562 HG23 ILE A 228 6.568 -3.711 -0.871 1.00 39.80 H ATOM 563 HD11 ILE A 228 4.943 -3.811 2.890 1.00 38.03 H ATOM 564 HD12 ILE A 228 6.520 -3.689 3.044 1.00 38.03 H ATOM 565 HD13 ILE A 228 5.773 -2.904 1.882 1.00 38.03 H ATOM 566 N SER A 229 8.427 -7.805 1.361 1.00 20.86 N ATOM 567 CA SER A 229 8.429 -9.127 1.963 1.00 17.34 C ATOM 568 C SER A 229 8.774 -9.031 3.437 1.00 20.46 C ATOM 569 O SER A 229 9.662 -8.265 3.830 1.00 19.71 O ATOM 570 CB SER A 229 9.428 -10.056 1.276 1.00 25.41 C ATOM 571 OG SER A 229 9.129 -10.183 -0.101 1.00 24.70 O ATOM 572 H SER A 229 9.141 -7.346 1.504 1.00 25.03 H ATOM 573 HA SER A 229 7.545 -9.517 1.882 1.00 20.81 H ATOM 574 HB2 SER A 229 10.320 -9.689 1.373 1.00 30.49 H ATOM 575 HB3 SER A 229 9.382 -10.932 1.691 1.00 30.49 H ATOM 576 HG SER A 229 8.357 -10.499 -0.199 1.00 29.64 H ATOM 577 N CYS A 230 8.058 -9.811 4.244 1.00 16.60 N ATOM 578 CA CYS A 230 8.314 -9.855 5.673 1.00 15.53 C ATOM 579 C CYS A 230 9.676 -10.462 5.953 1.00 19.99 C ATOM 580 O CYS A 230 9.999 -11.538 5.448 1.00 17.71 O ATOM 581 CB CYS A 230 7.241 -10.681 6.370 1.00 17.16 C ATOM 582 SG CYS A 230 7.505 -10.827 8.140 1.00 17.12 S ATOM 583 H CYS A 230 7.419 -10.324 3.984 1.00 19.92 H ATOM 584 HA CYS A 230 8.296 -8.955 6.034 1.00 18.64 H ATOM 585 HB2 CYS A 230 6.378 -10.260 6.230 1.00 20.59 H ATOM 586 HB3 CYS A 230 7.237 -11.575 5.993 1.00 20.59 H ATOM 587 N ALA A 231 10.468 -9.788 6.792 1.00 15.82 N ATOM 588 CA ALA A 231 11.790 -10.296 7.131 1.00 19.37 C ATOM 589 C ALA A 231 11.733 -11.575 7.942 1.00 18.34 C ATOM 590 O ALA A 231 12.728 -12.318 7.983 1.00 20.12 O ATOM 591 CB ALA A 231 12.555 -9.230 7.908 1.00 19.77 C ATOM 592 H ALA A 231 10.263 -9.044 7.171 1.00 18.98 H ATOM 593 HA ALA A 231 12.277 -10.480 6.313 1.00 23.25 H ATOM 594 HB1 ALA A 231 13.434 -9.573 8.132 1.00 23.72 H ATOM 595 HB2 ALA A 231 12.639 -8.437 7.357 1.00 23.72 H ATOM 596 HB3 ALA A 231 12.065 -9.019 8.719 1.00 23.72 H ATOM 597 N ASP A 232 10.633 -11.835 8.649 1.00 18.13 N ATOM 598 CA ASP A 232 10.585 -13.026 9.492 1.00 18.33 C ATOM 599 C ASP A 232 9.920 -14.223 8.843 1.00 21.03 C ATOM 600 O ASP A 232 10.426 -15.344 8.993 1.00 24.30 O ATOM 601 CB ASP A 232 9.890 -12.686 10.807 1.00 21.01 C ATOM 602 CG ASP A 232 10.733 -11.790 11.670 1.00 24.19 C ATOM 603 OD1 ASP A 232 11.830 -12.226 12.069 1.00 27.88 O ATOM 604 OD2 ASP A 232 10.287 -10.687 11.943 1.00 32.94 O ATOM 605 H ASP A 232 9.922 -11.352 8.658 1.00 21.76 H ATOM 606 HA ASP A 232 11.495 -13.284 9.705 1.00 21.99 H ATOM 607 HB2 ASP A 232 9.056 -12.228 10.619 1.00 25.21 H ATOM 608 HB3 ASP A 232 9.719 -13.505 11.298 1.00 25.21 H ATOM 609 N CYS A 233 8.814 -14.051 8.120 1.00 20.58 N ATOM 610 CA CYS A 233 8.134 -15.210 7.556 1.00 20.45 C ATOM 611 C CYS A 233 8.353 -15.342 6.052 1.00 20.06 C ATOM 612 O CYS A 233 8.132 -16.435 5.493 1.00 21.49 O ATOM 613 CB CYS A 233 6.631 -15.162 7.874 1.00 22.26 C ATOM 614 SG CYS A 233 5.683 -13.889 7.039 1.00 19.92 S ATOM 615 H CYS A 233 8.446 -13.293 7.946 1.00 24.69 H ATOM 616 HA CYS A 233 8.494 -16.008 7.973 1.00 24.54 H ATOM 617 HB2 CYS A 233 6.242 -16.017 7.632 1.00 26.72 H ATOM 618 HB3 CYS A 233 6.527 -15.020 8.828 1.00 26.72 H ATOM 619 N GLY A 234 8.759 -14.265 5.392 1.00 18.09 N ATOM 620 CA GLY A 234 9.059 -14.271 3.981 1.00 19.47 C ATOM 621 C GLY A 234 7.859 -14.063 3.102 1.00 19.48 C ATOM 622 O GLY A 234 8.008 -13.869 1.882 1.00 20.38 O ATOM 623 H GLY A 234 8.869 -13.495 5.759 1.00 21.70 H ATOM 624 HA2 GLY A 234 9.700 -13.568 3.789 1.00 23.36 H ATOM 625 HA3 GLY A 234 9.463 -15.121 3.745 1.00 23.36 H ATOM 626 N ASN A 235 6.670 -14.063 3.669 1.00 19.27 N ATOM 627 CA ASN A 235 5.510 -13.823 2.815 1.00 19.65 C ATOM 628 C ASN A 235 5.480 -12.354 2.367 1.00 20.08 C ATOM 629 O ASN A 235 6.060 -11.473 2.998 1.00 18.61 O ATOM 630 CB ASN A 235 4.240 -14.230 3.548 1.00 21.32 C ATOM 631 CG ASN A 235 4.176 -15.739 3.815 1.00 27.57 C ATOM 632 OD1 ASN A 235 4.526 -16.549 2.966 1.00 38.44 O ATOM 633 ND2 ASN A 235 3.751 -16.102 4.999 1.00 36.23 N ATOM 634 H ASN A 235 6.504 -14.192 4.503 1.00 23.12 H ATOM 635 HA ASN A 235 5.585 -14.375 2.021 1.00 23.57 H ATOM 636 HB2 ASN A 235 4.206 -13.772 4.402 1.00 25.58 H ATOM 637 HB3 ASN A 235 3.471 -13.987 3.009 1.00 25.58 H ATOM 638 HD21 ASN A 235 3.696 -16.937 5.198 1.00 43.47 H ATOM 639 HD22 ASN A 235 3.526 -15.506 5.576 1.00 43.47 H ATOM 640 N SER A 236 4.783 -12.098 1.260 1.00 18.42 N ATOM 641 CA SER A 236 4.911 -10.848 0.525 1.00 17.36 C ATOM 642 C SER A 236 3.571 -10.226 0.195 1.00 20.21 C ATOM 643 O SER A 236 2.521 -10.870 0.223 1.00 18.23 O ATOM 644 CB SER A 236 5.702 -11.061 -0.758 1.00 19.34 C ATOM 645 OG SER A 236 6.921 -11.714 -0.448 1.00 22.76 O ATOM 646 H SER A 236 4.219 -12.646 0.911 1.00 22.11 H ATOM 647 HA SER A 236 5.402 -10.216 1.073 1.00 20.84 H ATOM 648 HB2 SER A 236 5.187 -11.615 -1.365 1.00 23.21 H ATOM 649 HB3 SER A 236 5.893 -10.201 -1.165 1.00 23.21 H ATOM 650 HG SER A 236 7.367 -11.838 -1.149 1.00 27.32 H ATOM 651 N GLY A 237 3.628 -8.937 -0.093 1.00 17.82 N ATOM 652 CA GLY A 237 2.458 -8.203 -0.526 1.00 19.55 C ATOM 653 C GLY A 237 2.840 -7.058 -1.438 1.00 21.15 C ATOM 654 O GLY A 237 3.915 -6.464 -1.306 1.00 22.30 O ATOM 655 H GLY A 237 4.342 -8.460 -0.044 1.00 21.39 H ATOM 656 HA2 GLY A 237 1.858 -8.796 -1.005 1.00 23.46 H ATOM 657 HA3 GLY A 237 1.991 -7.845 0.246 1.00 23.46 H ATOM 658 N HIS A 238 1.973 -6.773 -2.391 1.00 17.28 N ATOM 659 CA HIS A 238 2.058 -5.502 -3.097 1.00 20.03 C ATOM 660 C HIS A 238 1.752 -4.359 -2.129 1.00 20.60 C ATOM 661 O HIS A 238 0.815 -4.448 -1.322 1.00 20.89 O ATOM 662 CB HIS A 238 1.066 -5.411 -4.253 1.00 22.05 C ATOM 663 CG HIS A 238 1.243 -6.444 -5.311 1.00 20.96 C ATOM 664 ND1 HIS A 238 0.365 -7.497 -5.476 1.00 18.78 N ATOM 665 CD2 HIS A 238 2.163 -6.563 -6.296 1.00 20.76 C ATOM 666 CE1 HIS A 238 0.761 -8.240 -6.494 1.00 24.50 C ATOM 667 NE2 HIS A 238 1.842 -7.684 -7.017 1.00 21.69 N ATOM 668 H HIS A 238 1.333 -7.287 -2.649 1.00 20.73 H ATOM 669 HA HIS A 238 2.955 -5.382 -3.446 1.00 24.04 H ATOM 670 HB2 HIS A 238 0.168 -5.505 -3.898 1.00 26.46 H ATOM 671 HB3 HIS A 238 1.160 -4.542 -4.673 1.00 26.46 H ATOM 672 HD2 HIS A 238 2.882 -5.994 -6.451 1.00 24.91 H ATOM 673 HE1 HIS A 238 0.339 -9.009 -6.804 1.00 29.39 H ATOM 674 HE2 HIS A 238 2.282 -7.987 -7.691 1.00 26.03 H ATOM 675 N PRO A 239 2.524 -3.275 -2.165 1.00 18.91 N ATOM 676 CA PRO A 239 2.174 -2.116 -1.344 1.00 19.70 C ATOM 677 C PRO A 239 0.734 -1.675 -1.519 1.00 21.51 C ATOM 678 O PRO A 239 0.085 -1.295 -0.541 1.00 22.40 O ATOM 679 CB PRO A 239 3.174 -1.048 -1.829 1.00 21.72 C ATOM 680 CG PRO A 239 4.349 -1.798 -2.246 1.00 25.20 C ATOM 681 CD PRO A 239 3.858 -3.146 -2.777 1.00 24.09 C ATOM 682 HA PRO A 239 2.339 -2.307 -0.408 1.00 23.64 H ATOM 683 HB2 PRO A 239 2.795 -0.559 -2.576 1.00 26.07 H ATOM 684 HB3 PRO A 239 3.392 -0.448 -1.099 1.00 26.07 H ATOM 685 HG2 PRO A 239 4.810 -1.309 -2.945 1.00 30.24 H ATOM 686 HG3 PRO A 239 4.934 -1.929 -1.484 1.00 30.24 H ATOM 687 HD2 PRO A 239 3.788 -3.125 -3.744 1.00 28.91 H ATOM 688 HD3 PRO A 239 4.440 -3.862 -2.475 1.00 28.91 H ATOM 689 N SER A 240 0.198 -1.740 -2.741 1.00 21.16 N ATOM 690 CA SER A 240 -1.195 -1.370 -2.945 1.00 23.18 C ATOM 691 C SER A 240 -2.150 -2.355 -2.274 1.00 21.77 C ATOM 692 O SER A 240 -3.208 -1.936 -1.800 1.00 24.70 O ATOM 693 CB SER A 240 -1.517 -1.261 -4.438 1.00 24.99 C ATOM 694 OG SER A 240 -1.276 -2.480 -5.114 1.00 23.06 O ATOM 695 H SER A 240 0.613 -1.990 -3.451 1.00 25.39 H ATOM 696 HA SER A 240 -1.345 -0.498 -2.547 1.00 27.81 H ATOM 697 HB2 SER A 240 -2.452 -1.026 -4.540 1.00 29.98 H ATOM 698 HB3 SER A 240 -0.959 -0.571 -4.829 1.00 29.98 H ATOM 699 HG SER A 240 -0.468 -2.697 -5.037 1.00 27.68 H ATOM 700 N CYS A 241 -1.804 -3.650 -2.220 1.00 20.87 N ATOM 701 CA CYS A 241 -2.631 -4.598 -1.470 1.00 20.32 C ATOM 702 C CYS A 241 -2.490 -4.402 0.035 1.00 22.99 C ATOM 703 O CYS A 241 -3.425 -4.687 0.799 1.00 20.28 O ATOM 704 CB CYS A 241 -2.264 -6.034 -1.863 1.00 20.48 C ATOM 705 SG CYS A 241 -2.767 -6.463 -3.557 1.00 22.31 S ATOM 706 H CYS A 241 -1.113 -3.995 -2.599 1.00 25.04 H ATOM 707 HA CYS A 241 -3.562 -4.455 -1.702 1.00 24.39 H ATOM 708 HB2 CYS A 241 -1.302 -6.141 -1.801 1.00 24.57 H ATOM 709 HB3 CYS A 241 -2.704 -6.649 -1.256 1.00 24.57 H ATOM 710 N LEU A 242 -1.324 -3.934 0.486 1.00 18.19 N ATOM 711 CA LEU A 242 -1.094 -3.606 1.886 1.00 20.14 C ATOM 712 C LEU A 242 -1.666 -2.241 2.267 1.00 20.69 C ATOM 713 O LEU A 242 -1.717 -1.913 3.456 1.00 20.76 O ATOM 714 CB LEU A 242 0.420 -3.641 2.161 1.00 20.78 C ATOM 715 CG LEU A 242 1.083 -5.012 2.143 1.00 21.24 C ATOM 716 CD1 LEU A 242 2.601 -4.884 1.968 1.00 22.97 C ATOM 717 CD2 LEU A 242 0.785 -5.719 3.428 1.00 22.66 C ATOM 718 H LEU A 242 -0.639 -3.795 -0.015 1.00 21.83 H ATOM 719 HA LEU A 242 -1.518 -4.277 2.444 1.00 24.17 H ATOM 720 HB2 LEU A 242 0.863 -3.100 1.489 1.00 24.94 H ATOM 721 HB3 LEU A 242 0.579 -3.257 3.037 1.00 24.94 H ATOM 722 HG LEU A 242 0.729 -5.537 1.409 1.00 25.49 H ATOM 723 HD11 LEU A 242 2.993 -5.771 1.961 1.00 27.56 H ATOM 724 HD12 LEU A 242 2.785 -4.433 1.129 1.00 27.56 H ATOM 725 HD13 LEU A 242 2.961 -4.369 2.707 1.00 27.56 H ATOM 726 HD21 LEU A 242 1.209 -6.592 3.414 1.00 27.19 H ATOM 727 HD22 LEU A 242 1.134 -5.194 4.165 1.00 27.19 H ATOM 728 HD23 LEU A 242 -0.175 -5.819 3.518 1.00 27.19 H ATOM 729 N LYS A 243 -2.174 -1.499 1.294 1.00 22.79 N ATOM 730 CA LYS A 243 -2.762 -0.182 1.514 1.00 22.46 C ATOM 731 C LYS A 243 -1.736 0.789 2.086 1.00 24.75 C ATOM 732 O LYS A 243 -2.072 1.656 2.903 1.00 28.26 O ATOM 733 CB LYS A 243 -3.991 -0.253 2.429 1.00 24.54 C ATOM 734 CG LYS A 243 -4.964 -1.364 2.088 1.00 29.59 C ATOM 735 CD LYS A 243 -5.463 -1.223 0.702 1.00 32.39 C ATOM 736 CE LYS A 243 -6.472 -2.323 0.351 1.00 35.82 C ATOM 737 NZ LYS A 243 -7.627 -2.381 1.270 1.00 28.15 N ATOM 738 H LYS A 243 -2.192 -1.745 0.470 1.00 27.35 H ATOM 739 HA LYS A 243 -3.054 0.171 0.659 1.00 26.95 H ATOM 740 HB2 LYS A 243 -3.691 -0.394 3.341 1.00 29.45 H ATOM 741 HB3 LYS A 243 -4.471 0.588 2.369 1.00 29.45 H ATOM 742 HG2 LYS A 243 -4.515 -2.220 2.167 1.00 35.51 H ATOM 743 HG3 LYS A 243 -5.723 -1.324 2.692 1.00 35.51 H ATOM 744 HD2 LYS A 243 -5.903 -0.364 0.606 1.00 38.86 H ATOM 745 HD3 LYS A 243 -4.716 -1.288 0.086 1.00 38.86 H ATOM 746 HE2 LYS A 243 -6.812 -2.162 -0.543 1.00 42.98 H ATOM 747 HE3 LYS A 243 -6.023 -3.182 0.383 1.00 42.98 H ATOM 748 HZ1 LYS A 243 -8.180 -3.033 1.023 1.00 33.79 H ATOM 749 HZ2 LYS A 243 -7.347 -2.538 2.100 1.00 33.79 H ATOM 750 HZ3 LYS A 243 -8.067 -1.607 1.255 1.00 33.79 H ATOM 751 N PHE A 244 -0.484 0.662 1.636 1.00 22.60 N ATOM 752 CA PHE A 244 0.590 1.574 2.054 1.00 23.67 C ATOM 753 C PHE A 244 0.708 2.758 1.105 1.00 24.31 C ATOM 754 O PHE A 244 0.672 2.590 -0.115 1.00 25.55 O ATOM 755 CB PHE A 244 1.944 0.873 2.077 1.00 23.57 C ATOM 756 CG PHE A 244 2.135 -0.085 3.212 1.00 20.79 C ATOM 757 CD1 PHE A 244 1.173 -0.281 4.177 1.00 21.84 C ATOM 758 CD2 PHE A 244 3.308 -0.782 3.301 1.00 22.32 C ATOM 759 CE1 PHE A 244 1.387 -1.154 5.211 1.00 21.95 C ATOM 760 CE2 PHE A 244 3.523 -1.689 4.314 1.00 21.05 C ATOM 761 CZ PHE A 244 2.577 -1.868 5.277 1.00 20.30 C ATOM 762 H PHE A 244 -0.229 0.053 1.085 1.00 27.12 H ATOM 763 HA PHE A 244 0.402 1.909 2.945 1.00 28.41 H ATOM 764 HB2 PHE A 244 2.048 0.373 1.252 1.00 28.28 H ATOM 765 HB3 PHE A 244 2.640 1.545 2.140 1.00 28.28 H ATOM 766 HD1 PHE A 244 0.376 0.197 4.136 1.00 26.21 H ATOM 767 HD2 PHE A 244 3.959 -0.665 2.647 1.00 26.79 H ATOM 768 HE1 PHE A 244 0.730 -1.283 5.856 1.00 26.34 H ATOM 769 HE2 PHE A 244 4.328 -2.152 4.361 1.00 25.26 H ATOM 770 HZ PHE A 244 2.724 -2.469 5.971 1.00 24.36 H ATOM 771 N SER A 245 0.922 3.939 1.672 1.00 28.46 N ATOM 772 CA SER A 245 1.160 5.116 0.849 1.00 28.25 C ATOM 773 C SER A 245 2.514 5.011 0.161 1.00 29.55 C ATOM 774 O SER A 245 3.397 4.271 0.607 1.00 26.66 O ATOM 775 CB SER A 245 1.108 6.373 1.711 1.00 31.14 C ATOM 776 OG SER A 245 2.237 6.438 2.553 1.00 30.30 O ATOM 777 H SER A 245 0.934 4.085 2.520 1.00 34.15 H ATOM 778 HA SER A 245 0.472 5.180 0.168 1.00 33.90 H ATOM 779 HB2 SER A 245 1.097 7.153 1.134 1.00 37.37 H ATOM 780 HB3 SER A 245 0.306 6.350 2.257 1.00 37.37 H ATOM 781 HG SER A 245 2.259 5.766 3.057 1.00 36.36 H ATOM 782 N PRO A 246 2.723 5.764 -0.928 1.00 36.15 N ATOM 783 CA PRO A 246 4.048 5.726 -1.560 1.00 33.34 C ATOM 784 C PRO A 246 5.172 6.072 -0.594 1.00 31.41 C ATOM 785 O PRO A 246 6.247 5.460 -0.651 1.00 29.62 O ATOM 786 CB PRO A 246 3.927 6.759 -2.692 1.00 33.91 C ATOM 787 CG PRO A 246 2.491 6.771 -3.024 1.00 36.36 C ATOM 788 CD PRO A 246 1.768 6.563 -1.713 1.00 34.79 C ATOM 789 HA PRO A 246 4.213 4.850 -1.943 1.00 40.01 H ATOM 790 HB2 PRO A 246 4.215 7.630 -2.375 1.00 40.69 H ATOM 791 HB3 PRO A 246 4.455 6.476 -3.454 1.00 40.69 H ATOM 792 HG2 PRO A 246 2.253 7.627 -3.412 1.00 43.63 H ATOM 793 HG3 PRO A 246 2.293 6.049 -3.641 1.00 43.63 H ATOM 794 HD2 PRO A 246 1.601 7.414 -1.279 1.00 41.74 H ATOM 795 HD3 PRO A 246 0.946 6.066 -1.854 1.00 41.74 H ATOM 796 N GLU A 247 4.938 7.036 0.299 1.00 29.93 N ATOM 797 CA GLU A 247 5.973 7.466 1.242 1.00 32.78 C ATOM 798 C GLU A 247 6.289 6.370 2.258 1.00 28.32 C ATOM 799 O GLU A 247 7.462 6.090 2.543 1.00 26.34 O ATOM 800 CB GLU A 247 5.529 8.740 1.964 1.00 36.26 C ATOM 801 CG GLU A 247 5.397 9.977 1.064 1.00 42.01 C ATOM 802 CD GLU A 247 4.180 9.949 0.135 1.00 46.75 C ATOM 803 OE1 GLU A 247 3.249 9.126 0.345 1.00 40.53 O ATOM 804 OE2 GLU A 247 4.153 10.758 -0.825 1.00 50.54 O ATOM 805 H GLU A 247 4.191 7.456 0.380 1.00 35.91 H ATOM 806 HA GLU A 247 6.786 7.665 0.752 1.00 39.34 H ATOM 807 HB2 GLU A 247 4.663 8.579 2.370 1.00 43.51 H ATOM 808 HB3 GLU A 247 6.179 8.947 2.654 1.00 43.51 H ATOM 809 HG2 GLU A 247 5.321 10.764 1.626 1.00 50.41 H ATOM 810 HG3 GLU A 247 6.190 10.046 0.510 1.00 50.41 H ATOM 811 N LEU A 248 5.250 5.762 2.833 1.00 28.72 N ATOM 812 CA LEU A 248 5.461 4.641 3.752 1.00 24.15 C ATOM 813 C LEU A 248 6.185 3.497 3.060 1.00 23.72 C ATOM 814 O LEU A 248 7.063 2.859 3.659 1.00 24.19 O ATOM 815 CB LEU A 248 4.124 4.171 4.319 1.00 24.75 C ATOM 816 CG LEU A 248 4.225 2.968 5.276 1.00 25.96 C ATOM 817 CD1 LEU A 248 5.032 3.326 6.482 1.00 24.54 C ATOM 818 CD2 LEU A 248 2.837 2.519 5.722 1.00 25.04 C ATOM 819 H LEU A 248 4.426 5.974 2.711 1.00 34.47 H ATOM 820 HA LEU A 248 6.012 4.940 4.492 1.00 28.98 H ATOM 821 HB2 LEU A 248 3.720 4.904 4.810 1.00 29.70 H ATOM 822 HB3 LEU A 248 3.547 3.914 3.583 1.00 29.70 H ATOM 823 HG LEU A 248 4.659 2.228 4.823 1.00 31.15 H ATOM 824 HD11 LEU A 248 5.083 2.555 7.069 1.00 29.45 H ATOM 825 HD12 LEU A 248 5.923 3.586 6.200 1.00 29.45 H ATOM 826 HD13 LEU A 248 4.602 4.064 6.942 1.00 29.45 H ATOM 827 HD21 LEU A 248 2.928 1.762 6.322 1.00 30.05 H ATOM 828 HD22 LEU A 248 2.400 3.254 6.180 1.00 30.05 H ATOM 829 HD23 LEU A 248 2.323 2.263 4.941 1.00 30.05 H ATOM 830 N THR A 249 5.812 3.208 1.804 1.00 23.57 N ATOM 831 CA THR A 249 6.442 2.139 1.047 1.00 22.40 C ATOM 832 C THR A 249 7.939 2.372 0.920 1.00 25.38 C ATOM 833 O THR A 249 8.738 1.454 1.121 1.00 26.35 O ATOM 834 CB THR A 249 5.789 2.008 -0.338 1.00 24.10 C ATOM 835 OG1 THR A 249 4.403 1.638 -0.193 1.00 25.07 O ATOM 836 CG2 THR A 249 6.506 0.940 -1.180 1.00 27.07 C ATOM 837 H THR A 249 5.193 3.623 1.375 1.00 28.28 H ATOM 838 HA THR A 249 6.311 1.301 1.518 1.00 26.88 H ATOM 839 HB THR A 249 5.848 2.857 -0.805 1.00 28.92 H ATOM 840 HG1 THR A 249 3.994 2.224 0.248 1.00 30.08 H ATOM 841 HG21 THR A 249 6.085 0.867 -2.051 1.00 32.49 H ATOM 842 HG22 THR A 249 7.437 1.183 -1.300 1.00 32.49 H ATOM 843 HG23 THR A 249 6.459 0.080 -0.734 1.00 32.49 H ATOM 844 N VAL A 250 8.344 3.600 0.591 1.00 24.66 N ATOM 845 CA VAL A 250 9.768 3.877 0.492 1.00 27.19 C ATOM 846 C VAL A 250 10.464 3.569 1.809 1.00 21.46 C ATOM 847 O VAL A 250 11.528 2.941 1.834 1.00 28.62 O ATOM 848 CB VAL A 250 9.988 5.342 0.062 1.00 29.75 C ATOM 849 CG1 VAL A 250 11.471 5.702 0.138 1.00 33.77 C ATOM 850 CG2 VAL A 250 9.472 5.527 -1.357 1.00 34.87 C ATOM 851 H VAL A 250 7.829 4.269 0.426 1.00 29.60 H ATOM 852 HA VAL A 250 10.153 3.305 -0.190 1.00 32.63 H ATOM 853 HB VAL A 250 9.494 5.933 0.652 1.00 35.70 H ATOM 854 HG11 VAL A 250 11.586 6.625 -0.136 1.00 40.52 H ATOM 855 HG12 VAL A 250 11.777 5.586 1.051 1.00 40.52 H ATOM 856 HG13 VAL A 250 11.969 5.116 -0.454 1.00 40.52 H ATOM 857 HG21 VAL A 250 9.611 6.448 -1.625 1.00 41.84 H ATOM 858 HG22 VAL A 250 9.958 4.932 -1.949 1.00 41.84 H ATOM 859 HG23 VAL A 250 8.526 5.315 -1.378 1.00 41.84 H ATOM 860 N ARG A 251 9.879 4.014 2.923 1.00 24.33 N ATOM 861 CA ARG A 251 10.530 3.838 4.208 1.00 23.44 C ATOM 862 C ARG A 251 10.628 2.372 4.587 1.00 26.20 C ATOM 863 O ARG A 251 11.676 1.937 5.073 1.00 23.84 O ATOM 864 CB ARG A 251 9.805 4.619 5.292 1.00 28.35 C ATOM 865 CG ARG A 251 9.832 6.114 5.074 1.00 37.51 C ATOM 866 CD ARG A 251 9.956 6.850 6.399 1.00 42.04 C ATOM 867 NE ARG A 251 10.021 8.297 6.228 1.00 50.12 N ATOM 868 CZ ARG A 251 11.149 8.995 6.099 1.00 55.41 C ATOM 869 NH1 ARG A 251 12.329 8.380 6.123 1.00 52.21 N ATOM 870 NH2 ARG A 251 11.095 10.319 5.945 1.00 54.77 N ATOM 871 H ARG A 251 9.119 4.415 2.956 1.00 29.20 H ATOM 872 HA ARG A 251 11.433 4.187 4.148 1.00 28.13 H ATOM 873 HB2 ARG A 251 8.877 4.339 5.313 1.00 34.02 H ATOM 874 HB3 ARG A 251 10.226 4.435 6.146 1.00 34.02 H ATOM 875 HG2 ARG A 251 10.596 6.346 4.523 1.00 45.01 H ATOM 876 HG3 ARG A 251 9.008 6.393 4.645 1.00 45.01 H ATOM 877 HD2 ARG A 251 9.183 6.647 6.948 1.00 50.44 H ATOM 878 HD3 ARG A 251 10.767 6.563 6.847 1.00 50.44 H ATOM 879 HE ARG A 251 9.279 8.730 6.209 1.00 60.14 H ATOM 880 HH11 ARG A 251 12.368 7.527 6.222 1.00 62.65 H ATOM 881 HH12 ARG A 251 13.054 8.837 6.040 1.00 62.65 H ATOM 882 HH21 ARG A 251 10.335 10.719 5.930 1.00 65.72 H ATOM 883 HH22 ARG A 251 11.822 10.772 5.863 1.00 65.72 H ATOM 884 N VAL A 252 9.565 1.577 4.371 1.00 24.67 N ATOM 885 CA VAL A 252 9.637 0.204 4.867 1.00 22.54 C ATOM 886 C VAL A 252 10.593 -0.628 4.025 1.00 22.37 C ATOM 887 O VAL A 252 11.182 -1.588 4.523 1.00 22.45 O ATOM 888 CB VAL A 252 8.236 -0.454 4.959 1.00 23.96 C ATOM 889 CG1 VAL A 252 7.330 0.354 5.850 1.00 22.75 C ATOM 890 CG2 VAL A 252 7.601 -0.622 3.598 1.00 27.26 C ATOM 891 H VAL A 252 8.839 1.795 3.966 1.00 29.61 H ATOM 892 HA VAL A 252 9.999 0.229 5.767 1.00 27.04 H ATOM 893 HB VAL A 252 8.330 -1.336 5.352 1.00 28.76 H ATOM 894 HG11 VAL A 252 6.462 -0.076 5.891 1.00 27.29 H ATOM 895 HG12 VAL A 252 7.719 0.400 6.737 1.00 27.29 H ATOM 896 HG13 VAL A 252 7.239 1.247 5.482 1.00 27.29 H ATOM 897 HG21 VAL A 252 6.731 -1.035 3.704 1.00 32.71 H ATOM 898 HG22 VAL A 252 7.505 0.251 3.185 1.00 32.71 H ATOM 899 HG23 VAL A 252 8.171 -1.185 3.051 1.00 32.71 H ATOM 900 N LYS A 253 10.771 -0.283 2.747 1.00 23.79 N ATOM 901 CA LYS A 253 11.723 -1.001 1.920 1.00 27.01 C ATOM 902 C LYS A 253 13.157 -0.821 2.402 1.00 25.85 C ATOM 903 O LYS A 253 14.019 -1.608 2.023 1.00 28.76 O ATOM 904 CB LYS A 253 11.597 -0.548 0.461 1.00 28.16 C ATOM 905 CG LYS A 253 10.350 -1.079 -0.255 1.00 26.45 C ATOM 906 CD LYS A 253 10.271 -0.611 -1.692 1.00 35.28 C ATOM 907 CE LYS A 253 9.111 -1.288 -2.447 1.00 36.07 C ATOM 908 NZ LYS A 253 8.907 -0.716 -3.827 1.00 37.55 N ATOM 909 H LYS A 253 10.356 0.355 2.346 1.00 28.54 H ATOM 910 HA LYS A 253 11.515 -1.948 1.955 1.00 32.41 H ATOM 911 HB2 LYS A 253 11.561 0.421 0.438 1.00 33.79 H ATOM 912 HB3 LYS A 253 12.374 -0.858 -0.029 1.00 33.79 H ATOM 913 HG2 LYS A 253 10.372 -2.049 -0.254 1.00 31.74 H ATOM 914 HG3 LYS A 253 9.559 -0.763 0.209 1.00 31.74 H ATOM 915 HD2 LYS A 253 10.126 0.348 -1.709 1.00 42.34 H ATOM 916 HD3 LYS A 253 11.099 -0.832 -2.147 1.00 42.34 H ATOM 917 HE2 LYS A 253 9.302 -2.234 -2.539 1.00 43.28 H ATOM 918 HE3 LYS A 253 8.290 -1.161 -1.945 1.00 43.28 H ATOM 919 HZ1 LYS A 253 8.231 -1.131 -4.231 1.00 45.06 H ATOM 920 HZ2 LYS A 253 8.722 0.153 -3.772 1.00 45.06 H ATOM 921 HZ3 LYS A 253 9.645 -0.825 -4.313 1.00 45.06 H ATOM 922 N ALA A 254 13.421 0.175 3.237 1.00 28.09 N ATOM 923 CA ALA A 254 14.754 0.421 3.771 1.00 31.53 C ATOM 924 C ALA A 254 14.929 -0.107 5.184 1.00 33.49 C ATOM 925 O ALA A 254 16.003 0.063 5.774 1.00 28.38 O ATOM 926 CB ALA A 254 15.043 1.923 3.739 1.00 31.90 C ATOM 927 H ALA A 254 12.831 0.735 3.517 1.00 33.71 H ATOM 928 HA ALA A 254 15.406 -0.021 3.205 1.00 37.84 H ATOM 929 HB1 ALA A 254 15.931 2.081 4.095 1.00 38.28 H ATOM 930 HB2 ALA A 254 14.994 2.235 2.822 1.00 38.28 H ATOM 931 HB3 ALA A 254 14.382 2.383 4.281 1.00 38.28 H ATOM 932 N LEU A 255 13.901 -0.742 5.740 1.00 25.16 N ATOM 933 CA LEU A 255 13.911 -1.230 7.104 1.00 22.46 C ATOM 934 C LEU A 255 13.686 -2.731 7.091 1.00 19.80 C ATOM 935 O LEU A 255 13.232 -3.287 6.093 1.00 21.67 O ATOM 936 CB LEU A 255 12.821 -0.554 7.946 1.00 27.55 C ATOM 937 CG LEU A 255 12.944 0.968 8.055 1.00 25.72 C ATOM 938 CD1 LEU A 255 11.775 1.553 8.796 1.00 26.15 C ATOM 939 CD2 LEU A 255 14.234 1.320 8.758 1.00 33.07 C ATOM 940 H LEU A 255 13.164 -0.905 5.328 1.00 30.19 H ATOM 941 HA LEU A 255 14.773 -1.048 7.509 1.00 26.95 H ATOM 942 HB2 LEU A 255 11.957 -0.750 7.550 1.00 33.06 H ATOM 943 HB3 LEU A 255 12.856 -0.916 8.846 1.00 33.06 H ATOM 944 HG LEU A 255 12.966 1.354 7.166 1.00 30.87 H ATOM 945 HD11 LEU A 255 11.884 2.516 8.848 1.00 31.38 H ATOM 946 HD12 LEU A 255 10.959 1.337 8.319 1.00 31.38 H ATOM 947 HD13 LEU A 255 11.747 1.175 9.689 1.00 31.38 H ATOM 948 HD21 LEU A 255 14.305 2.285 8.823 1.00 39.68 H ATOM 949 HD22 LEU A 255 14.227 0.927 9.645 1.00 39.68 H ATOM 950 HD23 LEU A 255 14.978 0.966 8.246 1.00 39.68 H ATOM 951 N ARG A 256 13.998 -3.379 8.214 1.00 21.72 N ATOM 952 CA ARG A 256 13.693 -4.803 8.404 1.00 18.70 C ATOM 953 C ARG A 256 12.207 -4.913 8.725 1.00 20.99 C ATOM 954 O ARG A 256 11.799 -5.043 9.881 1.00 22.81 O ATOM 955 CB ARG A 256 14.530 -5.398 9.528 1.00 21.02 C ATOM 956 CG ARG A 256 14.496 -6.918 9.559 1.00 19.78 C ATOM 957 CD ARG A 256 15.233 -7.551 10.739 1.00 20.39 C ATOM 958 NE ARG A 256 15.186 -9.002 10.638 1.00 24.50 N ATOM 959 CZ ARG A 256 14.132 -9.733 10.985 1.00 24.93 C ATOM 960 NH1 ARG A 256 13.051 -9.145 11.490 1.00 22.58 N ATOM 961 NH2 ARG A 256 14.163 -11.043 10.841 1.00 22.24 N ATOM 962 H ARG A 256 14.389 -3.015 8.888 1.00 26.06 H ATOM 963 HA ARG A 256 13.875 -5.291 7.586 1.00 22.44 H ATOM 964 HB2 ARG A 256 15.453 -5.123 9.412 1.00 25.23 H ATOM 965 HB3 ARG A 256 14.192 -5.075 10.377 1.00 25.23 H ATOM 966 HG2 ARG A 256 13.571 -7.205 9.603 1.00 23.74 H ATOM 967 HG3 ARG A 256 14.903 -7.253 8.745 1.00 23.74 H ATOM 968 HD2 ARG A 256 16.162 -7.272 10.729 1.00 24.46 H ATOM 969 HD3 ARG A 256 14.806 -7.286 11.569 1.00 24.46 H ATOM 970 HE ARG A 256 15.911 -9.414 10.429 1.00 29.40 H ATOM 971 HH11 ARG A 256 13.029 -8.289 11.579 1.00 27.09 H ATOM 972 HH12 ARG A 256 12.371 -9.619 11.720 1.00 27.09 H ATOM 973 HH21 ARG A 256 14.864 -11.424 10.521 1.00 26.69 H ATOM 974 HH22 ARG A 256 13.486 -11.518 11.077 1.00 26.69 H ATOM 975 N TRP A 257 11.394 -4.842 7.676 1.00 17.88 N ATOM 976 CA TRP A 257 9.949 -4.747 7.832 1.00 16.74 C ATOM 977 C TRP A 257 9.356 -6.099 8.190 1.00 17.22 C ATOM 978 O TRP A 257 9.785 -7.139 7.682 1.00 18.63 O ATOM 979 CB TRP A 257 9.332 -4.215 6.543 1.00 18.29 C ATOM 980 CG TRP A 257 7.848 -4.127 6.602 1.00 18.08 C ATOM 981 CD1 TRP A 257 7.132 -3.154 7.211 1.00 20.21 C ATOM 982 CD2 TRP A 257 6.903 -5.032 6.023 1.00 17.19 C ATOM 983 NE1 TRP A 257 5.777 -3.380 7.047 1.00 19.43 N ATOM 984 CE2 TRP A 257 5.615 -4.534 6.321 1.00 15.89 C ATOM 985 CE3 TRP A 257 7.013 -6.219 5.283 1.00 21.84 C ATOM 986 CZ2 TRP A 257 4.451 -5.195 5.930 1.00 18.23 C ATOM 987 CZ3 TRP A 257 5.835 -6.860 4.883 1.00 19.68 C ATOM 988 CH2 TRP A 257 4.585 -6.331 5.193 1.00 21.40 C ATOM 989 H TRP A 257 11.657 -4.846 6.857 1.00 21.46 H ATOM 990 HA TRP A 257 9.744 -4.125 8.547 1.00 20.09 H ATOM 991 HB2 TRP A 257 9.678 -3.325 6.371 1.00 21.94 H ATOM 992 HB3 TRP A 257 9.567 -4.809 5.812 1.00 21.94 H ATOM 993 HD1 TRP A 257 7.498 -2.426 7.659 1.00 24.25 H ATOM 994 HE1 TRP A 257 5.144 -2.889 7.359 1.00 23.32 H ATOM 995 HE3 TRP A 257 7.846 -6.571 5.068 1.00 26.21 H ATOM 996 HZ2 TRP A 257 3.612 -4.847 6.129 1.00 21.88 H ATOM 997 HZ3 TRP A 257 5.889 -7.646 4.387 1.00 23.62 H ATOM 998 HH2 TRP A 257 3.821 -6.783 4.917 1.00 25.68 H ATOM 999 N GLN A 258 8.341 -6.068 9.061 1.00 18.98 N ATOM 1000 CA GLN A 258 7.615 -7.246 9.502 1.00 16.05 C ATOM 1001 C GLN A 258 6.149 -7.088 9.138 1.00 17.61 C ATOM 1002 O GLN A 258 5.591 -5.997 9.240 1.00 17.26 O ATOM 1003 CB GLN A 258 7.712 -7.439 11.009 1.00 18.94 C ATOM 1004 CG GLN A 258 9.096 -7.704 11.553 1.00 19.28 C ATOM 1005 CD GLN A 258 9.107 -7.618 13.049 1.00 21.10 C ATOM 1006 OE1 GLN A 258 8.665 -6.620 13.624 1.00 22.63 O ATOM 1007 NE2 GLN A 258 9.556 -8.679 13.691 1.00 21.25 N ATOM 1008 H GLN A 258 8.051 -5.343 9.421 1.00 22.78 H ATOM 1009 HA GLN A 258 7.966 -8.036 9.060 1.00 19.26 H ATOM 1010 HB2 GLN A 258 7.380 -6.637 11.441 1.00 22.72 H ATOM 1011 HB3 GLN A 258 7.155 -8.194 11.256 1.00 22.72 H ATOM 1012 HG2 GLN A 258 9.377 -8.596 11.297 1.00 23.13 H ATOM 1013 HG3 GLN A 258 9.712 -7.042 11.204 1.00 23.13 H ATOM 1014 HE21 GLN A 258 9.822 -9.368 13.250 1.00 25.49 H ATOM 1015 HE22 GLN A 258 9.584 -8.682 14.550 1.00 25.49 H ATOM 1016 N CYS A 259 5.526 -8.190 8.757 1.00 16.39 N ATOM 1017 CA CYS A 259 4.112 -8.190 8.435 1.00 16.93 C ATOM 1018 C CYS A 259 3.270 -8.017 9.696 1.00 18.91 C ATOM 1019 O CYS A 259 3.769 -8.039 10.815 1.00 18.42 O ATOM 1020 CB CYS A 259 3.735 -9.480 7.717 1.00 16.83 C ATOM 1021 SG CYS A 259 3.643 -10.969 8.734 1.00 17.55 S ATOM 1022 H CYS A 259 5.904 -8.959 8.677 1.00 19.67 H ATOM 1023 HA CYS A 259 3.922 -7.447 7.840 1.00 20.32 H ATOM 1024 HB2 CYS A 259 2.864 -9.356 7.308 1.00 20.19 H ATOM 1025 HB3 CYS A 259 4.394 -9.645 7.025 1.00 20.19 H ATOM 1026 N ILE A 260 1.962 -7.810 9.476 1.00 19.47 N ATOM 1027 CA ILE A 260 1.027 -7.581 10.579 1.00 17.78 C ATOM 1028 C ILE A 260 1.190 -8.645 11.669 1.00 17.79 C ATOM 1029 O ILE A 260 1.290 -8.327 12.860 1.00 20.93 O ATOM 1030 CB ILE A 260 -0.412 -7.535 10.041 1.00 19.05 C ATOM 1031 CG1 ILE A 260 -0.623 -6.237 9.247 1.00 22.45 C ATOM 1032 CG2 ILE A 260 -1.401 -7.615 11.196 1.00 22.88 C ATOM 1033 CD1 ILE A 260 -1.929 -6.190 8.459 1.00 29.03 C ATOM 1034 H ILE A 260 1.596 -7.798 8.698 1.00 23.37 H ATOM 1035 HA ILE A 260 1.221 -6.719 10.977 1.00 21.34 H ATOM 1036 HB ILE A 260 -0.554 -8.293 9.451 1.00 22.86 H ATOM 1037 HG12 ILE A 260 -0.625 -5.490 9.867 1.00 26.94 H ATOM 1038 HG13 ILE A 260 0.107 -6.136 8.616 1.00 26.94 H ATOM 1039 HG21 ILE A 260 -2.303 -7.585 10.842 1.00 27.45 H ATOM 1040 HG22 ILE A 260 -1.260 -8.447 11.674 1.00 27.45 H ATOM 1041 HG23 ILE A 260 -1.253 -6.863 11.790 1.00 27.45 H ATOM 1042 HD11 ILE A 260 -1.984 -5.343 7.990 1.00 34.84 H ATOM 1043 HD12 ILE A 260 -1.940 -6.922 7.823 1.00 34.84 H ATOM 1044 HD13 ILE A 260 -2.673 -6.275 9.076 1.00 34.84 H ATOM 1045 N GLU A 261 1.191 -9.926 11.291 1.00 19.83 N ATOM 1046 CA GLU A 261 1.186 -10.957 12.325 1.00 21.90 C ATOM 1047 C GLU A 261 2.552 -11.145 12.960 1.00 20.00 C ATOM 1048 O GLU A 261 2.626 -11.440 14.149 1.00 22.77 O ATOM 1049 CB GLU A 261 0.661 -12.288 11.767 1.00 24.00 C ATOM 1050 CG GLU A 261 -0.772 -12.191 11.227 1.00 27.19 C ATOM 1051 CD GLU A 261 -1.807 -11.656 12.238 1.00 28.90 C ATOM 1052 OE1 GLU A 261 -1.621 -11.809 13.476 1.00 32.53 O ATOM 1053 OE2 GLU A 261 -2.818 -11.090 11.775 1.00 31.56 O ATOM 1054 H GLU A 261 1.195 -10.212 10.480 1.00 23.79 H ATOM 1055 HA GLU A 261 0.578 -10.680 13.027 1.00 26.28 H ATOM 1056 HB2 GLU A 261 1.235 -12.573 11.039 1.00 28.79 H ATOM 1057 HB3 GLU A 261 0.669 -12.952 12.474 1.00 28.79 H ATOM 1058 HG2 GLU A 261 -0.774 -11.596 10.461 1.00 32.63 H ATOM 1059 HG3 GLU A 261 -1.060 -13.076 10.953 1.00 32.63 H ATOM 1060 N CYS A 262 3.641 -10.953 12.215 1.00 18.20 N ATOM 1061 CA CYS A 262 4.991 -11.072 12.751 1.00 16.91 C ATOM 1062 C CYS A 262 5.457 -9.867 13.569 1.00 17.49 C ATOM 1063 O CYS A 262 6.435 -9.989 14.322 1.00 21.27 O ATOM 1064 CB CYS A 262 5.997 -11.285 11.618 1.00 19.06 C ATOM 1065 SG CYS A 262 5.832 -12.961 10.831 1.00 20.69 S ATOM 1066 H CYS A 262 3.620 -10.748 11.380 1.00 21.84 H ATOM 1067 HA CYS A 262 5.027 -11.851 13.328 1.00 20.30 H ATOM 1068 HB2 CYS A 262 5.850 -10.615 10.933 1.00 22.87 H ATOM 1069 HB3 CYS A 262 6.896 -11.207 11.974 1.00 22.87 H ATOM 1070 N LYS A 263 4.789 -8.729 13.435 1.00 16.67 N ATOM 1071 CA LYS A 263 5.274 -7.491 14.036 1.00 19.05 C ATOM 1072 C LYS A 263 5.513 -7.654 15.530 1.00 18.27 C ATOM 1073 O LYS A 263 4.629 -8.098 16.273 1.00 19.28 O ATOM 1074 CB LYS A 263 4.274 -6.369 13.788 1.00 20.18 C ATOM 1075 CG LYS A 263 4.889 -4.984 14.044 1.00 20.68 C ATOM 1076 CD LYS A 263 5.468 -4.414 12.800 1.00 22.49 C ATOM 1077 CE LYS A 263 4.391 -3.970 11.825 1.00 20.83 C ATOM 1078 NZ LYS A 263 5.033 -3.640 10.544 1.00 20.37 N ATOM 1079 H LYS A 263 4.052 -8.645 13.001 1.00 20.01 H ATOM 1080 HA LYS A 263 6.115 -7.244 13.621 1.00 22.86 H ATOM 1081 HB2 LYS A 263 3.980 -6.403 12.864 1.00 24.21 H ATOM 1082 HB3 LYS A 263 3.517 -6.479 14.385 1.00 24.21 H ATOM 1083 HG2 LYS A 263 4.200 -4.381 14.364 1.00 24.82 H ATOM 1084 HG3 LYS A 263 5.598 -5.064 14.701 1.00 24.82 H ATOM 1085 HD2 LYS A 263 6.010 -3.642 13.025 1.00 26.99 H ATOM 1086 HD3 LYS A 263 6.012 -5.089 12.363 1.00 26.99 H ATOM 1087 HE2 LYS A 263 3.757 -4.690 11.682 1.00 25.00 H ATOM 1088 HE3 LYS A 263 3.944 -3.179 12.165 1.00 25.00 H ATOM 1089 HZ1 LYS A 263 4.420 -3.376 9.955 1.00 24.44 H ATOM 1090 HZ2 LYS A 263 5.624 -2.984 10.660 1.00 24.44 H ATOM 1091 HZ3 LYS A 263 5.454 -4.355 10.222 1.00 24.44 H ATOM 1092 N THR A 264 6.723 -7.307 15.958 1.00 18.06 N ATOM 1093 CA THR A 264 7.081 -7.260 17.368 1.00 18.60 C ATOM 1094 C THR A 264 7.325 -5.812 17.776 1.00 23.23 C ATOM 1095 O THR A 264 7.747 -4.994 16.960 1.00 22.68 O ATOM 1096 CB THR A 264 8.340 -8.079 17.652 1.00 23.27 C ATOM 1097 OG1 THR A 264 9.376 -7.671 16.770 1.00 25.67 O ATOM 1098 CG2 THR A 264 8.077 -9.571 17.441 1.00 23.17 C ATOM 1099 H THR A 264 7.370 -7.089 15.434 1.00 21.67 H ATOM 1100 HA THR A 264 6.352 -7.615 17.901 1.00 22.32 H ATOM 1101 HB THR A 264 8.620 -7.940 18.571 1.00 27.92 H ATOM 1102 HG1 THR A 264 9.544 -6.856 16.881 1.00 30.80 H ATOM 1103 HG21 THR A 264 8.883 -10.079 17.625 1.00 27.80 H ATOM 1104 HG22 THR A 264 7.373 -9.871 18.037 1.00 27.80 H ATOM 1105 HG23 THR A 264 7.805 -9.733 16.525 1.00 27.80 H ATOM 1106 N CYS A 265 7.107 -5.533 19.060 1.00 19.02 N ATOM 1107 CA CYS A 265 7.313 -4.188 19.604 1.00 19.90 C ATOM 1108 C CYS A 265 8.782 -3.793 19.502 1.00 23.11 C ATOM 1109 O CYS A 265 9.680 -4.555 19.888 1.00 22.64 O ATOM 1110 CB CYS A 265 6.839 -4.147 21.058 1.00 22.24 C ATOM 1111 SG CYS A 265 7.130 -2.558 21.866 1.00 21.25 S ATOM 1112 H CYS A 265 6.838 -6.107 19.641 1.00 22.82 H ATOM 1113 HA CYS A 265 6.790 -3.550 19.094 1.00 23.88 H ATOM 1114 HB2 CYS A 265 5.886 -4.323 21.082 1.00 26.69 H ATOM 1115 HB3 CYS A 265 7.313 -4.828 21.562 1.00 26.69 H ATOM 1116 N SER A 266 9.035 -2.598 18.963 1.00 19.76 N ATOM 1117 CA SER A 266 10.411 -2.158 18.769 1.00 23.71 C ATOM 1118 C SER A 266 11.112 -1.854 20.089 1.00 25.83 C ATOM 1119 O SER A 266 12.344 -1.888 20.144 1.00 31.14 O ATOM 1120 CB SER A 266 10.441 -0.933 17.860 1.00 23.35 C ATOM 1121 OG SER A 266 10.301 -1.322 16.501 1.00 25.68 O ATOM 1122 H SER A 266 8.437 -2.035 18.706 1.00 23.71 H ATOM 1123 HA SER A 266 10.906 -2.867 18.328 1.00 28.45 H ATOM 1124 HB2 SER A 266 9.708 -0.344 18.098 1.00 28.02 H ATOM 1125 HB3 SER A 266 11.287 -0.474 17.974 1.00 28.02 H ATOM 1126 HG SER A 266 10.930 -1.834 16.283 1.00 30.82 H ATOM 1127 N SER A 267 10.363 -1.583 21.150 1.00 22.65 N ATOM 1128 CA SER A 267 10.972 -1.360 22.456 1.00 23.83 C ATOM 1129 C SER A 267 11.246 -2.675 23.185 1.00 29.69 C ATOM 1130 O SER A 267 12.385 -2.950 23.563 1.00 35.91 O ATOM 1131 CB SER A 267 10.073 -0.452 23.291 1.00 30.67 C ATOM 1132 OG SER A 267 10.576 -0.307 24.609 1.00 34.02 O ATOM 1133 H SER A 267 9.506 -1.522 21.142 1.00 27.18 H ATOM 1134 HA SER A 267 11.820 -0.907 22.333 1.00 28.60 H ATOM 1135 HB2 SER A 267 10.031 0.422 22.872 1.00 36.80 H ATOM 1136 HB3 SER A 267 9.185 -0.841 23.334 1.00 36.80 H ATOM 1137 HG SER A 267 10.072 0.195 25.056 1.00 40.82 H ATOM 1138 N CYS A 268 10.219 -3.497 23.406 1.00 25.49 N ATOM 1139 CA CYS A 268 10.381 -4.659 24.268 1.00 24.24 C ATOM 1140 C CYS A 268 10.660 -5.946 23.500 1.00 28.42 C ATOM 1141 O CYS A 268 10.961 -6.963 24.132 1.00 30.84 O ATOM 1142 CB CYS A 268 9.141 -4.853 25.149 1.00 29.68 C ATOM 1143 SG CYS A 268 7.663 -5.414 24.329 1.00 26.26 S ATOM 1144 H CYS A 268 9.432 -3.404 23.073 1.00 30.59 H ATOM 1145 HA CYS A 268 11.135 -4.502 24.856 1.00 29.09 H ATOM 1146 HB2 CYS A 268 9.355 -5.506 25.833 1.00 35.61 H ATOM 1147 HB3 CYS A 268 8.932 -4.005 25.569 1.00 35.61 H ATOM 1148 N ARG A 269 10.567 -5.925 22.170 1.00 23.82 N ATOM 1149 CA ARG A 269 10.851 -7.049 21.279 1.00 25.53 C ATOM 1150 C ARG A 269 9.869 -8.206 21.430 1.00 26.31 C ATOM 1151 O ARG A 269 10.098 -9.284 20.879 1.00 27.29 O ATOM 1152 CB ARG A 269 12.288 -7.551 21.470 1.00 35.65 C ATOM 1153 CG ARG A 269 13.324 -6.444 21.430 1.00 38.87 C ATOM 1154 CD ARG A 269 14.246 -6.578 20.238 1.00 55.92 C ATOM 1155 NE ARG A 269 14.716 -7.957 20.074 1.00 60.51 N ATOM 1156 CZ ARG A 269 15.174 -8.469 18.934 1.00 62.41 C ATOM 1157 NH1 ARG A 269 15.561 -9.737 18.889 1.00 61.80 N ATOM 1158 NH2 ARG A 269 15.239 -7.721 17.836 1.00 61.30 N ATOM 1159 H ARG A 269 10.324 -5.223 21.736 1.00 28.59 H ATOM 1160 HA ARG A 269 10.779 -6.733 20.365 1.00 30.63 H ATOM 1161 HB2 ARG A 269 12.355 -7.990 22.332 1.00 42.78 H ATOM 1162 HB3 ARG A 269 12.497 -8.180 20.762 1.00 42.78 H ATOM 1163 HG2 ARG A 269 12.873 -5.587 21.368 1.00 46.65 H ATOM 1164 HG3 ARG A 269 13.862 -6.482 22.235 1.00 46.65 H ATOM 1165 HD2 ARG A 269 13.769 -6.322 19.433 1.00 67.10 H ATOM 1166 HD3 ARG A 269 15.020 -6.007 20.365 1.00 67.10 H ATOM 1167 HE ARG A 269 14.694 -8.471 20.763 1.00 72.61 H ATOM 1168 HH11 ARG A 269 15.523 -10.224 19.598 1.00 74.15 H ATOM 1169 HH12 ARG A 269 15.862 -10.069 18.156 1.00 74.15 H ATOM 1170 HH21 ARG A 269 14.985 -6.900 17.860 1.00 73.56 H ATOM 1171 HH22 ARG A 269 15.537 -8.058 17.103 1.00 73.56 H ATOM 1172 N ASP A 270 8.746 -7.983 22.084 1.00 26.83 N ATOM 1173 CA ASP A 270 7.746 -8.993 22.368 1.00 24.21 C ATOM 1174 C ASP A 270 6.479 -8.700 21.578 1.00 24.72 C ATOM 1175 O ASP A 270 6.280 -7.588 21.057 1.00 21.97 O ATOM 1176 CB ASP A 270 7.451 -9.006 23.877 1.00 26.70 C ATOM 1177 CG ASP A 270 6.773 -10.270 24.330 1.00 34.09 C ATOM 1178 OD1 ASP A 270 6.824 -11.254 23.576 1.00 33.33 O ATOM 1179 OD2 ASP A 270 6.217 -10.277 25.447 1.00 32.44 O ATOM 1180 H ASP A 270 8.530 -7.209 22.390 1.00 32.20 H ATOM 1181 HA ASP A 270 8.080 -9.866 22.109 1.00 29.05 H ATOM 1182 HB2 ASP A 270 8.287 -8.924 24.363 1.00 32.04 H ATOM 1183 HB3 ASP A 270 6.869 -8.261 24.091 1.00 32.04 H ATOM 1184 N GLN A 271 5.615 -9.718 21.496 1.00 25.12 N ATOM 1185 CA GLN A 271 4.240 -9.532 21.060 1.00 23.28 C ATOM 1186 C GLN A 271 3.331 -9.557 22.284 1.00 27.25 C ATOM 1187 O GLN A 271 2.762 -8.527 22.666 1.00 24.72 O ATOM 1188 CB GLN A 271 3.831 -10.590 20.040 1.00 23.85 C ATOM 1189 CG GLN A 271 4.595 -10.431 18.747 1.00 23.37 C ATOM 1190 CD GLN A 271 4.334 -11.545 17.775 1.00 27.54 C ATOM 1191 OE1 GLN A 271 3.958 -12.657 18.162 1.00 28.39 O ATOM 1192 NE2 GLN A 271 4.517 -11.255 16.491 1.00 31.17 N ATOM 1193 H GLN A 271 5.811 -10.532 21.690 1.00 30.14 H ATOM 1194 HA GLN A 271 4.155 -8.662 20.640 1.00 27.94 H ATOM 1195 HB2 GLN A 271 4.020 -11.471 20.399 1.00 28.62 H ATOM 1196 HB3 GLN A 271 2.884 -10.501 19.848 1.00 28.62 H ATOM 1197 HG2 GLN A 271 4.332 -9.598 18.325 1.00 28.04 H ATOM 1198 HG3 GLN A 271 5.545 -10.419 18.941 1.00 28.04 H ATOM 1199 HE21 GLN A 271 4.770 -10.466 16.260 1.00 37.41 H ATOM 1200 HE22 GLN A 271 4.382 -11.856 15.891 1.00 37.41 H ATOM 1201 N GLY A 272 3.198 -10.708 22.916 1.00 26.34 N ATOM 1202 CA GLY A 272 2.605 -10.758 24.238 1.00 28.51 C ATOM 1203 C GLY A 272 1.096 -10.659 24.248 1.00 26.85 C ATOM 1204 O GLY A 272 0.412 -10.709 23.218 1.00 26.34 O ATOM 1205 H GLY A 272 3.441 -11.472 22.604 1.00 31.61 H ATOM 1206 HA2 GLY A 272 2.854 -11.592 24.666 1.00 34.21 H ATOM 1207 HA3 GLY A 272 2.957 -10.028 24.771 1.00 34.21 H ATOM 1208 N LYS A 273 0.557 -10.520 25.461 1.00 27.92 N ATOM 1209 CA LYS A 273 -0.891 -10.595 25.602 1.00 29.05 C ATOM 1210 C LYS A 273 -1.594 -9.394 24.991 1.00 31.68 C ATOM 1211 O LYS A 273 -2.759 -9.514 24.603 1.00 35.91 O ATOM 1212 CB LYS A 273 -1.294 -10.746 27.081 1.00 39.87 C ATOM 1213 CG LYS A 273 -0.995 -9.542 27.988 1.00 42.65 C ATOM 1214 CD LYS A 273 -1.567 -9.763 29.413 1.00 48.45 C ATOM 1215 CE LYS A 273 -1.197 -8.637 30.392 1.00 57.74 C ATOM 1216 NZ LYS A 273 0.208 -8.731 30.920 1.00 57.61 N ATOM 1217 H LYS A 273 0.992 -10.387 26.191 1.00 33.50 H ATOM 1218 HA LYS A 273 -1.204 -11.385 25.133 1.00 34.86 H ATOM 1219 HB2 LYS A 273 -2.249 -10.908 27.122 1.00 47.84 H ATOM 1220 HB3 LYS A 273 -0.822 -11.509 27.450 1.00 47.84 H ATOM 1221 HG2 LYS A 273 -0.035 -9.423 28.060 1.00 51.18 H ATOM 1222 HG3 LYS A 273 -1.407 -8.747 27.614 1.00 51.18 H ATOM 1223 HD2 LYS A 273 -2.535 -9.807 29.360 1.00 58.14 H ATOM 1224 HD3 LYS A 273 -1.217 -10.595 29.767 1.00 58.14 H ATOM 1225 HE2 LYS A 273 -1.286 -7.785 29.937 1.00 69.29 H ATOM 1226 HE3 LYS A 273 -1.801 -8.671 31.149 1.00 69.29 H ATOM 1227 HZ1 LYS A 273 0.368 -8.058 31.480 1.00 69.13 H ATOM 1228 HZ2 LYS A 273 0.319 -9.500 31.354 1.00 69.13 H ATOM 1229 HZ3 LYS A 273 0.790 -8.692 30.247 1.00 69.13 H ATOM 1230 N ASN A 274 -0.907 -8.256 24.876 1.00 33.93 N ATOM 1231 CA ASN A 274 -1.466 -7.052 24.277 1.00 36.35 C ATOM 1232 C ASN A 274 -1.081 -6.895 22.814 1.00 34.66 C ATOM 1233 O ASN A 274 -1.149 -5.788 22.280 1.00 32.08 O ATOM 1234 CB ASN A 274 -1.016 -5.824 25.058 1.00 37.97 C ATOM 1235 CG ASN A 274 -1.564 -5.802 26.458 1.00 46.82 C ATOM 1236 OD1 ASN A 274 -2.687 -6.253 26.708 1.00 45.15 O ATOM 1237 ND2 ASN A 274 -0.775 -5.270 27.391 1.00 49.04 N ATOM 1238 H ASN A 274 -0.096 -8.159 25.145 1.00 40.72 H ATOM 1239 HA ASN A 274 -2.434 -7.098 24.326 1.00 43.62 H ATOM 1240 HB2 ASN A 274 -0.047 -5.821 25.114 1.00 45.56 H ATOM 1241 HB3 ASN A 274 -1.325 -5.026 24.601 1.00 45.56 H ATOM 1242 HD21 ASN A 274 -1.040 -5.233 28.208 1.00 58.85 H ATOM 1243 HD22 ASN A 274 -0.001 -4.965 27.175 1.00 58.85 H ATOM 1244 N ALA A 275 -0.692 -7.984 22.148 1.00 26.57 N ATOM 1245 CA ALA A 275 -0.213 -7.865 20.770 1.00 31.01 C ATOM 1246 C ALA A 275 -1.218 -7.139 19.868 1.00 26.64 C ATOM 1247 O ALA A 275 -0.833 -6.313 19.029 1.00 26.10 O ATOM 1248 CB ALA A 275 0.089 -9.262 20.223 1.00 28.51 C ATOM 1249 H ALA A 275 -0.695 -8.784 22.463 1.00 31.89 H ATOM 1250 HA ALA A 275 0.613 -7.357 20.766 1.00 37.21 H ATOM 1251 HB1 ALA A 275 0.406 -9.181 19.310 1.00 34.22 H ATOM 1252 HB2 ALA A 275 0.771 -9.676 20.776 1.00 34.22 H ATOM 1253 HB3 ALA A 275 -0.723 -9.792 20.247 1.00 34.22 H ATOM 1254 N ASP A 276 -2.508 -7.456 19.993 1.00 27.49 N ATOM 1255 CA ASP A 276 -3.503 -6.959 19.049 1.00 27.93 C ATOM 1256 C ASP A 276 -3.673 -5.448 19.129 1.00 26.05 C ATOM 1257 O ASP A 276 -4.145 -4.825 18.168 1.00 27.34 O ATOM 1258 CB ASP A 276 -4.855 -7.633 19.307 1.00 36.09 C ATOM 1259 CG ASP A 276 -5.295 -8.528 18.159 1.00 41.39 C ATOM 1260 OD1 ASP A 276 -4.418 -9.102 17.485 1.00 42.98 O ATOM 1261 OD2 ASP A 276 -6.525 -8.643 17.931 1.00 47.37 O ATOM 1262 H ASP A 276 -2.829 -7.956 20.615 1.00 32.98 H ATOM 1263 HA ASP A 276 -3.223 -7.182 18.148 1.00 33.52 H ATOM 1264 HB2 ASP A 276 -4.788 -8.180 20.105 1.00 43.30 H ATOM 1265 HB3 ASP A 276 -5.531 -6.948 19.429 1.00 43.30 H ATOM 1266 N ASN A 277 -3.323 -4.855 20.259 1.00 25.08 N ATOM 1267 CA ASN A 277 -3.442 -3.419 20.438 1.00 26.11 C ATOM 1268 C ASN A 277 -2.131 -2.696 20.196 1.00 25.43 C ATOM 1269 O ASN A 277 -2.041 -1.491 20.454 1.00 28.03 O ATOM 1270 CB ASN A 277 -3.970 -3.110 21.840 1.00 30.89 C ATOM 1271 CG ASN A 277 -5.435 -3.435 21.973 1.00 37.04 C ATOM 1272 OD1 ASN A 277 -6.225 -3.134 21.078 1.00 43.27 O ATOM 1273 ND2 ASN A 277 -5.808 -4.063 23.079 1.00 43.40 N ATOM 1274 H ASN A 277 -3.011 -5.268 20.946 1.00 30.10 H ATOM 1275 HA ASN A 277 -4.088 -3.080 19.798 1.00 31.33 H ATOM 1276 HB2 ASN A 277 -3.482 -3.642 22.488 1.00 37.07 H ATOM 1277 HB3 ASN A 277 -3.851 -2.166 22.024 1.00 37.07 H ATOM 1278 HD21 ASN A 277 -6.635 -4.269 23.198 1.00 52.08 H ATOM 1279 HD22 ASN A 277 -5.224 -4.266 23.676 1.00 52.08 H ATOM 1280 N MET A 278 -1.116 -3.399 19.701 1.00 21.44 N ATOM 1281 CA MET A 278 0.132 -2.761 19.309 1.00 22.86 C ATOM 1282 C MET A 278 -0.112 -1.673 18.259 1.00 21.29 C ATOM 1283 O MET A 278 -0.800 -1.907 17.267 1.00 20.74 O ATOM 1284 CB MET A 278 1.065 -3.835 18.753 1.00 20.92 C ATOM 1285 CG MET A 278 2.441 -3.381 18.488 1.00 22.06 C ATOM 1286 SD MET A 278 3.507 -4.637 17.703 1.00 22.17 S ATOM 1287 CE MET A 278 3.427 -5.989 18.887 1.00 21.15 C ATOM 1288 H MET A 278 -1.127 -4.251 19.583 1.00 25.73 H ATOM 1289 HA MET A 278 0.551 -2.366 20.090 1.00 27.43 H ATOM 1290 HB2 MET A 278 1.114 -4.563 19.392 1.00 25.11 H ATOM 1291 HB3 MET A 278 0.697 -4.160 17.916 1.00 25.11 H ATOM 1292 HG2 MET A 278 2.407 -2.612 17.897 1.00 26.47 H ATOM 1293 HG3 MET A 278 2.853 -3.129 19.329 1.00 26.47 H ATOM 1294 HE1 MET A 278 3.969 -6.725 18.563 1.00 25.38 H ATOM 1295 HE2 MET A 278 3.765 -5.679 19.742 1.00 25.38 H ATOM 1296 HE3 MET A 278 2.504 -6.273 18.980 1.00 25.38 H ATOM 1297 N LEU A 279 0.444 -0.471 18.486 1.00 18.75 N ATOM 1298 CA LEU A 279 0.382 0.622 17.520 1.00 17.54 C ATOM 1299 C LEU A 279 1.357 0.399 16.368 1.00 19.94 C ATOM 1300 O LEU A 279 2.478 -0.057 16.589 1.00 21.62 O ATOM 1301 CB LEU A 279 0.723 1.939 18.219 1.00 19.53 C ATOM 1302 CG LEU A 279 -0.105 2.294 19.458 1.00 23.01 C ATOM 1303 CD1 LEU A 279 0.328 3.672 19.891 1.00 21.17 C ATOM 1304 CD2 LEU A 279 -1.583 2.272 19.200 1.00 29.53 C ATOM 1305 H LEU A 279 0.868 -0.269 19.206 1.00 22.50 H ATOM 1306 HA LEU A 279 -0.515 0.686 17.159 1.00 21.05 H ATOM 1307 HB2 LEU A 279 1.652 1.904 18.495 1.00 23.43 H ATOM 1308 HB3 LEU A 279 0.606 2.659 17.580 1.00 23.43 H ATOM 1309 HG LEU A 279 0.095 1.669 20.172 1.00 27.61 H ATOM 1310 HD11 LEU A 279 -0.179 3.929 20.677 1.00 25.41 H ATOM 1311 HD12 LEU A 279 1.275 3.655 20.098 1.00 25.41 H ATOM 1312 HD13 LEU A 279 0.159 4.297 19.168 1.00 25.41 H ATOM 1313 HD21 LEU A 279 -2.049 2.504 20.018 1.00 35.43 H ATOM 1314 HD22 LEU A 279 -1.791 2.917 18.506 1.00 35.43 H ATOM 1315 HD23 LEU A 279 -1.840 1.382 18.913 1.00 35.43 H ATOM 1316 N PHE A 280 0.944 0.744 15.136 1.00 19.91 N ATOM 1317 CA PHE A 280 1.832 0.723 13.967 1.00 19.95 C ATOM 1318 C PHE A 280 2.113 2.150 13.517 1.00 20.74 C ATOM 1319 O PHE A 280 1.176 2.879 13.188 1.00 20.57 O ATOM 1320 CB PHE A 280 1.233 -0.036 12.779 1.00 19.36 C ATOM 1321 CG PHE A 280 1.080 -1.535 12.987 1.00 15.89 C ATOM 1322 CD1 PHE A 280 1.587 -2.170 14.091 1.00 16.52 C ATOM 1323 CD2 PHE A 280 0.407 -2.287 12.035 1.00 21.30 C ATOM 1324 CE1 PHE A 280 1.431 -3.553 14.243 1.00 18.76 C ATOM 1325 CE2 PHE A 280 0.251 -3.664 12.184 1.00 21.42 C ATOM 1326 CZ PHE A 280 0.757 -4.280 13.280 1.00 17.68 C ATOM 1327 H PHE A 280 0.142 0.998 14.954 1.00 23.90 H ATOM 1328 HA PHE A 280 2.673 0.304 14.208 1.00 23.94 H ATOM 1329 HB2 PHE A 280 0.351 0.325 12.595 1.00 23.23 H ATOM 1330 HB3 PHE A 280 1.806 0.096 12.008 1.00 23.23 H ATOM 1331 HD1 PHE A 280 2.042 -1.681 14.738 1.00 19.82 H ATOM 1332 HD2 PHE A 280 0.060 -1.866 11.282 1.00 25.56 H ATOM 1333 HE1 PHE A 280 1.776 -3.981 14.993 1.00 22.51 H ATOM 1334 HE2 PHE A 280 -0.203 -4.156 11.538 1.00 25.71 H ATOM 1335 HZ PHE A 280 0.652 -5.198 13.384 1.00 21.21 H ATOM 1336 N CYS A 281 3.392 2.509 13.429 1.00 18.37 N ATOM 1337 CA CYS A 281 3.780 3.859 12.989 1.00 18.10 C ATOM 1338 C CYS A 281 3.323 4.142 11.567 1.00 22.71 C ATOM 1339 O CYS A 281 3.544 3.349 10.649 1.00 20.74 O ATOM 1340 CB CYS A 281 5.290 4.029 13.084 1.00 19.93 C ATOM 1341 SG CYS A 281 5.827 5.705 12.640 1.00 22.97 S ATOM 1342 H CYS A 281 4.056 1.996 13.616 1.00 22.05 H ATOM 1343 HA CYS A 281 3.366 4.513 13.573 1.00 21.72 H ATOM 1344 HB2 CYS A 281 5.572 3.853 13.996 1.00 23.92 H ATOM 1345 HB3 CYS A 281 5.718 3.405 12.477 1.00 23.92 H ATOM 1346 N ASP A 282 2.699 5.300 11.364 1.00 20.34 N ATOM 1347 CA ASP A 282 2.275 5.636 10.011 1.00 21.27 C ATOM 1348 C ASP A 282 3.382 6.229 9.151 1.00 25.84 C ATOM 1349 O ASP A 282 3.128 6.532 7.979 1.00 27.41 O ATOM 1350 CB ASP A 282 1.072 6.573 10.079 1.00 25.92 C ATOM 1351 CG ASP A 282 -0.176 5.853 10.515 1.00 30.35 C ATOM 1352 OD1 ASP A 282 -0.406 4.715 10.021 1.00 26.79 O ATOM 1353 OD2 ASP A 282 -0.920 6.374 11.379 1.00 29.04 O ATOM 1354 H ASP A 282 2.515 5.885 11.966 1.00 24.40 H ATOM 1355 HA ASP A 282 1.980 4.821 9.576 1.00 25.53 H ATOM 1356 HB2 ASP A 282 1.253 7.279 10.720 1.00 31.10 H ATOM 1357 HB3 ASP A 282 0.912 6.951 9.201 1.00 31.10 H ATOM 1358 N SER A 283 4.599 6.358 9.678 1.00 22.01 N ATOM 1359 CA SER A 283 5.762 6.767 8.906 1.00 22.62 C ATOM 1360 C SER A 283 6.697 5.615 8.555 1.00 26.46 C ATOM 1361 O SER A 283 7.157 5.547 7.419 1.00 27.64 O ATOM 1362 CB SER A 283 6.528 7.871 9.666 1.00 26.65 C ATOM 1363 OG SER A 283 7.793 8.113 9.091 1.00 34.05 O ATOM 1364 H SER A 283 4.776 6.209 10.506 1.00 26.41 H ATOM 1365 HA SER A 283 5.453 7.152 8.071 1.00 27.14 H ATOM 1366 HB2 SER A 283 6.008 8.690 9.637 1.00 31.98 H ATOM 1367 HB3 SER A 283 6.650 7.591 10.587 1.00 31.98 H ATOM 1368 HG SER A 283 8.256 7.413 9.111 1.00 40.86 H ATOM 1369 N CYS A 284 6.938 4.652 9.473 1.00 22.66 N ATOM 1370 CA CYS A 284 7.906 3.587 9.250 1.00 20.98 C ATOM 1371 C CYS A 284 7.310 2.206 9.465 1.00 19.37 C ATOM 1372 O CYS A 284 8.001 1.216 9.240 1.00 21.15 O ATOM 1373 CB CYS A 284 9.112 3.733 10.200 1.00 23.63 C ATOM 1374 SG CYS A 284 8.700 3.413 11.949 1.00 21.74 S ATOM 1375 H CYS A 284 6.543 4.606 10.235 1.00 27.19 H ATOM 1376 HA CYS A 284 8.231 3.638 8.337 1.00 25.17 H ATOM 1377 HB2 CYS A 284 9.798 3.102 9.935 1.00 28.36 H ATOM 1378 HB3 CYS A 284 9.454 4.639 10.136 1.00 28.36 H ATOM 1379 N ASP A 285 6.069 2.129 9.915 1.00 17.68 N ATOM 1380 CA ASP A 285 5.336 0.887 10.194 1.00 16.07 C ATOM 1381 C ASP A 285 5.957 0.035 11.305 1.00 17.96 C ATOM 1382 O ASP A 285 5.589 -1.151 11.471 1.00 16.82 O ATOM 1383 CB ASP A 285 5.129 0.049 8.925 1.00 18.94 C ATOM 1384 CG ASP A 285 3.837 -0.730 8.976 1.00 21.61 C ATOM 1385 OD1 ASP A 285 2.811 -0.154 9.398 1.00 21.42 O ATOM 1386 OD2 ASP A 285 3.814 -1.932 8.606 1.00 19.75 O ATOM 1387 H ASP A 285 5.595 2.828 10.080 1.00 21.22 H ATOM 1388 HA ASP A 285 4.451 1.137 10.505 1.00 19.28 H ATOM 1389 HB2 ASP A 285 5.098 0.637 8.155 1.00 22.73 H ATOM 1390 HB3 ASP A 285 5.860 -0.582 8.836 1.00 22.73 H ATOM 1391 N ARG A 286 6.848 0.569 12.135 1.00 20.53 N ATOM 1392 CA ARG A 286 7.252 -0.192 13.318 1.00 17.48 C ATOM 1393 C ARG A 286 6.085 -0.299 14.297 1.00 20.61 C ATOM 1394 O ARG A 286 5.190 0.545 14.320 1.00 19.70 O ATOM 1395 CB ARG A 286 8.444 0.464 14.028 1.00 22.31 C ATOM 1396 CG ARG A 286 9.767 0.412 13.294 1.00 23.79 C ATOM 1397 CD ARG A 286 10.774 1.222 14.077 1.00 25.88 C ATOM 1398 NE ARG A 286 12.126 1.180 13.531 1.00 32.23 N ATOM 1399 CZ ARG A 286 12.677 2.129 12.774 1.00 32.86 C ATOM 1400 NH1 ARG A 286 12.002 3.210 12.413 1.00 27.66 N ATOM 1401 NH2 ARG A 286 13.929 1.991 12.368 1.00 31.07 N ATOM 1402 H ARG A 286 7.222 1.338 12.044 1.00 24.64 H ATOM 1403 HA ARG A 286 7.511 -1.088 13.051 1.00 20.98 H ATOM 1404 HB2 ARG A 286 8.233 1.399 14.177 1.00 26.77 H ATOM 1405 HB3 ARG A 286 8.571 0.023 14.882 1.00 26.77 H ATOM 1406 HG2 ARG A 286 10.078 -0.505 13.237 1.00 28.55 H ATOM 1407 HG3 ARG A 286 9.670 0.801 12.410 1.00 28.55 H ATOM 1408 HD2 ARG A 286 10.488 2.149 14.087 1.00 31.06 H ATOM 1409 HD3 ARG A 286 10.811 0.881 14.984 1.00 31.06 H ATOM 1410 HE ARG A 286 12.605 0.489 13.712 1.00 38.67 H ATOM 1411 HH11 ARG A 286 11.191 3.319 12.676 1.00 33.19 H ATOM 1412 HH12 ARG A 286 12.377 3.806 11.919 1.00 33.19 H ATOM 1413 HH21 ARG A 286 14.377 1.290 12.587 1.00 37.28 H ATOM 1414 HH22 ARG A 286 14.286 2.591 11.866 1.00 37.28 H ATOM 1415 N GLY A 287 6.104 -1.350 15.112 1.00 16.48 N ATOM 1416 CA GLY A 287 5.112 -1.542 16.152 1.00 16.84 C ATOM 1417 C GLY A 287 5.635 -1.140 17.521 1.00 18.58 C ATOM 1418 O GLY A 287 6.815 -1.348 17.841 1.00 20.54 O ATOM 1419 H GLY A 287 6.695 -1.974 15.077 1.00 19.77 H ATOM 1420 HA2 GLY A 287 4.326 -1.009 15.954 1.00 20.20 H ATOM 1421 HA3 GLY A 287 4.852 -2.476 16.183 1.00 20.20 H ATOM 1422 N PHE A 288 4.731 -0.583 18.328 1.00 20.18 N ATOM 1423 CA PHE A 288 4.988 -0.243 19.727 1.00 20.35 C ATOM 1424 C PHE A 288 3.748 -0.560 20.539 1.00 19.07 C ATOM 1425 O PHE A 288 2.653 -0.115 20.203 1.00 21.59 O ATOM 1426 CB PHE A 288 5.322 1.248 19.930 1.00 19.24 C ATOM 1427 CG PHE A 288 6.652 1.658 19.403 1.00 18.86 C ATOM 1428 CD1 PHE A 288 6.800 2.045 18.084 1.00 22.48 C ATOM 1429 CD2 PHE A 288 7.744 1.675 20.237 1.00 21.28 C ATOM 1430 CE1 PHE A 288 8.024 2.417 17.608 1.00 25.09 C ATOM 1431 CE2 PHE A 288 8.955 2.057 19.779 1.00 23.26 C ATOM 1432 CZ PHE A 288 9.101 2.429 18.452 1.00 24.10 C ATOM 1433 H PHE A 288 3.933 -0.386 18.076 1.00 24.21 H ATOM 1434 HA PHE A 288 5.726 -0.775 20.064 1.00 24.42 H ATOM 1435 HB2 PHE A 288 4.649 1.781 19.477 1.00 23.09 H ATOM 1436 HB3 PHE A 288 5.309 1.443 20.880 1.00 23.09 H ATOM 1437 HD1 PHE A 288 6.066 2.033 17.513 1.00 26.97 H ATOM 1438 HD2 PHE A 288 7.647 1.424 21.128 1.00 25.53 H ATOM 1439 HE1 PHE A 288 8.123 2.674 16.720 1.00 30.11 H ATOM 1440 HE2 PHE A 288 9.690 2.060 20.348 1.00 27.91 H ATOM 1441 HZ PHE A 288 9.936 2.688 18.133 1.00 28.93 H ATOM 1442 N HIS A 289 3.910 -1.308 21.620 1.00 22.14 N ATOM 1443 CA HIS A 289 2.845 -1.354 22.605 1.00 22.04 C ATOM 1444 C HIS A 289 2.663 0.042 23.178 1.00 20.26 C ATOM 1445 O HIS A 289 3.641 0.752 23.404 1.00 23.35 O ATOM 1446 CB HIS A 289 3.195 -2.310 23.745 1.00 22.31 C ATOM 1447 CG HIS A 289 3.370 -3.742 23.336 1.00 22.00 C ATOM 1448 ND1 HIS A 289 4.571 -4.397 23.483 1.00 27.08 N ATOM 1449 CD2 HIS A 289 2.488 -4.657 22.872 1.00 28.93 C ATOM 1450 CE1 HIS A 289 4.429 -5.652 23.087 1.00 22.40 C ATOM 1451 NE2 HIS A 289 3.178 -5.833 22.712 1.00 25.49 N ATOM 1452 H HIS A 289 4.603 -1.783 21.803 1.00 26.57 H ATOM 1453 HA HIS A 289 2.016 -1.640 22.190 1.00 26.44 H ATOM 1454 HB2 HIS A 289 4.026 -2.017 24.149 1.00 26.77 H ATOM 1455 HB3 HIS A 289 2.483 -2.279 24.404 1.00 26.77 H ATOM 1456 HD2 HIS A 289 1.590 -4.512 22.679 1.00 34.72 H ATOM 1457 HE1 HIS A 289 5.099 -6.297 23.073 1.00 26.89 H ATOM 1458 HE2 HIS A 289 2.848 -6.568 22.413 1.00 30.59 H ATOM 1459 N MET A 290 1.414 0.432 23.441 1.00 23.66 N ATOM 1460 CA MET A 290 1.176 1.745 24.052 1.00 22.40 C ATOM 1461 C MET A 290 2.022 1.940 25.303 1.00 25.73 C ATOM 1462 O MET A 290 2.597 3.015 25.508 1.00 25.41 O ATOM 1463 CB MET A 290 -0.308 1.923 24.397 1.00 26.21 C ATOM 1464 CG MET A 290 -1.182 2.072 23.189 1.00 30.13 C ATOM 1465 SD MET A 290 -2.913 2.363 23.616 1.00 37.24 S ATOM 1466 CE MET A 290 -3.425 0.745 24.143 1.00 40.52 C ATOM 1467 H MET A 290 0.705 -0.028 23.281 1.00 28.39 H ATOM 1468 HA MET A 290 1.412 2.432 23.409 1.00 26.88 H ATOM 1469 HB2 MET A 290 -0.611 1.145 24.890 1.00 31.45 H ATOM 1470 HB3 MET A 290 -0.411 2.720 24.940 1.00 31.45 H ATOM 1471 HG2 MET A 290 -0.871 2.826 22.665 1.00 36.16 H ATOM 1472 HG3 MET A 290 -1.135 1.259 22.662 1.00 36.16 H ATOM 1473 HE1 MET A 290 -4.359 0.779 24.402 1.00 48.62 H ATOM 1474 HE2 MET A 290 -3.308 0.122 23.409 1.00 48.62 H ATOM 1475 HE3 MET A 290 -2.882 0.473 24.899 1.00 48.62 H ATOM 1476 N GLU A 291 2.106 0.913 26.155 1.00 28.18 N ATOM 1477 CA GLU A 291 2.842 1.010 27.411 1.00 28.37 C ATOM 1478 C GLU A 291 4.346 1.071 27.198 1.00 29.69 C ATOM 1479 O GLU A 291 5.086 1.392 28.134 1.00 30.22 O ATOM 1480 CB GLU A 291 2.481 -0.176 28.317 1.00 30.69 C ATOM 1481 CG GLU A 291 2.750 -1.545 27.690 1.00 33.22 C ATOM 1482 CD GLU A 291 1.561 -2.111 26.925 1.00 36.63 C ATOM 1483 OE1 GLU A 291 0.724 -1.335 26.402 1.00 30.26 O ATOM 1484 OE2 GLU A 291 1.465 -3.363 26.844 1.00 43.84 O ATOM 1485 H GLU A 291 1.740 0.146 26.024 1.00 33.81 H ATOM 1486 HA GLU A 291 2.575 1.823 27.867 1.00 34.05 H ATOM 1487 HB2 GLU A 291 3.003 -0.116 29.132 1.00 36.83 H ATOM 1488 HB3 GLU A 291 1.535 -0.129 28.530 1.00 36.83 H ATOM 1489 HG2 GLU A 291 3.492 -1.465 27.070 1.00 39.86 H ATOM 1490 HG3 GLU A 291 2.976 -2.173 28.394 1.00 39.86 H ATOM 1491 N CYS A 292 4.817 0.783 25.992 1.00 26.31 N ATOM 1492 CA CYS A 292 6.235 0.798 25.689 1.00 26.98 C ATOM 1493 C CYS A 292 6.628 2.047 24.927 1.00 24.91 C ATOM 1494 O CYS A 292 7.801 2.195 24.553 1.00 31.03 O ATOM 1495 CB CYS A 292 6.623 -0.451 24.875 1.00 26.85 C ATOM 1496 SG CYS A 292 6.305 -2.036 25.711 1.00 27.25 S ATOM 1497 H CYS A 292 4.323 0.572 25.320 1.00 31.57 H ATOM 1498 HA CYS A 292 6.735 0.783 26.520 1.00 32.37 H ATOM 1499 HB2 CYS A 292 6.117 -0.450 24.047 1.00 32.22 H ATOM 1500 HB3 CYS A 292 7.571 -0.409 24.677 1.00 32.22 H ATOM 1501 N CYS A 293 5.682 2.950 24.676 1.00 26.47 N ATOM 1502 CA CYS A 293 6.066 4.188 24.029 1.00 25.21 C ATOM 1503 C CYS A 293 6.784 5.111 25.015 1.00 26.55 C ATOM 1504 O CYS A 293 6.669 4.987 26.244 1.00 28.39 O ATOM 1505 CB CYS A 293 4.857 4.899 23.453 1.00 24.93 C ATOM 1506 SG CYS A 293 4.061 4.011 22.087 1.00 26.54 S ATOM 1507 H CYS A 293 4.847 2.870 24.862 1.00 31.76 H ATOM 1508 HA CYS A 293 6.676 3.991 23.300 1.00 30.25 H ATOM 1509 HB2 CYS A 293 4.198 5.012 24.156 1.00 29.92 H ATOM 1510 HB3 CYS A 293 5.135 5.766 23.120 1.00 29.92 H ATOM 1511 HG CYS A 293 3.121 4.649 21.701 1.00 31.85 H ATOM 1512 N ASP A 294 7.507 6.057 24.449 1.00 29.36 N ATOM 1513 CA ASP A 294 8.151 7.106 25.232 1.00 30.52 C ATOM 1514 C ASP A 294 7.616 8.455 24.776 1.00 32.47 C ATOM 1515 O ASP A 294 8.019 8.945 23.720 1.00 37.01 O ATOM 1516 CB ASP A 294 9.668 7.047 25.066 1.00 34.57 C ATOM 1517 CG ASP A 294 10.395 8.042 25.966 1.00 45.48 C ATOM 1518 OD1 ASP A 294 9.716 8.863 26.606 1.00 45.39 O ATOM 1519 OD2 ASP A 294 11.643 8.002 26.032 1.00 54.75 O ATOM 1520 H ASP A 294 7.644 6.120 23.602 1.00 35.24 H ATOM 1521 HA ASP A 294 7.938 6.989 26.171 1.00 36.63 H ATOM 1522 HB2 ASP A 294 9.976 6.155 25.292 1.00 41.48 H ATOM 1523 HB3 ASP A 294 9.893 7.253 24.145 1.00 41.48 H ATOM 1524 N PRO A 295 6.709 9.074 25.565 1.00 29.50 N ATOM 1525 CA PRO A 295 6.213 8.604 26.862 1.00 29.60 C ATOM 1526 C PRO A 295 5.150 7.525 26.712 1.00 27.36 C ATOM 1527 O PRO A 295 4.549 7.430 25.645 1.00 27.46 O ATOM 1528 CB PRO A 295 5.621 9.874 27.479 1.00 35.91 C ATOM 1529 CG PRO A 295 5.135 10.614 26.317 1.00 31.78 C ATOM 1530 CD PRO A 295 6.132 10.381 25.219 1.00 37.93 C ATOM 1531 HA PRO A 295 6.941 8.277 27.414 1.00 35.52 H ATOM 1532 HB2 PRO A 295 4.892 9.645 28.077 1.00 43.10 H ATOM 1533 HB3 PRO A 295 6.312 10.370 27.945 1.00 43.10 H ATOM 1534 HG2 PRO A 295 4.262 10.277 26.060 1.00 38.14 H ATOM 1535 HG3 PRO A 295 5.083 11.559 26.533 1.00 38.14 H ATOM 1536 HD2 PRO A 295 5.686 10.337 24.359 1.00 45.51 H ATOM 1537 HD3 PRO A 295 6.817 11.068 25.232 1.00 45.51 H ATOM 1538 N PRO A 296 4.940 6.714 27.749 1.00 27.82 N ATOM 1539 CA PRO A 296 3.928 5.666 27.656 1.00 27.14 C ATOM 1540 C PRO A 296 2.530 6.239 27.525 1.00 31.21 C ATOM 1541 O PRO A 296 2.214 7.308 28.055 1.00 28.42 O ATOM 1542 CB PRO A 296 4.101 4.876 28.962 1.00 37.04 C ATOM 1543 CG PRO A 296 4.873 5.732 29.848 1.00 36.86 C ATOM 1544 CD PRO A 296 5.725 6.592 28.990 1.00 32.88 C ATOM 1545 HA PRO A 296 4.111 5.085 26.901 1.00 32.56 H ATOM 1546 HB2 PRO A 296 3.230 4.687 29.345 1.00 44.45 H ATOM 1547 HB3 PRO A 296 4.580 4.052 28.782 1.00 44.45 H ATOM 1548 HG2 PRO A 296 4.269 6.276 30.376 1.00 44.23 H ATOM 1549 HG3 PRO A 296 5.424 5.181 30.426 1.00 44.23 H ATOM 1550 HD2 PRO A 296 5.848 7.463 29.400 1.00 39.45 H ATOM 1551 HD3 PRO A 296 6.574 6.158 28.813 1.00 39.45 H ATOM 1552 N LEU A 297 1.685 5.513 26.801 1.00 25.91 N ATOM 1553 CA LEU A 297 0.322 5.948 26.527 1.00 24.60 C ATOM 1554 C LEU A 297 -0.674 5.036 27.216 1.00 32.02 C ATOM 1555 O LEU A 297 -0.472 3.822 27.286 1.00 32.17 O ATOM 1556 CB LEU A 297 0.027 5.969 25.028 1.00 25.48 C ATOM 1557 CG LEU A 297 0.930 6.876 24.194 1.00 28.16 C ATOM 1558 CD1 LEU A 297 0.691 6.670 22.716 1.00 28.26 C ATOM 1559 CD2 LEU A 297 0.694 8.334 24.550 1.00 31.78 C ATOM 1560 H LEU A 297 1.881 4.752 26.451 1.00 31.09 H ATOM 1561 HA LEU A 297 0.199 6.847 26.871 1.00 29.52 H ATOM 1562 HB2 LEU A 297 0.122 5.067 24.683 1.00 30.58 H ATOM 1563 HB3 LEU A 297 -0.887 6.269 24.899 1.00 30.58 H ATOM 1564 HG LEU A 297 1.857 6.664 24.383 1.00 33.80 H ATOM 1565 HD11 LEU A 297 1.278 7.259 22.217 1.00 33.91 H ATOM 1566 HD12 LEU A 297 0.880 5.746 22.491 1.00 33.91 H ATOM 1567 HD13 LEU A 297 -0.235 6.878 22.514 1.00 33.91 H ATOM 1568 HD21 LEU A 297 1.277 8.889 24.010 1.00 38.14 H ATOM 1569 HD22 LEU A 297 -0.234 8.556 24.373 1.00 38.14 H ATOM 1570 HD23 LEU A 297 0.891 8.464 25.491 1.00 38.14 H ATOM 1571 N THR A 298 -1.759 5.621 27.720 1.00 33.12 N ATOM 1572 CA THR A 298 -2.834 4.816 28.287 1.00 39.15 C ATOM 1573 C THR A 298 -4.066 4.768 27.398 1.00 35.26 C ATOM 1574 O THR A 298 -4.914 3.892 27.584 1.00 33.46 O ATOM 1575 CB THR A 298 -3.233 5.343 29.676 1.00 38.93 C ATOM 1576 OG1 THR A 298 -4.222 6.356 29.523 1.00 43.59 O ATOM 1577 CG2 THR A 298 -2.011 5.942 30.428 1.00 40.79 C ATOM 1578 H THR A 298 -1.895 6.470 27.746 1.00 39.74 H ATOM 1579 HA THR A 298 -2.515 3.907 28.397 1.00 46.98 H ATOM 1580 HB THR A 298 -3.594 4.616 30.206 1.00 46.72 H ATOM 1581 HG1 THR A 298 -4.449 6.652 30.276 1.00 52.31 H ATOM 1582 HG21 THR A 298 -2.286 6.267 31.300 1.00 48.94 H ATOM 1583 HG22 THR A 298 -1.329 5.262 30.546 1.00 48.94 H ATOM 1584 HG23 THR A 298 -1.637 6.679 29.920 1.00 48.94 H ATOM 1585 N ARG A 299 -4.179 5.671 26.436 1.00 28.79 N ATOM 1586 CA ARG A 299 -5.267 5.645 25.473 1.00 26.31 C ATOM 1587 C ARG A 299 -4.706 5.649 24.066 1.00 27.96 C ATOM 1588 O ARG A 299 -3.631 6.194 23.812 1.00 26.27 O ATOM 1589 CB ARG A 299 -6.208 6.837 25.642 1.00 30.17 C ATOM 1590 CG ARG A 299 -7.134 6.699 26.825 1.00 30.98 C ATOM 1591 CD ARG A 299 -8.157 7.812 26.897 1.00 38.27 C ATOM 1592 NE ARG A 299 -9.012 7.917 25.708 1.00 40.06 N ATOM 1593 CZ ARG A 299 -8.865 8.809 24.727 1.00 37.46 C ATOM 1594 NH1 ARG A 299 -7.875 9.732 24.741 1.00 32.37 N ATOM 1595 NH2 ARG A 299 -9.732 8.787 23.728 1.00 42.59 N ATOM 1596 H ARG A 299 -3.628 6.321 26.318 1.00 34.55 H ATOM 1597 HA ARG A 299 -5.782 4.831 25.594 1.00 31.57 H ATOM 1598 HB2 ARG A 299 -5.679 7.640 25.768 1.00 36.20 H ATOM 1599 HB3 ARG A 299 -6.753 6.922 24.844 1.00 36.20 H ATOM 1600 HG2 ARG A 299 -7.611 5.857 26.758 1.00 37.18 H ATOM 1601 HG3 ARG A 299 -6.610 6.720 27.641 1.00 37.18 H ATOM 1602 HD2 ARG A 299 -8.733 7.658 27.662 1.00 45.92 H ATOM 1603 HD3 ARG A 299 -7.692 8.657 27.002 1.00 45.92 H ATOM 1604 HE ARG A 299 -9.662 7.358 25.639 1.00 48.07 H ATOM 1605 HH11 ARG A 299 -7.315 9.751 25.393 1.00 38.84 H ATOM 1606 HH12 ARG A 299 -7.804 10.296 24.096 1.00 38.84 H ATOM 1607 HH21 ARG A 299 -10.361 8.200 23.718 1.00 51.11 H ATOM 1608 HH22 ARG A 299 -9.657 9.348 23.081 1.00 51.11 H ATOM 1609 N MET A 300 -5.474 5.080 23.156 1.00 28.17 N ATOM 1610 CA MET A 300 -5.066 5.031 21.764 1.00 27.48 C ATOM 1611 C MET A 300 -4.948 6.442 21.183 1.00 27.26 C ATOM 1612 O MET A 300 -5.881 7.248 21.347 1.00 26.65 O ATOM 1613 CB MET A 300 -6.098 4.239 20.984 1.00 33.24 C ATOM 1614 CG MET A 300 -5.748 2.798 20.800 1.00 44.75 C ATOM 1615 SD MET A 300 -4.995 2.683 19.192 1.00 55.24 S ATOM 1616 CE MET A 300 -6.374 3.105 18.113 1.00 36.54 C ATOM 1617 H MET A 300 -6.236 4.715 23.317 1.00 33.80 H ATOM 1618 HA MET A 300 -4.211 4.578 21.692 1.00 32.98 H ATOM 1619 HB2 MET A 300 -6.944 4.280 21.457 1.00 39.88 H ATOM 1620 HB3 MET A 300 -6.194 4.635 20.104 1.00 39.88 H ATOM 1621 HG2 MET A 300 -5.110 2.516 21.475 1.00 53.70 H ATOM 1622 HG3 MET A 300 -6.549 2.251 20.820 1.00 53.70 H ATOM 1623 HE1 MET A 300 -6.074 3.074 17.191 1.00 43.85 H ATOM 1624 HE2 MET A 300 -7.089 2.464 18.250 1.00 43.85 H ATOM 1625 HE3 MET A 300 -6.683 3.998 18.331 1.00 43.85 H ATOM 1626 N PRO A 301 -3.853 6.770 20.488 1.00 25.92 N ATOM 1627 CA PRO A 301 -3.787 8.064 19.794 1.00 27.01 C ATOM 1628 C PRO A 301 -4.842 8.161 18.702 1.00 30.12 C ATOM 1629 O PRO A 301 -5.293 7.161 18.135 1.00 27.18 O ATOM 1630 CB PRO A 301 -2.374 8.091 19.205 1.00 28.04 C ATOM 1631 CG PRO A 301 -1.608 7.077 19.989 1.00 28.43 C ATOM 1632 CD PRO A 301 -2.582 6.032 20.380 1.00 29.96 C ATOM 1633 HA PRO A 301 -3.894 8.797 20.421 1.00 32.41 H ATOM 1634 HB2 PRO A 301 -2.406 7.846 18.267 1.00 33.64 H ATOM 1635 HB3 PRO A 301 -1.990 8.974 19.317 1.00 33.64 H ATOM 1636 HG2 PRO A 301 -0.908 6.699 19.434 1.00 34.11 H ATOM 1637 HG3 PRO A 301 -1.227 7.497 20.776 1.00 34.11 H ATOM 1638 HD2 PRO A 301 -2.644 5.352 19.690 1.00 35.95 H ATOM 1639 HD3 PRO A 301 -2.341 5.647 21.237 1.00 35.95 H ATOM 1640 N LYS A 302 -5.262 9.386 18.427 1.00 25.22 N ATOM 1641 CA LYS A 302 -6.282 9.642 17.428 1.00 25.08 C ATOM 1642 C LYS A 302 -5.641 10.043 16.108 1.00 26.53 C ATOM 1643 O LYS A 302 -4.674 10.803 16.080 1.00 26.11 O ATOM 1644 CB LYS A 302 -7.232 10.743 17.899 1.00 30.02 C ATOM 1645 CG LYS A 302 -8.296 11.079 16.872 1.00 41.10 C ATOM 1646 CD LYS A 302 -9.600 11.577 17.515 1.00 42.31 C ATOM 1647 CE LYS A 302 -10.666 11.880 16.465 1.00 44.97 C ATOM 1648 NZ LYS A 302 -11.996 12.189 17.080 1.00 52.47 N ATOM 1649 H LYS A 302 -4.966 10.095 18.811 1.00 30.26 H ATOM 1650 HA LYS A 302 -6.799 8.835 17.283 1.00 30.10 H ATOM 1651 HB2 LYS A 302 -7.679 10.450 18.709 1.00 36.02 H ATOM 1652 HB3 LYS A 302 -6.720 11.548 18.075 1.00 36.02 H ATOM 1653 HG2 LYS A 302 -7.963 11.778 16.288 1.00 49.32 H ATOM 1654 HG3 LYS A 302 -8.500 10.283 16.356 1.00 49.32 H ATOM 1655 HD2 LYS A 302 -9.945 10.892 18.109 1.00 50.78 H ATOM 1656 HD3 LYS A 302 -9.421 12.392 18.009 1.00 50.78 H ATOM 1657 HE2 LYS A 302 -10.389 12.649 15.944 1.00 53.96 H ATOM 1658 HE3 LYS A 302 -10.773 11.107 15.889 1.00 53.96 H ATOM 1659 HZ1 LYS A 302 -12.593 12.360 16.442 1.00 62.96 H ATOM 1660 HZ2 LYS A 302 -12.277 11.494 17.561 1.00 62.96 H ATOM 1661 HZ3 LYS A 302 -11.928 12.900 17.611 1.00 62.96 H ATOM 1662 N GLY A 303 -6.190 9.524 15.006 1.00 25.32 N ATOM 1663 CA GLY A 303 -5.663 9.854 13.701 1.00 27.15 C ATOM 1664 C GLY A 303 -4.305 9.228 13.437 1.00 27.79 C ATOM 1665 O GLY A 303 -3.872 8.284 14.110 1.00 31.10 O ATOM 1666 H GLY A 303 -6.861 8.986 14.997 1.00 30.39 H ATOM 1667 HA2 GLY A 303 -6.279 9.547 13.018 1.00 32.58 H ATOM 1668 HA3 GLY A 303 -5.575 10.817 13.624 1.00 32.58 H ATOM 1669 N MET A 304 -3.629 9.783 12.435 1.00 27.75 N ATOM 1670 CA MET A 304 -2.307 9.303 12.057 1.00 31.27 C ATOM 1671 C MET A 304 -1.344 9.455 13.225 1.00 31.52 C ATOM 1672 O MET A 304 -1.338 10.472 13.928 1.00 27.86 O ATOM 1673 CB MET A 304 -1.784 10.062 10.847 1.00 31.96 C ATOM 1674 CG MET A 304 -2.659 9.973 9.625 1.00 41.37 C ATOM 1675 SD MET A 304 -2.343 8.469 8.676 1.00 60.63 S ATOM 1676 CE MET A 304 -0.784 8.883 7.891 1.00 48.94 C ATOM 1677 H MET A 304 -3.915 10.439 11.960 1.00 33.30 H ATOM 1678 HA MET A 304 -2.369 8.364 11.818 1.00 37.53 H ATOM 1679 HB2 MET A 304 -1.702 11.000 11.081 1.00 38.35 H ATOM 1680 HB3 MET A 304 -0.912 9.707 10.611 1.00 38.35 H ATOM 1681 HG2 MET A 304 -3.589 9.967 9.899 1.00 49.64 H ATOM 1682 HG3 MET A 304 -2.483 10.735 9.051 1.00 49.64 H ATOM 1683 HE1 MET A 304 -0.500 8.137 7.340 1.00 58.73 H ATOM 1684 HE2 MET A 304 -0.907 9.673 7.341 1.00 58.73 H ATOM 1685 HE3 MET A 304 -0.121 9.057 8.578 1.00 58.73 H ATOM 1686 N TRP A 305 -0.530 8.427 13.440 1.00 24.46 N ATOM 1687 CA TRP A 305 0.358 8.382 14.588 1.00 21.59 C ATOM 1688 C TRP A 305 1.769 8.100 14.124 1.00 24.60 C ATOM 1689 O TRP A 305 1.987 7.211 13.297 1.00 24.07 O ATOM 1690 CB TRP A 305 -0.080 7.325 15.576 1.00 23.68 C ATOM 1691 CG TRP A 305 0.822 7.241 16.734 1.00 25.09 C ATOM 1692 CD1 TRP A 305 0.901 8.120 17.774 1.00 24.23 C ATOM 1693 CD2 TRP A 305 1.811 6.239 16.970 1.00 22.86 C ATOM 1694 NE1 TRP A 305 1.883 7.729 18.648 1.00 25.36 N ATOM 1695 CE2 TRP A 305 2.444 6.560 18.187 1.00 23.09 C ATOM 1696 CE3 TRP A 305 2.210 5.084 16.278 1.00 21.83 C ATOM 1697 CZ2 TRP A 305 3.461 5.784 18.725 1.00 25.11 C ATOM 1698 CZ3 TRP A 305 3.244 4.318 16.811 1.00 21.04 C ATOM 1699 CH2 TRP A 305 3.852 4.670 18.023 1.00 22.84 C ATOM 1700 H TRP A 305 -0.474 7.738 12.928 1.00 29.35 H ATOM 1701 HA TRP A 305 0.349 9.243 15.037 1.00 25.91 H ATOM 1702 HB2 TRP A 305 -0.969 7.541 15.900 1.00 28.41 H ATOM 1703 HB3 TRP A 305 -0.087 6.461 15.135 1.00 28.41 H ATOM 1704 HD1 TRP A 305 0.372 8.878 17.871 1.00 29.07 H ATOM 1705 HE1 TRP A 305 2.090 8.129 19.380 1.00 30.43 H ATOM 1706 HE3 TRP A 305 1.809 4.849 15.473 1.00 26.19 H ATOM 1707 HZ2 TRP A 305 3.876 6.021 19.523 1.00 30.13 H ATOM 1708 HZ3 TRP A 305 3.516 3.547 16.368 1.00 25.25 H ATOM 1709 HH2 TRP A 305 4.529 4.132 18.364 1.00 27.41 H ATOM 1710 N ILE A 306 2.708 8.877 14.660 1.00 23.67 N ATOM 1711 CA ILE A 306 4.117 8.830 14.321 1.00 22.96 C ATOM 1712 C ILE A 306 4.870 8.447 15.577 1.00 28.51 C ATOM 1713 O ILE A 306 4.658 9.049 16.638 1.00 29.72 O ATOM 1714 CB ILE A 306 4.617 10.189 13.793 1.00 33.25 C ATOM 1715 CG1 ILE A 306 3.844 10.588 12.544 1.00 35.53 C ATOM 1716 CG2 ILE A 306 6.106 10.151 13.548 1.00 37.01 C ATOM 1717 CD1 ILE A 306 3.948 9.598 11.451 1.00 33.37 C ATOM 1718 H ILE A 306 2.534 9.472 15.256 1.00 28.40 H ATOM 1719 HA ILE A 306 4.271 8.154 13.644 1.00 27.55 H ATOM 1720 HB ILE A 306 4.445 10.856 14.476 1.00 39.90 H ATOM 1721 HG12 ILE A 306 2.905 10.682 12.772 1.00 42.64 H ATOM 1722 HG13 ILE A 306 4.190 11.432 12.216 1.00 42.64 H ATOM 1723 HG21 ILE A 306 6.394 11.016 13.217 1.00 44.41 H ATOM 1724 HG22 ILE A 306 6.558 9.948 14.382 1.00 44.41 H ATOM 1725 HG23 ILE A 306 6.300 9.464 12.891 1.00 44.41 H ATOM 1726 HD11 ILE A 306 3.435 9.913 10.690 1.00 40.04 H ATOM 1727 HD12 ILE A 306 4.881 9.499 11.204 1.00 40.04 H ATOM 1728 HD13 ILE A 306 3.596 8.749 11.760 1.00 40.04 H ATOM 1729 N CYS A 307 5.799 7.514 15.439 1.00 23.05 N ATOM 1730 CA CYS A 307 6.448 6.910 16.586 1.00 25.88 C ATOM 1731 C CYS A 307 7.600 7.781 17.092 1.00 26.64 C ATOM 1732 O CYS A 307 7.991 8.779 16.476 1.00 29.12 O ATOM 1733 CB CYS A 307 6.971 5.518 16.234 1.00 24.18 C ATOM 1734 SG CYS A 307 8.492 5.430 15.264 1.00 24.82 S ATOM 1735 H CYS A 307 6.073 7.211 14.682 1.00 27.66 H ATOM 1736 HA CYS A 307 5.802 6.818 17.304 1.00 31.06 H ATOM 1737 HB2 CYS A 307 7.133 5.039 17.062 1.00 29.02 H ATOM 1738 HB3 CYS A 307 6.284 5.058 15.728 1.00 29.02 H ATOM 1739 N GLN A 308 8.142 7.367 18.242 1.00 28.29 N ATOM 1740 CA GLN A 308 9.222 8.101 18.901 1.00 29.25 C ATOM 1741 C GLN A 308 10.495 8.149 18.078 1.00 29.98 C ATOM 1742 O GLN A 308 11.333 9.040 18.303 1.00 32.51 O ATOM 1743 CB GLN A 308 9.526 7.469 20.259 1.00 30.64 C ATOM 1744 CG GLN A 308 9.957 6.013 20.199 1.00 30.10 C ATOM 1745 CD GLN A 308 9.774 5.302 21.528 1.00 28.27 C ATOM 1746 OE1 GLN A 308 8.639 5.108 22.008 1.00 29.93 O ATOM 1747 NE2 GLN A 308 10.883 4.936 22.149 1.00 30.24 N ATOM 1748 H GLN A 308 7.897 6.658 18.663 1.00 33.95 H ATOM 1749 HA GLN A 308 8.932 9.014 19.055 1.00 35.10 H ATOM 1750 HB2 GLN A 308 10.242 7.970 20.680 1.00 36.77 H ATOM 1751 HB3 GLN A 308 8.728 7.517 20.808 1.00 36.77 H ATOM 1752 HG2 GLN A 308 9.423 5.552 19.534 1.00 36.12 H ATOM 1753 HG3 GLN A 308 10.896 5.970 19.961 1.00 36.12 H ATOM 1754 HE21 GLN A 308 11.649 5.105 21.796 1.00 36.28 H ATOM 1755 HE22 GLN A 308 10.839 4.529 22.905 1.00 36.28 H ATOM 1756 N ILE A 309 10.679 7.211 17.148 1.00 27.57 N ATOM 1757 CA ILE A 309 11.866 7.214 16.305 1.00 28.54 C ATOM 1758 C ILE A 309 11.707 8.227 15.181 1.00 31.42 C ATOM 1759 O ILE A 309 12.659 8.933 14.826 1.00 33.52 O ATOM 1760 CB ILE A 309 12.145 5.808 15.755 1.00 29.93 C ATOM 1761 CG1 ILE A 309 12.434 4.827 16.894 1.00 32.75 C ATOM 1762 CG2 ILE A 309 13.299 5.847 14.785 1.00 31.64 C ATOM 1763 CD1 ILE A 309 12.625 3.399 16.438 1.00 37.03 C ATOM 1764 H ILE A 309 10.132 6.567 16.988 1.00 33.08 H ATOM 1765 HA ILE A 309 12.630 7.481 16.840 1.00 34.25 H ATOM 1766 HB ILE A 309 11.356 5.503 15.281 1.00 35.91 H ATOM 1767 HG12 ILE A 309 13.246 5.105 17.347 1.00 39.30 H ATOM 1768 HG13 ILE A 309 11.690 4.843 17.516 1.00 39.30 H ATOM 1769 HG21 ILE A 309 13.459 4.951 14.449 1.00 37.97 H ATOM 1770 HG22 ILE A 309 13.074 6.440 14.051 1.00 37.97 H ATOM 1771 HG23 ILE A 309 14.087 6.174 15.245 1.00 37.97 H ATOM 1772 HD11 ILE A 309 12.803 2.842 17.212 1.00 44.44 H ATOM 1773 HD12 ILE A 309 11.817 3.099 15.994 1.00 44.44 H ATOM 1774 HD13 ILE A 309 13.374 3.361 15.824 1.00 44.44 H ATOM 1775 N CYS A 310 10.500 8.329 14.628 1.00 29.84 N ATOM 1776 CA CYS A 310 10.240 9.172 13.467 1.00 30.84 C ATOM 1777 C CYS A 310 10.003 10.627 13.844 1.00 36.89 C ATOM 1778 O CYS A 310 10.407 11.525 13.102 1.00 41.67 O ATOM 1779 CB CYS A 310 9.021 8.675 12.708 1.00 32.52 C ATOM 1780 SG CYS A 310 9.335 7.107 11.912 1.00 27.03 S ATOM 1781 H CYS A 310 9.805 7.913 14.914 1.00 35.81 H ATOM 1782 HA CYS A 310 11.004 9.135 12.870 1.00 37.01 H ATOM 1783 HB2 CYS A 310 8.284 8.559 13.328 1.00 39.02 H ATOM 1784 HB3 CYS A 310 8.785 9.322 12.024 1.00 39.02 H ATOM 1785 N ARG A 311 9.299 10.884 14.940 1.00 33.87 N ATOM 1786 CA ARG A 311 8.973 12.265 15.259 1.00 40.11 C ATOM 1787 C ARG A 311 10.260 13.036 15.552 1.00 43.15 C ATOM 1788 O ARG A 311 11.172 12.505 16.203 1.00 49.12 O ATOM 1789 CB ARG A 311 7.999 12.338 16.437 1.00 38.29 C ATOM 1790 CG ARG A 311 8.575 12.000 17.774 1.00 38.65 C ATOM 1791 CD ARG A 311 7.542 12.157 18.904 1.00 38.29 C ATOM 1792 NE ARG A 311 8.205 12.036 20.201 1.00 47.59 N ATOM 1793 CZ ARG A 311 7.947 11.107 21.118 1.00 46.25 C ATOM 1794 NH1 ARG A 311 7.004 10.205 20.925 1.00 41.13 N ATOM 1795 NH2 ARG A 311 8.638 11.094 22.248 1.00 48.90 N ATOM 1796 H ARG A 311 9.008 10.298 15.498 1.00 40.65 H ATOM 1797 HA ARG A 311 8.546 12.675 14.491 1.00 48.13 H ATOM 1798 HB2 ARG A 311 7.651 13.242 16.491 1.00 45.95 H ATOM 1799 HB3 ARG A 311 7.269 11.721 16.270 1.00 45.95 H ATOM 1800 HG2 ARG A 311 8.877 11.078 17.766 1.00 46.38 H ATOM 1801 HG3 ARG A 311 9.319 12.594 17.959 1.00 46.38 H ATOM 1802 HD2 ARG A 311 7.129 13.032 18.849 1.00 45.95 H ATOM 1803 HD3 ARG A 311 6.872 11.458 18.833 1.00 45.95 H ATOM 1804 HE ARG A 311 8.813 12.614 20.387 1.00 57.11 H ATOM 1805 HH11 ARG A 311 6.554 10.203 20.192 1.00 49.36 H ATOM 1806 HH12 ARG A 311 6.844 9.614 21.528 1.00 49.36 H ATOM 1807 HH21 ARG A 311 9.250 11.683 22.385 1.00 58.68 H ATOM 1808 HH22 ARG A 311 8.467 10.504 22.850 1.00 58.68 H ATOM 1809 N PRO A 312 10.383 14.284 15.072 1.00 50.74 N ATOM 1810 CA PRO A 312 11.622 15.075 15.178 1.00 54.20 C ATOM 1811 C PRO A 312 12.051 15.331 16.623 1.00 53.99 C ATOM 1812 O PRO A 312 11.163 15.553 17.453 1.00 59.59 O ATOM 1813 CB PRO A 312 11.259 16.393 14.480 1.00 52.92 C ATOM 1814 CG PRO A 312 9.774 16.483 14.579 1.00 54.30 C ATOM 1815 CD PRO A 312 9.279 15.061 14.486 1.00 51.12 C ATOM 1816 HA PRO A 312 12.344 14.642 14.697 1.00 65.04 H ATOM 1817 HB2 PRO A 312 11.679 17.135 14.943 1.00 63.50 H ATOM 1818 HB3 PRO A 312 11.541 16.362 13.553 1.00 63.50 H ATOM 1819 HG2 PRO A 312 9.527 16.876 15.430 1.00 65.16 H ATOM 1820 HG3 PRO A 312 9.430 17.013 13.843 1.00 65.16 H ATOM 1821 HD2 PRO A 312 8.470 14.950 15.010 1.00 61.34 H ATOM 1822 HD3 PRO A 312 9.141 14.810 13.560 1.00 61.34 H TER 1823 PRO A 312 ATOM 1824 N ALA B 1 -5.000 6.049 15.226 1.00 35.64 N ATOM 1825 CA ALA B 1 -3.819 5.189 15.000 1.00 29.09 C ATOM 1826 C ALA B 1 -4.257 3.842 14.461 1.00 24.67 C ATOM 1827 O ALA B 1 -5.386 3.401 14.712 1.00 29.04 O ATOM 1828 CB ALA B 1 -3.044 4.993 16.282 1.00 26.27 C ATOM 1829 H1 ALA B 1 -4.879 6.833 14.822 1.00 42.77 H ATOM 1830 H2 ALA B 1 -5.724 5.653 14.892 1.00 42.77 H ATOM 1831 H3 ALA B 1 -5.110 6.180 16.100 1.00 42.77 H ATOM 1832 HA ALA B 1 -3.234 5.606 14.347 1.00 34.90 H ATOM 1833 HB1 ALA B 1 -2.277 4.427 16.105 1.00 31.53 H ATOM 1834 HB2 ALA B 1 -2.749 5.858 16.607 1.00 31.53 H ATOM 1835 HB3 ALA B 1 -3.622 4.573 16.938 1.00 31.53 H ATOM 1836 N ARG B 2 -3.370 3.207 13.712 1.00 25.75 N ATOM 1837 CA ARG B 2 -3.537 1.814 13.330 1.00 21.46 C ATOM 1838 C ARG B 2 -2.977 0.923 14.417 1.00 23.30 C ATOM 1839 O ARG B 2 -1.914 1.210 14.976 1.00 23.48 O ATOM 1840 CB ARG B 2 -2.790 1.484 12.044 1.00 26.07 C ATOM 1841 CG ARG B 2 -3.365 1.975 10.770 1.00 32.93 C ATOM 1842 CD ARG B 2 -2.469 1.500 9.633 1.00 28.49 C ATOM 1843 NE ARG B 2 -1.113 2.002 9.798 1.00 25.17 N ATOM 1844 CZ ARG B 2 0.000 1.314 9.571 1.00 24.45 C ATOM 1845 NH1 ARG B 2 -0.050 0.064 9.143 1.00 23.98 N ATOM 1846 NH2 ARG B 2 1.178 1.891 9.784 1.00 25.87 N ATOM 1847 H ARG B 2 -2.651 3.567 13.408 1.00 30.91 H ATOM 1848 HA ARG B 2 -4.478 1.613 13.209 1.00 25.75 H ATOM 1849 HB2 ARG B 2 -1.896 1.856 12.114 1.00 31.28 H ATOM 1850 HB3 ARG B 2 -2.727 0.519 11.974 1.00 31.28 H ATOM 1851 HG2 ARG B 2 -4.254 1.607 10.645 1.00 39.51 H ATOM 1852 HG3 ARG B 2 -3.388 2.945 10.769 1.00 39.51 H ATOM 1853 HD2 ARG B 2 -2.438 0.530 9.631 1.00 34.19 H ATOM 1854 HD3 ARG B 2 -2.817 1.829 8.789 1.00 34.19 H ATOM 1855 HE ARG B 2 -1.025 2.815 10.065 1.00 30.20 H ATOM 1856 HH11 ARG B 2 -0.811 -0.314 9.010 1.00 28.78 H ATOM 1857 HH12 ARG B 2 0.678 -0.370 8.997 1.00 28.78 H ATOM 1858 HH21 ARG B 2 1.215 2.705 10.059 1.00 31.05 H ATOM 1859 HH22 ARG B 2 1.904 1.455 9.632 1.00 31.05 H ATOM 1860 N THR B 3 -3.680 -0.163 14.694 1.00 22.38 N ATOM 1861 CA THR B 3 -3.169 -1.234 15.524 1.00 22.60 C ATOM 1862 C THR B 3 -3.095 -2.495 14.694 1.00 22.10 C ATOM 1863 O THR B 3 -3.604 -2.578 13.571 1.00 22.03 O ATOM 1864 CB THR B 3 -4.046 -1.514 16.757 1.00 25.13 C ATOM 1865 OG1 THR B 3 -5.331 -2.022 16.352 1.00 25.02 O ATOM 1866 CG2 THR B 3 -4.202 -0.260 17.596 1.00 30.53 C ATOM 1867 H THR B 3 -4.477 -0.305 14.404 1.00 26.86 H ATOM 1868 HA THR B 3 -2.275 -1.011 15.827 1.00 27.12 H ATOM 1869 HB THR B 3 -3.606 -2.182 17.305 1.00 30.16 H ATOM 1870 HG1 THR B 3 -5.806 -2.174 17.027 1.00 30.02 H ATOM 1871 HG21 THR B 3 -4.757 -0.447 18.370 1.00 36.63 H ATOM 1872 HG22 THR B 3 -3.333 0.047 17.898 1.00 36.63 H ATOM 1873 HG23 THR B 3 -4.620 0.440 17.071 1.00 36.63 H ATOM 1874 N LYS B 4 -2.455 -3.489 15.288 1.00 22.43 N ATOM 1875 CA LYS B 4 -2.399 -4.780 14.637 1.00 21.69 C ATOM 1876 C LYS B 4 -3.811 -5.246 14.297 1.00 22.29 C ATOM 1877 O LYS B 4 -4.095 -5.641 13.166 1.00 23.41 O ATOM 1878 CB LYS B 4 -1.652 -5.751 15.549 1.00 19.73 C ATOM 1879 CG LYS B 4 -1.525 -7.085 14.951 1.00 20.97 C ATOM 1880 CD LYS B 4 -0.671 -7.993 15.836 1.00 27.07 C ATOM 1881 CE LYS B 4 0.806 -7.551 15.961 1.00 25.34 C ATOM 1882 NZ LYS B 4 1.773 -8.696 15.724 1.00 23.79 N ATOM 1883 H LYS B 4 -2.056 -3.444 16.048 1.00 26.92 H ATOM 1884 HA LYS B 4 -1.900 -4.698 13.809 1.00 26.03 H ATOM 1885 HB2 LYS B 4 -0.760 -5.409 15.716 1.00 23.67 H ATOM 1886 HB3 LYS B 4 -2.137 -5.839 16.385 1.00 23.67 H ATOM 1887 HG2 LYS B 4 -2.405 -7.484 14.862 1.00 25.16 H ATOM 1888 HG3 LYS B 4 -1.097 -7.011 14.084 1.00 25.16 H ATOM 1889 HD2 LYS B 4 -1.051 -8.006 16.728 1.00 32.49 H ATOM 1890 HD3 LYS B 4 -0.680 -8.889 15.464 1.00 32.49 H ATOM 1891 HE2 LYS B 4 0.987 -6.863 15.302 1.00 30.41 H ATOM 1892 HE3 LYS B 4 0.960 -7.207 16.854 1.00 30.41 H ATOM 1893 HZ1 LYS B 4 2.611 -8.407 15.803 1.00 28.55 H ATOM 1894 HZ2 LYS B 4 1.632 -9.341 16.321 1.00 28.55 H ATOM 1895 HZ3 LYS B 4 1.657 -9.028 14.906 1.00 28.55 H ATOM 1896 N GLN B 5 -4.740 -5.085 15.236 1.00 25.62 N ATOM 1897 CA GLN B 5 -6.112 -5.514 15.011 1.00 29.31 C ATOM 1898 C GLN B 5 -6.781 -4.706 13.906 1.00 28.71 C ATOM 1899 O GLN B 5 -7.421 -5.271 13.011 1.00 27.94 O ATOM 1900 CB GLN B 5 -6.891 -5.382 16.316 1.00 32.02 C ATOM 1901 CG GLN B 5 -8.285 -5.894 16.259 1.00 37.51 C ATOM 1902 CD GLN B 5 -8.955 -5.728 17.592 1.00 47.99 C ATOM 1903 OE1 GLN B 5 -8.729 -4.734 18.288 1.00 49.86 O ATOM 1904 NE2 GLN B 5 -9.750 -6.711 17.980 1.00 52.95 N ATOM 1905 H GLN B 5 -4.600 -4.732 16.007 1.00 30.74 H ATOM 1906 HA GLN B 5 -6.116 -6.448 14.748 1.00 35.18 H ATOM 1907 HB2 GLN B 5 -6.424 -5.878 17.006 1.00 38.42 H ATOM 1908 HB3 GLN B 5 -6.932 -4.444 16.559 1.00 38.42 H ATOM 1909 HG2 GLN B 5 -8.787 -5.393 15.598 1.00 45.02 H ATOM 1910 HG3 GLN B 5 -8.275 -6.838 16.034 1.00 45.02 H ATOM 1911 HE21 GLN B 5 -9.862 -7.399 17.476 1.00 63.53 H ATOM 1912 HE22 GLN B 5 -10.156 -6.662 18.737 1.00 63.53 H ATOM 1913 N THR B 6 -6.683 -3.379 13.963 1.00 23.91 N ATOM 1914 CA THR B 6 -7.388 -2.587 12.965 1.00 24.02 C ATOM 1915 C THR B 6 -6.731 -2.704 11.593 1.00 26.56 C ATOM 1916 O THR B 6 -7.431 -2.635 10.573 1.00 27.81 O ATOM 1917 CB THR B 6 -7.511 -1.116 13.404 1.00 27.25 C ATOM 1918 OG1 THR B 6 -6.247 -0.454 13.348 1.00 28.25 O ATOM 1919 CG2 THR B 6 -8.080 -1.046 14.812 1.00 30.43 C ATOM 1920 H THR B 6 -6.235 -2.930 14.544 1.00 28.70 H ATOM 1921 HA THR B 6 -8.289 -2.937 12.881 1.00 28.83 H ATOM 1922 HB THR B 6 -8.129 -0.662 12.811 1.00 32.70 H ATOM 1923 HG1 THR B 6 -5.949 -0.471 12.563 1.00 33.90 H ATOM 1924 HG21 THR B 6 -8.158 -0.120 15.092 1.00 36.51 H ATOM 1925 HG22 THR B 6 -8.957 -1.458 14.835 1.00 36.51 H ATOM 1926 HG23 THR B 6 -7.495 -1.513 15.429 1.00 36.51 H ATOM 1927 N ALA B 7 -5.405 -2.910 11.537 1.00 21.85 N ATOM 1928 CA ALA B 7 -4.736 -3.096 10.256 1.00 20.98 C ATOM 1929 C ALA B 7 -5.133 -4.416 9.627 1.00 22.61 C ATOM 1930 O ALA B 7 -5.275 -4.512 8.409 1.00 23.89 O ATOM 1931 CB ALA B 7 -3.220 -3.055 10.421 1.00 23.52 C ATOM 1932 H ALA B 7 -4.884 -2.946 12.220 1.00 26.22 H ATOM 1933 HA ALA B 7 -4.996 -2.382 9.653 1.00 25.18 H ATOM 1934 HB1 ALA B 7 -2.804 -3.181 9.553 1.00 28.23 H ATOM 1935 HB2 ALA B 7 -2.966 -2.193 10.788 1.00 28.23 H ATOM 1936 HB3 ALA B 7 -2.949 -3.764 11.024 1.00 28.23 H ATOM 1937 N ARG B 8 -5.280 -5.449 10.438 1.00 25.57 N ATOM 1938 CA ARG B 8 -5.732 -6.716 9.903 1.00 26.56 C ATOM 1939 C ARG B 8 -7.067 -6.532 9.185 1.00 28.26 C ATOM 1940 O ARG B 8 -7.256 -7.006 8.059 1.00 28.48 O ATOM 1941 CB ARG B 8 -5.822 -7.728 11.048 1.00 32.00 C ATOM 1942 CG ARG B 8 -6.173 -9.105 10.643 1.00 34.45 C ATOM 1943 CD ARG B 8 -6.362 -9.939 11.880 1.00 39.31 C ATOM 1944 NE ARG B 8 -5.149 -10.015 12.703 1.00 36.30 N ATOM 1945 CZ ARG B 8 -5.077 -9.683 13.991 1.00 36.56 C ATOM 1946 NH1 ARG B 8 -6.145 -9.232 14.639 1.00 39.61 N ATOM 1947 NH2 ARG B 8 -3.927 -9.826 14.649 1.00 34.43 N ATOM 1948 H ARG B 8 -5.128 -5.443 11.284 1.00 30.68 H ATOM 1949 HA ARG B 8 -5.083 -7.042 9.259 1.00 31.87 H ATOM 1950 HB2 ARG B 8 -4.962 -7.764 11.495 1.00 38.40 H ATOM 1951 HB3 ARG B 8 -6.500 -7.426 11.672 1.00 38.40 H ATOM 1952 HG2 ARG B 8 -7.002 -9.099 10.140 1.00 41.34 H ATOM 1953 HG3 ARG B 8 -5.453 -9.486 10.116 1.00 41.34 H ATOM 1954 HD2 ARG B 8 -7.067 -9.549 12.419 1.00 47.17 H ATOM 1955 HD3 ARG B 8 -6.604 -10.842 11.619 1.00 47.17 H ATOM 1956 HE ARG B 8 -4.430 -10.296 12.325 1.00 43.56 H ATOM 1957 HH11 ARG B 8 -6.895 -9.146 14.226 1.00 47.53 H ATOM 1958 HH12 ARG B 8 -6.086 -9.019 15.470 1.00 47.53 H ATOM 1959 HH21 ARG B 8 -3.229 -10.114 14.237 1.00 41.32 H ATOM 1960 HH22 ARG B 8 -3.876 -9.603 15.478 1.00 41.32 H ATOM 1961 N LYS B 9 -7.989 -5.794 9.810 1.00 27.75 N ATOM 1962 CA LYS B 9 -9.322 -5.604 9.247 1.00 29.46 C ATOM 1963 C LYS B 9 -9.300 -4.695 8.025 1.00 32.11 C ATOM 1964 O LYS B 9 -9.920 -4.999 7.002 1.00 34.44 O ATOM 1965 CB LYS B 9 -10.242 -5.019 10.324 1.00 34.17 C ATOM 1966 CG LYS B 9 -11.721 -5.286 10.098 1.00 45.89 C ATOM 1967 CD LYS B 9 -12.543 -4.917 11.331 1.00 46.22 C ATOM 1968 CE LYS B 9 -13.951 -5.508 11.250 1.00 53.43 C ATOM 1969 NZ LYS B 9 -13.942 -7.009 11.277 1.00 57.32 N ATOM 1970 H LYS B 9 -7.865 -5.394 10.561 1.00 33.30 H ATOM 1971 HA LYS B 9 -9.680 -6.465 8.978 1.00 35.35 H ATOM 1972 HB2 LYS B 9 -10.001 -5.404 11.181 1.00 41.01 H ATOM 1973 HB3 LYS B 9 -10.117 -4.058 10.351 1.00 41.01 H ATOM 1974 HG2 LYS B 9 -12.034 -4.751 9.352 1.00 55.06 H ATOM 1975 HG3 LYS B 9 -11.853 -6.229 9.915 1.00 55.06 H ATOM 1976 HD2 LYS B 9 -12.109 -5.268 12.124 1.00 55.46 H ATOM 1977 HD3 LYS B 9 -12.620 -3.951 11.389 1.00 55.46 H ATOM 1978 HE2 LYS B 9 -14.470 -5.197 12.008 1.00 64.12 H ATOM 1979 HE3 LYS B 9 -14.368 -5.224 10.422 1.00 64.12 H ATOM 1980 HZ1 LYS B 9 -14.774 -7.320 11.228 1.00 68.79 H ATOM 1981 HZ2 LYS B 9 -13.476 -7.323 10.586 1.00 68.79 H ATOM 1982 HZ3 LYS B 9 -13.569 -7.298 12.032 1.00 68.79 H ATOM 1983 N SER B 10 -8.603 -3.561 8.113 1.00 26.59 N ATOM 1984 CA SER B 10 -8.645 -2.579 7.036 1.00 27.20 C ATOM 1985 C SER B 10 -7.879 -3.045 5.808 1.00 28.13 C ATOM 1986 O SER B 10 -8.190 -2.632 4.681 1.00 30.25 O ATOM 1987 CB SER B 10 -8.111 -1.229 7.536 1.00 34.06 C ATOM 1988 OG SER B 10 -6.768 -1.315 7.967 1.00 32.18 O ATOM 1989 H SER B 10 -8.104 -3.341 8.778 1.00 31.90 H ATOM 1990 HA SER B 10 -9.569 -2.449 6.772 1.00 32.64 H ATOM 1991 HB2 SER B 10 -8.165 -0.585 6.813 1.00 40.87 H ATOM 1992 HB3 SER B 10 -8.659 -0.934 8.281 1.00 40.87 H ATOM 1993 HG SER B 10 -6.703 -1.868 8.597 1.00 38.61 H ATOM 1994 N THR B 11 -6.918 -3.942 5.979 1.00 27.36 N ATOM 1995 CA THR B 11 -6.165 -4.401 4.823 1.00 25.58 C ATOM 1996 C THR B 11 -7.006 -5.311 3.941 1.00 29.53 C ATOM 1997 O THR B 11 -6.925 -5.226 2.714 1.00 33.17 O ATOM 1998 CB THR B 11 -4.893 -5.108 5.287 1.00 27.33 C ATOM 1999 OG1 THR B 11 -4.106 -4.183 6.052 1.00 25.98 O ATOM 2000 CG2 THR B 11 -4.085 -5.601 4.111 1.00 27.24 C ATOM 2001 H THR B 11 -6.688 -4.292 6.730 1.00 32.84 H ATOM 2002 HA THR B 11 -5.903 -3.632 4.293 1.00 30.70 H ATOM 2003 HB THR B 11 -5.129 -5.869 5.840 1.00 32.79 H ATOM 2004 HG1 THR B 11 -4.541 -3.919 6.720 1.00 31.17 H ATOM 2005 HG21 THR B 11 -3.282 -6.047 4.424 1.00 32.69 H ATOM 2006 HG22 THR B 11 -4.609 -6.228 3.588 1.00 32.69 H ATOM 2007 HG23 THR B 11 -3.831 -4.854 3.546 1.00 32.69 H ATOM 2008 N GLY B 12 -7.827 -6.166 4.545 1.00 25.35 N ATOM 2009 CA GLY B 12 -8.588 -7.172 3.838 1.00 28.45 C ATOM 2010 C GLY B 12 -7.943 -8.543 3.961 1.00 27.28 C ATOM 2011 O GLY B 12 -6.748 -8.686 4.231 1.00 25.99 O ATOM 2012 H GLY B 12 -7.959 -6.177 5.395 1.00 30.42 H ATOM 2013 HA2 GLY B 12 -9.486 -7.217 4.202 1.00 34.14 H ATOM 2014 HA3 GLY B 12 -8.645 -6.938 2.898 1.00 34.14 H ATOM 2015 N GLY B 13 -8.743 -9.579 3.764 1.00 26.29 N ATOM 2016 CA GLY B 13 -8.251 -10.920 3.977 1.00 26.05 C ATOM 2017 C GLY B 13 -7.192 -11.397 2.993 1.00 24.65 C ATOM 2018 O GLY B 13 -7.173 -10.983 1.845 1.00 22.10 O ATOM 2019 H GLY B 13 -9.563 -9.530 3.510 1.00 31.55 H ATOM 2020 HA2 GLY B 13 -7.873 -10.976 4.869 1.00 31.27 H ATOM 2021 HA3 GLY B 13 -8.998 -11.538 3.931 1.00 31.27 H HETATM 2022 C BTK B 14 -6.152 -13.945 1.697 1.00 24.06 C HETATM 2023 N BTK B 14 -6.321 -12.283 3.451 1.00 22.56 N HETATM 2024 O BTK B 14 -7.257 -14.445 2.030 1.00 23.48 O HETATM 2025 CA BTK B 14 -5.402 -12.946 2.565 1.00 21.21 C HETATM 2026 CB BTK B 14 -4.287 -13.747 3.207 1.00 21.33 C HETATM 2027 CD BTK B 14 -2.270 -13.568 4.545 1.00 29.33 C HETATM 2028 CE BTK B 14 -1.578 -12.750 5.625 1.00 33.24 C HETATM 2029 CG BTK B 14 -3.457 -12.806 4.050 1.00 28.50 C HETATM 2030 NZ BTK B 14 -0.766 -11.730 5.074 1.00 27.69 N HETATM 2031 CAA BTK B 14 3.318 -9.513 3.782 1.00 26.22 C HETATM 2032 OAD BTK B 14 0.945 -13.146 4.566 1.00 35.35 O HETATM 2033 CAF BTK B 14 2.640 -10.713 4.391 1.00 31.32 C HETATM 2034 CAJ BTK B 14 1.180 -10.712 4.059 1.00 34.86 C HETATM 2035 CAN BTK B 14 0.477 -11.971 4.583 1.00 30.07 C HETATM 2036 H BTK B 14 -6.214 -12.570 4.405 1.00 27.08 H HETATM 2037 HA BTK B 14 -4.956 -12.171 1.868 1.00 25.46 H HETATM 2038 HB2 BTK B 14 -3.653 -14.241 2.426 1.00 25.60 H HETATM 2039 HB3 BTK B 14 -4.749 -14.546 3.847 1.00 25.60 H HETATM 2040 HD2 BTK B 14 -1.566 -13.773 3.696 1.00 35.19 H HETATM 2041 HD3 BTK B 14 -2.597 -14.557 4.960 1.00 35.19 H HETATM 2042 HE2 BTK B 14 -0.925 -13.436 6.239 1.00 39.89 H HETATM 2043 HE3 BTK B 14 -2.354 -12.293 6.306 1.00 39.89 H HETATM 2044 HG2 BTK B 14 -4.061 -12.422 4.913 1.00 34.20 H HETATM 2045 HG3 BTK B 14 -3.125 -11.922 3.443 1.00 34.20 H HETATM 2046 HNZ BTK B 14 -1.115 -10.804 5.083 1.00 33.23 H HETATM 2047 HAA BTK B 14 3.201 -9.529 2.671 1.00 31.46 H HETATM 2048 HAAA BTK B 14 2.871 -8.565 4.169 1.00 31.46 H HETATM 2049 HAAB BTK B 14 4.409 -9.509 4.021 1.00 31.46 H HETATM 2050 HAF BTK B 14 3.108 -11.659 4.012 1.00 37.58 H HETATM 2051 HAFA BTK B 14 2.769 -10.710 5.505 1.00 37.58 H HETATM 2052 HAJ BTK B 14 0.691 -9.808 4.510 1.00 41.83 H HETATM 2053 HAJA BTK B 14 1.046 -10.651 2.946 1.00 41.83 H ATOM 2054 N ALA B 15 -5.566 -14.241 0.544 1.00 18.89 N ATOM 2055 CA ALA B 15 -6.175 -15.197 -0.372 1.00 23.38 C ATOM 2056 C ALA B 15 -6.121 -16.586 0.264 1.00 25.45 C ATOM 2057 O ALA B 15 -5.308 -16.836 1.155 1.00 24.76 O ATOM 2058 CB ALA B 15 -5.476 -15.188 -1.722 1.00 23.11 C ATOM 2059 H ALA B 15 -4.823 -13.905 0.269 1.00 22.66 H ATOM 2060 HA ALA B 15 -7.106 -14.962 -0.510 1.00 28.05 H ATOM 2061 HB1 ALA B 15 -5.906 -15.834 -2.304 1.00 27.74 H ATOM 2062 HB2 ALA B 15 -5.544 -14.300 -2.106 1.00 27.74 H ATOM 2063 HB3 ALA B 15 -4.544 -15.424 -1.596 1.00 27.74 H ATOM 2064 N PRO B 16 -7.010 -17.485 -0.152 1.00 27.47 N ATOM 2065 CA PRO B 16 -7.003 -18.836 0.422 1.00 27.65 C ATOM 2066 C PRO B 16 -5.633 -19.487 0.298 1.00 25.77 C ATOM 2067 O PRO B 16 -5.005 -19.454 -0.764 1.00 27.19 O ATOM 2068 CB PRO B 16 -8.066 -19.571 -0.401 1.00 35.54 C ATOM 2069 CG PRO B 16 -9.035 -18.487 -0.776 1.00 29.55 C ATOM 2070 CD PRO B 16 -8.165 -17.268 -1.034 1.00 27.45 C ATOM 2071 HA PRO B 16 -7.271 -18.812 1.354 1.00 33.18 H ATOM 2072 HB2 PRO B 16 -7.661 -19.963 -1.190 1.00 42.64 H ATOM 2073 HB3 PRO B 16 -8.497 -20.248 0.144 1.00 42.64 H ATOM 2074 HG2 PRO B 16 -9.518 -18.742 -1.578 1.00 35.46 H ATOM 2075 HG3 PRO B 16 -9.647 -18.324 -0.041 1.00 35.46 H ATOM 2076 HD2 PRO B 16 -7.883 -17.243 -1.962 1.00 32.94 H ATOM 2077 HD3 PRO B 16 -8.635 -16.457 -0.783 1.00 32.94 H ATOM 2078 N ARG B 17 -5.160 -20.063 1.406 1.00 30.06 N ATOM 2079 CA ARG B 17 -3.795 -20.584 1.449 1.00 33.36 C ATOM 2080 C ARG B 17 -3.557 -21.682 0.425 1.00 33.18 C ATOM 2081 O ARG B 17 -2.442 -21.805 -0.098 1.00 31.25 O ATOM 2082 CB ARG B 17 -3.476 -21.117 2.838 1.00 41.98 C ATOM 2083 CG ARG B 17 -3.450 -20.052 3.899 1.00 41.88 C ATOM 2084 CD ARG B 17 -3.613 -20.688 5.269 1.00 49.02 C ATOM 2085 NE ARG B 17 -5.014 -21.016 5.552 1.00 52.03 N ATOM 2086 CZ ARG B 17 -5.411 -21.757 6.584 1.00 48.45 C ATOM 2087 NH1 ARG B 17 -4.512 -22.252 7.419 1.00 45.79 N ATOM 2088 NH2 ARG B 17 -6.702 -22.006 6.777 1.00 48.48 N ATOM 2089 H ARG B 17 -5.604 -20.163 2.136 1.00 36.07 H ATOM 2090 HA ARG B 17 -3.177 -19.860 1.258 1.00 40.03 H ATOM 2091 HB2 ARG B 17 -4.152 -21.767 3.087 1.00 50.38 H ATOM 2092 HB3 ARG B 17 -2.603 -21.540 2.819 1.00 50.38 H ATOM 2093 HG2 ARG B 17 -2.599 -19.587 3.873 1.00 50.25 H ATOM 2094 HG3 ARG B 17 -4.182 -19.432 3.756 1.00 50.25 H ATOM 2095 HD2 ARG B 17 -3.097 -21.509 5.303 1.00 58.83 H ATOM 2096 HD3 ARG B 17 -3.303 -20.069 5.948 1.00 58.83 H ATOM 2097 HE ARG B 17 -5.609 -20.763 4.985 1.00 62.44 H ATOM 2098 HH11 ARG B 17 -3.676 -22.091 7.295 1.00 54.94 H ATOM 2099 HH12 ARG B 17 -4.763 -22.733 8.086 1.00 54.94 H ATOM 2100 HH21 ARG B 17 -7.287 -21.686 6.233 1.00 58.18 H ATOM 2101 HH22 ARG B 17 -6.952 -22.488 7.443 1.00 58.18 H ATOM 2102 N LYS B 18 -4.573 -22.499 0.138 1.00 29.76 N ATOM 2103 CA LYS B 18 -4.406 -23.544 -0.865 1.00 31.82 C ATOM 2104 C LYS B 18 -4.162 -22.935 -2.227 1.00 35.76 C ATOM 2105 O LYS B 18 -3.411 -23.487 -3.039 1.00 35.81 O ATOM 2106 CB LYS B 18 -5.634 -24.447 -0.917 1.00 34.20 C ATOM 2107 CG LYS B 18 -5.705 -25.449 0.207 1.00 40.01 C ATOM 2108 CD LYS B 18 -6.929 -26.324 0.062 1.00 40.38 C ATOM 2109 CE LYS B 18 -7.700 -26.420 1.377 1.00 49.41 C ATOM 2110 NZ LYS B 18 -6.850 -26.885 2.508 1.00 45.11 N ATOM 2111 H LYS B 18 -5.351 -22.469 0.503 1.00 35.72 H ATOM 2112 HA LYS B 18 -3.637 -24.089 -0.634 1.00 38.18 H ATOM 2113 HB2 LYS B 18 -6.430 -23.895 -0.871 1.00 41.05 H ATOM 2114 HB3 LYS B 18 -5.624 -24.940 -1.752 1.00 41.05 H ATOM 2115 HG2 LYS B 18 -4.918 -26.016 0.184 1.00 48.01 H ATOM 2116 HG3 LYS B 18 -5.761 -24.981 1.054 1.00 48.01 H ATOM 2117 HD2 LYS B 18 -7.518 -25.944 -0.610 1.00 48.45 H ATOM 2118 HD3 LYS B 18 -6.656 -27.218 -0.197 1.00 48.45 H ATOM 2119 HE2 LYS B 18 -8.049 -25.544 1.604 1.00 59.29 H ATOM 2120 HE3 LYS B 18 -8.430 -27.050 1.271 1.00 59.29 H ATOM 2121 HZ1 LYS B 18 -7.334 -26.928 3.254 1.00 54.13 H ATOM 2122 HZ2 LYS B 18 -6.522 -27.693 2.329 1.00 54.13 H ATOM 2123 HZ3 LYS B 18 -6.174 -26.320 2.633 1.00 54.13 H ATOM 2124 N GLN B 19 -4.791 -21.788 -2.496 1.00 28.19 N ATOM 2125 CA GLN B 19 -4.576 -21.138 -3.778 1.00 31.62 C ATOM 2126 C GLN B 19 -3.170 -20.553 -3.861 1.00 28.34 C ATOM 2127 O GLN B 19 -2.552 -20.581 -4.933 1.00 35.19 O ATOM 2128 CB GLN B 19 -5.654 -20.086 -3.990 1.00 26.73 C ATOM 2129 CG GLN B 19 -7.051 -20.738 -4.190 1.00 25.04 C ATOM 2130 CD GLN B 19 -8.226 -19.752 -4.250 1.00 28.68 C ATOM 2131 OE1 GLN B 19 -9.305 -20.007 -3.669 1.00 30.20 O ATOM 2132 NE2 GLN B 19 -8.051 -18.655 -4.977 1.00 26.09 N ATOM 2133 H GLN B 19 -5.331 -21.380 -1.966 1.00 33.83 H ATOM 2134 HA GLN B 19 -4.664 -21.799 -4.483 1.00 37.94 H ATOM 2135 HB2 GLN B 19 -5.696 -19.509 -3.211 1.00 32.08 H ATOM 2136 HB3 GLN B 19 -5.445 -19.567 -4.782 1.00 32.08 H ATOM 2137 HG2 GLN B 19 -7.043 -21.235 -5.023 1.00 30.05 H ATOM 2138 HG3 GLN B 19 -7.216 -21.345 -3.451 1.00 30.05 H ATOM 2139 HE21 GLN B 19 -7.306 -18.524 -5.386 1.00 31.31 H ATOM 2140 HE22 GLN B 19 -8.683 -18.075 -5.038 1.00 31.31 H ATOM 2141 N LEU B 20 -2.639 -20.052 -2.737 1.00 26.10 N ATOM 2142 CA LEU B 20 -1.264 -19.534 -2.725 1.00 26.84 C ATOM 2143 C LEU B 20 -0.249 -20.656 -2.943 1.00 36.49 C ATOM 2144 O LEU B 20 0.730 -20.482 -3.682 1.00 40.05 O ATOM 2145 CB LEU B 20 -0.991 -18.810 -1.408 1.00 29.63 C ATOM 2146 CG LEU B 20 0.401 -18.211 -1.134 1.00 32.74 C ATOM 2147 CD1 LEU B 20 0.709 -17.038 -2.059 1.00 31.84 C ATOM 2148 CD2 LEU B 20 0.479 -17.745 0.316 1.00 30.73 C ATOM 2149 H LEU B 20 -3.047 -20.002 -1.981 1.00 31.32 H ATOM 2150 HA LEU B 20 -1.162 -18.893 -3.446 1.00 32.21 H ATOM 2151 HB2 LEU B 20 -1.623 -18.077 -1.343 1.00 35.55 H ATOM 2152 HB3 LEU B 20 -1.167 -19.437 -0.689 1.00 35.55 H ATOM 2153 HG LEU B 20 1.077 -18.894 -1.271 1.00 39.29 H ATOM 2154 HD11 LEU B 20 1.592 -16.695 -1.850 1.00 38.21 H ATOM 2155 HD12 LEU B 20 0.682 -17.347 -2.978 1.00 38.21 H ATOM 2156 HD13 LEU B 20 0.043 -16.346 -1.922 1.00 38.21 H ATOM 2157 HD21 LEU B 20 1.358 -17.369 0.480 1.00 36.87 H ATOM 2158 HD22 LEU B 20 -0.202 -17.071 0.467 1.00 36.87 H ATOM 2159 HD23 LEU B 20 0.329 -18.504 0.901 1.00 36.87 H ATOM 2160 N ALA B 21 -0.473 -21.815 -2.317 1.00 38.45 N ATOM 2161 CA ALA B 21 0.413 -22.963 -2.516 1.00 39.18 C ATOM 2162 C ALA B 21 0.311 -23.495 -3.939 1.00 37.94 C ATOM 2163 O ALA B 21 1.313 -23.924 -4.523 1.00 45.94 O ATOM 2164 CB ALA B 21 0.080 -24.063 -1.509 1.00 40.04 C ATOM 2165 H ALA B 21 -1.125 -21.960 -1.776 1.00 46.14 H ATOM 2166 HA ALA B 21 1.329 -22.685 -2.365 1.00 47.01 H ATOM 2167 HB1 ALA B 21 0.675 -24.815 -1.654 1.00 48.05 H ATOM 2168 HB2 ALA B 21 0.199 -23.715 -0.611 1.00 48.05 H ATOM 2169 HB3 ALA B 21 -0.841 -24.339 -1.636 1.00 48.05 H ATOM 2170 N THR B 22 -0.887 -23.477 -4.517 1.00 36.11 N ATOM 2171 CA THR B 22 -1.044 -23.890 -5.908 1.00 38.38 C ATOM 2172 C THR B 22 -0.259 -22.985 -6.843 1.00 49.24 C ATOM 2173 O THR B 22 0.277 -23.448 -7.860 1.00 48.75 O ATOM 2174 CB THR B 22 -2.525 -23.887 -6.290 1.00 44.41 C ATOM 2175 OG1 THR B 22 -3.145 -25.072 -5.777 1.00 37.91 O ATOM 2176 CG2 THR B 22 -2.716 -23.825 -7.809 1.00 45.41 C ATOM 2177 H THR B 22 -1.615 -23.233 -4.132 1.00 43.34 H ATOM 2178 HA THR B 22 -0.707 -24.794 -6.010 1.00 46.06 H ATOM 2179 HB THR B 22 -2.953 -23.108 -5.899 1.00 53.29 H ATOM 2180 HG1 THR B 22 -3.073 -25.095 -4.940 1.00 45.49 H ATOM 2181 HG21 THR B 22 -3.662 -23.824 -8.025 1.00 54.49 H ATOM 2182 HG22 THR B 22 -2.311 -23.017 -8.161 1.00 54.49 H ATOM 2183 HG23 THR B 22 -2.299 -24.594 -8.227 1.00 54.49 H ATOM 2184 N LYS B 23 -0.206 -21.681 -6.537 1.00 46.29 N ATOM 2185 CA LYS B 23 0.533 -20.768 -7.398 1.00 47.45 C ATOM 2186 C LYS B 23 2.026 -20.838 -7.124 1.00 47.64 C ATOM 2187 O LYS B 23 2.831 -20.645 -8.044 1.00 54.80 O ATOM 2188 CB LYS B 23 0.037 -19.332 -7.226 1.00 43.21 C ATOM 2189 CG LYS B 23 0.834 -18.326 -8.063 1.00 43.99 C ATOM 2190 CD LYS B 23 -0.060 -17.302 -8.706 1.00 42.15 C ATOM 2191 CE LYS B 23 0.730 -16.318 -9.579 1.00 43.12 C ATOM 2192 NZ LYS B 23 1.260 -16.954 -10.824 1.00 51.99 N ATOM 2193 H LYS B 23 -0.581 -21.315 -5.854 1.00 55.55 H ATOM 2194 HA LYS B 23 0.388 -21.023 -8.323 1.00 56.94 H ATOM 2195 HB2 LYS B 23 -0.891 -19.283 -7.501 1.00 51.85 H ATOM 2196 HB3 LYS B 23 0.121 -19.079 -6.293 1.00 51.85 H ATOM 2197 HG2 LYS B 23 1.463 -17.861 -7.490 1.00 52.78 H ATOM 2198 HG3 LYS B 23 1.307 -18.799 -8.766 1.00 52.78 H ATOM 2199 HD2 LYS B 23 -0.708 -17.753 -9.270 1.00 50.58 H ATOM 2200 HD3 LYS B 23 -0.514 -16.795 -8.014 1.00 50.58 H ATOM 2201 HE2 LYS B 23 0.148 -15.587 -9.839 1.00 51.74 H ATOM 2202 HE3 LYS B 23 1.484 -15.979 -9.071 1.00 51.74 H ATOM 2203 HZ1 LYS B 23 1.711 -16.354 -11.303 1.00 62.39 H ATOM 2204 HZ2 LYS B 23 1.805 -17.626 -10.615 1.00 62.39 H ATOM 2205 HZ3 LYS B 23 0.587 -17.269 -11.315 1.00 62.39 H ATOM 2206 N ALA B 24 2.412 -21.103 -5.876 1.00 46.31 N ATOM 2207 CA ALA B 24 3.814 -21.307 -5.548 1.00 47.67 C ATOM 2208 C ALA B 24 4.377 -22.585 -6.151 1.00 56.59 C ATOM 2209 O ALA B 24 5.602 -22.753 -6.165 1.00 61.12 O ATOM 2210 CB ALA B 24 3.995 -21.328 -4.033 1.00 47.76 C ATOM 2211 H ALA B 24 1.879 -21.170 -5.204 1.00 55.58 H ATOM 2212 HA ALA B 24 4.328 -20.562 -5.899 1.00 57.20 H ATOM 2213 HB1 ALA B 24 4.934 -21.464 -3.829 1.00 57.31 H ATOM 2214 HB2 ALA B 24 3.697 -20.480 -3.667 1.00 57.31 H ATOM 2215 HB3 ALA B 24 3.467 -22.053 -3.662 1.00 57.31 H ATOM 2216 N ALA B 25 3.524 -23.483 -6.640 1.00 54.53 N ATOM 2217 CA ALA B 25 3.976 -24.709 -7.287 1.00 53.82 C ATOM 2218 C ALA B 25 3.653 -24.681 -8.780 1.00 54.91 C ATOM 2219 O ALA B 25 4.205 -25.466 -9.557 1.00 57.07 O ATOM 2220 CB ALA B 25 3.339 -25.917 -6.632 1.00 51.56 C ATOM 2221 H ALA B 25 2.668 -23.403 -6.609 1.00 65.44 H ATOM 2222 HA ALA B 25 4.938 -24.784 -7.188 1.00 64.58 H ATOM 2223 HB1 ALA B 25 3.653 -26.720 -7.077 1.00 61.87 H ATOM 2224 HB2 ALA B 25 3.591 -25.938 -5.695 1.00 61.87 H ATOM 2225 HB3 ALA B 25 2.375 -25.849 -6.714 1.00 61.87 H TER 2226 ALA B 25 HETATM 2227 ZN ZN A 401 8.093 5.453 12.982 1.00 23.32 ZN HETATM 2228 ZN ZN A 402 6.462 -3.487 23.922 1.00 24.79 ZN HETATM 2229 ZN ZN A 403 -1.338 -8.039 -4.408 1.00 20.18 ZN HETATM 2230 ZN ZN A 404 5.635 -12.203 8.618 1.00 18.77 ZN HETATM 2231 S SO4 B 101 -7.991 -20.230 3.899 1.00 59.01 S HETATM 2232 O1 SO4 B 101 -8.091 -21.252 2.850 1.00 56.17 O HETATM 2233 O2 SO4 B 101 -8.934 -19.131 3.620 1.00 50.29 O HETATM 2234 O3 SO4 B 101 -8.294 -20.830 5.205 1.00 59.25 O HETATM 2235 O4 SO4 B 101 -6.621 -19.711 3.928 1.00 48.56 O HETATM 2236 O HOH A 501 9.087 8.962 28.838 1.00 43.95 O HETATM 2237 O HOH A 502 -0.548 1.952 28.741 1.00 39.03 O HETATM 2238 O HOH A 503 15.462 -1.913 10.200 1.00 31.89 O HETATM 2239 O HOH A 504 8.331 9.541 5.059 1.00 47.47 O HETATM 2240 O HOH A 505 2.758 -14.829 6.783 1.00 35.63 O HETATM 2241 O HOH A 506 11.721 12.205 7.383 1.00 56.43 O HETATM 2242 O HOH A 507 2.094 8.389 4.055 1.00 39.47 O HETATM 2243 O HOH A 508 11.230 -18.205 -2.436 1.00 37.57 O HETATM 2244 O HOH A 509 -14.325 12.543 16.250 1.00 54.30 O HETATM 2245 O HOH A 510 5.281 9.404 19.297 1.00 36.16 O HETATM 2246 O HOH A 511 9.278 -7.598 -6.126 1.00 24.35 O HETATM 2247 O HOH A 512 4.836 -11.908 26.862 1.00 30.92 O HETATM 2248 O HOH A 513 13.218 -21.241 -3.371 1.00 42.74 O HETATM 2249 O HOH A 514 7.458 -4.859 -11.070 1.00 32.86 O HETATM 2250 O HOH A 515 12.956 -14.549 12.370 1.00 40.86 O HETATM 2251 O HOH A 516 1.542 -3.180 8.811 1.00 30.41 O HETATM 2252 O HOH A 517 12.146 -3.059 15.405 1.00 36.55 O HETATM 2253 O HOH A 518 8.318 -11.757 14.664 1.00 32.12 O HETATM 2254 O HOH A 519 -3.010 -4.294 -5.849 1.00 26.01 O HETATM 2255 O HOH A 520 9.590 -1.576 26.672 1.00 43.42 O HETATM 2256 O HOH A 521 3.395 -14.345 0.078 1.00 17.78 O HETATM 2257 O HOH A 522 17.861 -1.301 7.082 1.00 40.96 O HETATM 2258 O HOH A 523 -0.562 -1.354 22.662 1.00 30.92 O HETATM 2259 O HOH A 524 10.661 -9.598 -2.203 1.00 32.10 O HETATM 2260 O HOH A 525 -7.599 -11.925 -0.812 1.00 22.70 O HETATM 2261 O HOH A 526 8.495 -3.044 15.296 1.00 19.27 O HETATM 2262 O HOH A 527 10.349 -18.120 3.284 1.00 35.14 O HETATM 2263 O HOH A 528 0.181 4.333 4.214 1.00 29.72 O HETATM 2264 O HOH A 529 4.242 8.325 23.138 1.00 32.13 O HETATM 2265 O HOH A 530 11.894 -11.072 14.698 1.00 35.89 O HETATM 2266 O HOH A 531 12.646 -16.083 10.315 1.00 36.23 O HETATM 2267 O HOH A 532 13.578 2.607 0.125 1.00 39.76 O HETATM 2268 O HOH A 533 12.208 -14.919 -3.853 1.00 30.48 O HETATM 2269 O HOH A 534 9.177 -4.050 12.987 1.00 21.56 O HETATM 2270 O HOH A 535 11.330 -6.677 5.237 1.00 21.72 O HETATM 2271 O HOH A 536 2.527 9.454 29.668 1.00 32.59 O HETATM 2272 O HOH A 537 6.906 5.226 19.937 1.00 27.92 O HETATM 2273 O HOH A 538 -1.172 4.364 7.451 1.00 37.47 O HETATM 2274 O HOH A 539 -1.986 10.384 16.562 1.00 25.88 O HETATM 2275 O HOH A 540 -1.476 -3.367 5.746 1.00 21.32 O HETATM 2276 O HOH A 541 -3.176 -13.252 15.185 1.00 36.52 O HETATM 2277 O HOH A 542 11.978 -11.653 3.439 1.00 22.02 O HETATM 2278 O HOH A 543 7.224 -11.711 -7.977 1.00 24.39 O HETATM 2279 O HOH A 544 7.708 3.150 27.988 1.00 39.41 O HETATM 2280 O HOH A 545 1.094 1.152 -5.882 1.00 45.81 O HETATM 2281 O HOH A 546 4.274 0.370 -4.981 1.00 28.41 O HETATM 2282 O HOH A 547 -6.988 -2.535 18.499 1.00 34.91 O HETATM 2283 O HOH A 548 5.503 10.083 -3.134 1.00 49.78 O HETATM 2284 O HOH A 549 12.446 -6.319 12.241 1.00 26.19 O HETATM 2285 O HOH A 550 -3.185 8.929 23.664 1.00 28.19 O HETATM 2286 O HOH A 551 -4.512 0.426 -2.456 1.00 37.30 O HETATM 2287 O HOH A 552 10.376 3.243 24.519 1.00 34.33 O HETATM 2288 O HOH A 553 9.098 -1.322 9.564 1.00 22.65 O HETATM 2289 O HOH A 554 6.832 7.555 5.512 1.00 34.82 O HETATM 2290 O HOH A 555 -7.224 -8.535 0.391 1.00 22.62 O HETATM 2291 O HOH A 556 -1.693 2.025 -1.493 1.00 39.48 O HETATM 2292 O HOH A 557 1.074 6.124 6.128 1.00 36.33 O HETATM 2293 O HOH A 558 11.674 -10.925 -7.933 1.00 39.23 O HETATM 2294 O HOH A 559 11.236 -2.432 11.291 1.00 26.36 O HETATM 2295 O HOH A 560 -2.100 -10.640 17.891 1.00 39.95 O HETATM 2296 O HOH A 561 7.095 -1.186 -8.202 1.00 30.44 O HETATM 2297 O HOH A 562 6.367 -1.400 -4.899 1.00 31.59 O HETATM 2298 O HOH A 563 -8.666 6.752 21.665 1.00 38.94 O HETATM 2299 O HOH A 564 -3.641 5.817 10.754 1.00 33.26 O HETATM 2300 O HOH A 565 -8.147 7.444 14.800 1.00 46.90 O HETATM 2301 O HOH A 566 2.001 2.594 -2.656 1.00 37.74 O HETATM 2302 O HOH A 567 0.446 9.580 -0.057 1.00 40.44 O HETATM 2303 O HOH A 568 -6.265 -3.720 -2.950 1.00 31.36 O HETATM 2304 O HOH A 569 -4.249 3.017 4.200 1.00 41.46 O HETATM 2305 O HOH A 570 11.311 -5.859 17.890 1.00 34.16 O HETATM 2306 O HOH A 571 10.678 -7.603 -3.733 1.00 30.29 O HETATM 2307 O HOH A 572 7.924 -3.516 10.581 1.00 18.06 O HETATM 2308 O HOH A 573 6.755 4.080 -3.159 1.00 35.92 O HETATM 2309 O HOH A 574 13.166 4.150 6.238 1.00 40.90 O HETATM 2310 O HOH A 575 9.528 8.126 2.231 1.00 34.18 O HETATM 2311 O HOH A 576 -5.575 9.797 22.738 1.00 26.53 O HETATM 2312 O HOH A 577 15.612 -20.311 2.710 1.00 40.71 O HETATM 2313 O HOH A 578 2.508 -10.324 27.633 1.00 33.77 O HETATM 2314 O HOH A 579 1.267 -7.480 6.642 1.00 20.66 O HETATM 2315 O HOH A 580 13.756 -18.500 4.942 1.00 27.04 O HETATM 2316 O HOH A 581 1.846 -7.299 25.271 1.00 39.58 O HETATM 2317 O HOH A 582 -7.770 3.462 24.057 1.00 42.74 O HETATM 2318 O HOH A 583 18.303 -7.277 8.762 1.00 35.40 O HETATM 2319 O HOH A 584 4.040 8.435 5.900 1.00 40.09 O HETATM 2320 O HOH A 585 -3.741 -9.515 21.731 1.00 35.14 O HETATM 2321 O HOH A 586 12.417 5.921 11.281 1.00 42.52 O HETATM 2322 O HOH A 587 12.522 1.936 24.538 1.00 44.69 O HETATM 2323 O HOH A 588 1.612 9.886 20.683 1.00 37.58 O HETATM 2324 O HOH A 589 4.389 -7.996 26.092 1.00 39.65 O HETATM 2325 O HOH A 590 11.299 -1.982 -5.123 1.00 48.43 O HETATM 2326 O HOH A 591 15.388 4.210 10.970 1.00 42.17 O HETATM 2327 O HOH A 592 -3.475 -11.876 8.954 1.00 33.37 O HETATM 2328 O HOH A 593 5.808 7.450 21.070 1.00 32.32 O HETATM 2329 O HOH A 594 -1.539 -12.679 22.031 1.00 29.32 O HETATM 2330 O HOH A 595 16.118 -14.272 11.967 1.00 39.81 O HETATM 2331 O HOH A 596 8.741 2.305 -3.583 1.00 38.80 O HETATM 2332 O HOH A 597 1.674 -13.609 16.054 1.00 33.73 O HETATM 2333 O HOH A 598 -2.460 0.161 5.559 1.00 36.31 O HETATM 2334 O HOH A 599 10.448 -18.220 7.988 1.00 42.40 O HETATM 2335 O HOH A 600 -9.382 10.370 21.120 1.00 53.92 O HETATM 2336 O HOH A 601 11.346 -5.883 14.943 1.00 35.33 O HETATM 2337 O HOH A 602 -1.291 2.184 5.905 1.00 37.86 O HETATM 2338 O HOH A 603 0.803 -12.629 -11.557 1.00 42.02 O HETATM 2339 O HOH A 604 2.042 -11.335 30.518 1.00 50.79 O HETATM 2340 O HOH A 605 0.333 -10.882 8.332 1.00 27.03 O HETATM 2341 O HOH A 606 11.119 -4.478 -1.313 1.00 40.09 O HETATM 2342 O HOH A 607 9.522 1.211 27.264 1.00 41.62 O HETATM 2343 O HOH A 608 10.845 -5.629 1.246 1.00 34.63 O HETATM 2344 O HOH A 609 12.378 5.512 7.833 1.00 42.96 O HETATM 2345 O HOH A 610 0.822 -12.673 19.383 1.00 34.97 O HETATM 2346 O HOH A 611 2.612 0.430 -9.392 1.00 48.91 O HETATM 2347 O HOH A 612 3.613 12.190 17.421 1.00 45.20 O HETATM 2348 O HOH A 613 11.757 -7.301 0.845 1.00 31.87 O HETATM 2349 O HOH A 614 -6.805 1.845 25.511 1.00 43.48 O HETATM 2350 O HOH A 615 -8.382 -7.787 -8.788 1.00 40.38 O HETATM 2351 O HOH A 616 9.552 -0.236 -7.301 1.00 53.31 O HETATM 2352 O HOH A 617 13.086 -9.023 2.880 1.00 31.54 O HETATM 2353 O HOH A 618 3.229 -14.603 11.800 1.00 24.55 O HETATM 2354 O HOH A 619 14.058 -4.053 17.673 1.00 57.46 O HETATM 2355 O HOH A 620 4.092 2.733 -3.725 1.00 35.74 O HETATM 2356 O HOH A 621 -10.290 11.946 21.856 1.00 43.01 O HETATM 2357 O HOH A 622 7.215 8.522 -2.569 1.00 45.94 O HETATM 2358 O HOH A 623 13.828 5.796 3.837 1.00 40.28 O HETATM 2359 O HOH A 624 10.949 -18.941 5.106 1.00 43.08 O HETATM 2360 O HOH A 625 4.331 8.551 31.059 1.00 43.48 O HETATM 2361 O HOH A 626 8.256 11.234 3.526 1.00 51.53 O HETATM 2362 O HOH A 627 7.349 -1.945 -11.052 1.00 46.61 O HETATM 2363 O HOH A 628 5.762 -6.038 26.912 1.00 41.57 O HETATM 2364 O HOH A 629 -5.267 -2.548 -5.400 1.00 35.35 O HETATM 2365 O HOH A 630 7.500 6.516 -4.311 1.00 41.45 O HETATM 2366 O HOH A 631 8.435 -19.040 8.626 1.00 46.41 O HETATM 2367 O HOH A 632 8.187 -13.318 -9.949 1.00 36.85 O HETATM 2368 O HOH A 633 15.157 4.931 1.257 1.00 44.94 O HETATM 2369 O HOH A 634 10.207 -11.521 -4.154 1.00 32.83 O HETATM 2370 O HOH A 635 -9.542 -5.734 -7.568 1.00 43.11 O HETATM 2371 O HOH A 636 -1.310 -16.835 3.266 1.00 33.60 O HETATM 2372 O HOH A 637 0.932 -4.672 6.620 1.00 20.82 O HETATM 2373 O HOH A 638 10.331 -20.323 1.904 1.00 44.27 O HETATM 2374 O HOH A 639 4.850 0.891 -7.885 1.00 41.33 O HETATM 2375 O HOH A 640 9.137 9.184 -0.336 1.00 37.90 O HETATM 2376 O HOH A 641 9.326 -10.574 -6.569 1.00 25.38 O HETATM 2377 O HOH A 642 -7.747 -2.490 -6.967 1.00 43.49 O HETATM 2378 O HOH A 643 8.864 -19.700 -3.023 1.00 45.10 O HETATM 2379 O HOH A 644 3.730 4.361 -6.130 1.00 42.31 O HETATM 2380 O HOH B 201 -6.962 -22.707 1.917 1.00 37.78 O HETATM 2381 O HOH B 202 -8.925 -16.717 2.880 1.00 40.57 O HETATM 2382 O HOH B 203 -0.553 -9.527 6.491 1.00 32.93 O HETATM 2383 O HOH B 204 -1.039 4.469 13.495 1.00 24.34 O HETATM 2384 O HOH B 205 -4.887 -0.945 6.118 1.00 43.44 O HETATM 2385 O HOH B 206 -5.537 -17.272 3.929 1.00 37.53 O HETATM 2386 O HOH B 207 -5.695 -6.159 0.536 1.00 23.09 O HETATM 2387 O HOH B 208 -9.926 -16.712 -4.818 1.00 24.01 O HETATM 2388 O HOH B 209 -5.605 -8.840 6.679 1.00 27.77 O HETATM 2389 O HOH B 210 -11.901 -6.193 5.559 1.00 40.91 O HETATM 2390 O HOH B 211 -1.926 -1.155 7.562 1.00 34.11 O HETATM 2391 O HOH B 212 0.868 -10.806 17.221 1.00 34.80 O HETATM 2392 O HOH B 213 -9.080 -7.435 13.347 1.00 37.24 O HETATM 2393 O HOH B 214 -2.566 -16.222 0.867 1.00 27.80 O HETATM 2394 O HOH B 215 -9.191 -8.637 6.796 1.00 36.99 O HETATM 2395 O HOH B 216 -0.060 -21.434 1.396 1.00 34.17 O HETATM 2396 O HOH B 217 -6.508 -13.275 6.121 1.00 33.48 O HETATM 2397 O HOH B 218 -6.255 0.247 10.328 1.00 33.21 O HETATM 2398 O HOH B 219 -12.173 -19.670 -3.590 1.00 23.54 O HETATM 2399 O HOH B 220 -2.899 -26.338 -2.814 1.00 38.87 O HETATM 2400 O HOH B 221 -10.063 -1.303 10.493 1.00 34.89 O HETATM 2401 O HOH B 222 -6.534 -24.237 3.822 1.00 46.02 O HETATM 2402 O HOH B 223 -9.637 0.030 4.101 1.00 52.53 O HETATM 2403 O HOH B 224 -10.636 -14.825 1.037 1.00 36.74 O HETATM 2404 O HOH B 225 -1.130 -21.151 7.587 1.00 44.74 O HETATM 2405 O HOH B 226 -9.396 -13.969 -0.811 1.00 28.49 O HETATM 2406 O HOH B 227 -11.330 -1.218 8.460 1.00 43.77 O HETATM 2407 O HOH B 228 -11.897 -11.124 4.785 1.00 43.23 O HETATM 2408 O HOH B 229 -9.893 -8.824 10.729 1.00 44.01 O HETATM 2409 O HOH B 230 4.189 -23.146 -12.519 1.00 53.97 O HETATM 2410 O HOH B 231 -11.744 -8.377 6.626 1.00 42.52 O HETATM 2411 O HOH B 232 0.198 -13.857 8.329 1.00 32.77 O HETATM 2412 O HOH B 233 2.222 -21.432 0.495 1.00 43.83 O HETATM 2413 O HOH B 234 -3.049 -9.530 7.396 1.00 37.54 O HETATM 2414 O HOH B 235 -0.451 -23.647 2.980 1.00 44.96 O HETATM 2415 O HOH B 236 -12.495 -9.806 8.556 1.00 48.12 O HETATM 2416 O HOH B 237 -3.053 -17.173 5.347 1.00 40.85 O HETATM 2417 O HOH B 238 -5.872 -11.324 8.054 1.00 31.58 O HETATM 2418 O HOH B 239 -8.374 -11.234 9.314 1.00 44.26 O HETATM 2419 O HOH B 240 -11.360 -1.606 13.063 1.00 47.68 O HETATM 2420 O HOH B 241 -2.073 -27.135 -0.123 1.00 37.75 O HETATM 2421 O HOH B 242 -0.405 -19.334 3.768 1.00 43.93 O HETATM 2422 O HOH B 243 -11.741 0.232 14.398 1.00 47.35 O HETATM 2423 O HOH B 244 4.548 -23.403 -14.860 1.00 57.57 O CONECT 247 2229 CONECT 288 2229 CONECT 582 2230 CONECT 614 2230 CONECT 664 2229 CONECT 705 2229 CONECT 1021 2230 CONECT 1065 2230 CONECT 1111 2228 CONECT 1143 2228 CONECT 1341 2227 CONECT 1374 2227 CONECT 1448 2228 CONECT 1496 2228 CONECT 1734 2227 CONECT 1780 2227 CONECT 2017 2023 CONECT 2022 2024 2025 2054 CONECT 2023 2017 2025 2036 CONECT 2024 2022 CONECT 2025 2022 2023 2026 2037 CONECT 2026 2025 2029 2038 2039 CONECT 2027 2028 2029 2040 2041 CONECT 2028 2027 2030 2042 2043 CONECT 2029 2026 2027 2044 2045 CONECT 2030 2028 2035 2046 CONECT 2031 2033 2047 2048 2049 CONECT 2032 2035 CONECT 2033 2031 2034 2050 2051 CONECT 2034 2033 2035 2052 2053 CONECT 2035 2030 2032 2034 CONECT 2036 2023 CONECT 2037 2025 CONECT 2038 2026 CONECT 2039 2026 CONECT 2040 2027 CONECT 2041 2027 CONECT 2042 2028 CONECT 2043 2028 CONECT 2044 2029 CONECT 2045 2029 CONECT 2046 2030 CONECT 2047 2031 CONECT 2048 2031 CONECT 2049 2031 CONECT 2050 2033 CONECT 2051 2033 CONECT 2052 2034 CONECT 2053 2034 CONECT 2054 2022 CONECT 2227 1341 1374 1734 1780 CONECT 2228 1111 1143 1448 1496 CONECT 2229 247 288 664 705 CONECT 2230 582 614 1021 1065 CONECT 2231 2232 2233 2234 2235 CONECT 2232 2231 CONECT 2233 2231 CONECT 2234 2231 CONECT 2235 2231 MASTER 331 0 6 6 5 0 6 6 1311 2 59 13 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5b75
Complex Type
Protein-Protein
PDBbind Subset
general set
Protein Name
MOZ double PHD finger, MOZDPF
Ligand Name
histone H3 butyrylation at K14, H3(1-25)K14bu
EC.Number
E.C.2.3.1.48
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
Kd=10uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Nat.Chem.Biol. Vol. 12: pp. 1111-1118
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):
Q92794
K7EMV3
Entrez Gene ID
NCBI Entrez Gene ID:
7994
ASD
Information of known allosteric effects of PDB entries
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