USER MOD reduce.3.24.130724 H: found=0, std=0, add=3959, rem=0, adj=112 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER ISOMERASE 12-MAY-09 3HFK TITLE CRYSTAL STRUCTURE OF 4-METHYLMUCONOLACTONE METHYLISOMERASE (H52A) IN TITLE 2 COMPLEX WITH 4-METHYLMUCONOLACTONE COMPND MOL_ID: 1; COMPND 2 MOLECULE: 4-METHYLMUCONOLACTONE METHYLISOMERASE; COMPND 3 CHAIN: A, B, C, D; COMPND 4 EC: 5.4.99.14; COMPND 5 ENGINEERED: YES; COMPND 6 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS REINEKEI; SOURCE 3 ORGANISM_TAXID: 395598; SOURCE 4 STRAIN: MT1; SOURCE 5 GENE: MMLI; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: JM109; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: PASKIBAMMLI KEYWDS FERREDOXIN, FERREDOXIN-LIKE FOLD, BETA-BARREL, ISOMERASE, 4- KEYWDS 2 METHYLMUCONOLACTONE METHYLISOMERASE, H52A, BIODEGRADATION, ORTHO- KEYWDS 3 CLEAVAGE EXPDTA X-RAY DIFFRACTION AUTHOR M.MARIN,D.W.HEINZ,D.H.PIEPER,B.U.KLINK REVDAT 2 22-JAN-14 3HFK 1 JRNL VERSN REVDAT 1 29-SEP-09 3HFK 0 JRNL AUTH M.MARIN,D.W.HEINZ,D.H.PIEPER,B.U.KLINK JRNL TITL CRYSTAL STRUCTURE AND CATALYTIC MECHANISM OF JRNL TITL 2 4-METHYLMUCONOLACTONE METHYLISOMERASE JRNL REF J.BIOL.CHEM. V. 284 32709 2009 JRNL REFN ISSN 0021-9258 JRNL PMID 19801657 JRNL DOI 10.1074/JBC.M109.024604 REMARK 2 REMARK 2 RESOLUTION. 1.90 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.5.0063 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.90 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 40.62 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 99.3 REMARK 3 NUMBER OF REFLECTIONS : 39116 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.187 REMARK 3 R VALUE (WORKING SET) : 0.185 REMARK 3 FREE R VALUE : 0.231 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 2079 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.90 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.95 REMARK 3 REFLECTION IN BIN (WORKING SET) : 2760 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 95.98 REMARK 3 BIN R VALUE (WORKING SET) : 0.3080 REMARK 3 BIN FREE R VALUE SET COUNT : 131 REMARK 3 BIN FREE R VALUE : 0.3670 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3685 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 77 REMARK 3 SOLVENT ATOMS : 518 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 19.01 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.20000 REMARK 3 B22 (A**2) : 0.65000 REMARK 3 B33 (A**2) : -0.85000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.165 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.152 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.100 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 3.380 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.945 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.913 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 4094 ; 0.017 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 5570 ; 1.579 ; 1.971 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 498 ; 5.722 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 208 ;33.453 ;23.269 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 731 ;14.581 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 32 ;18.881 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 561 ; 0.113 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 3204 ; 0.009 ; 0.021 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 2338 ; 0.969 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 3813 ; 1.683 ; 2.000 REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 1756 ; 2.580 ; 3.000 REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 1737 ; 4.049 ; 4.500 REMARK 3 SIDE-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 3HFK COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 15-MAY-09. REMARK 100 THE RCSB ID CODE IS RCSB053073. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 21-APR-09 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ESRF REMARK 200 BEAMLINE : ID14-4 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.97900 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 : XDS REMARK 200 DATA SCALING SOFTWARE : XSCALE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 41197 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.900 REMARK 200 RESOLUTION RANGE LOW (A) : 75.240 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.4 REMARK 200 DATA REDUNDANCY : 7.230 REMARK 200 R MERGE (I) : 0.11300 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 14.7100 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.90 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.00 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.0 REMARK 200 DATA REDUNDANCY IN SHELL : 7.15 REMARK 200 R MERGE FOR SHELL (I) : 0.56400 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 3.500 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: NULL REMARK 200 STARTING MODEL: PDB ENTRY 3HDS REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 48.77 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.40 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 25% PEG 1500, 0.1M MMT, HANGING DROP, REMARK 280 TEMPERATURE 292K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 2 2 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -X,Y,-Z+1/2 REMARK 290 4555 X,-Y,-Z REMARK 290 5555 X+1/2,Y+1/2,Z REMARK 290 6555 -X+1/2,-Y+1/2,Z+1/2 REMARK 290 7555 -X+1/2,Y+1/2,-Z+1/2 REMARK 290 8555 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 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 75.23500 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 75.23500 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 41.08500 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 42.18000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 6 -1.000000 0.000000 0.000000 41.08500 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 42.18000 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 75.23500 REMARK 290 SMTRY1 7 -1.000000 0.000000 0.000000 41.08500 REMARK 290 SMTRY2 7 0.000000 1.000000 0.000000 42.18000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 75.23500 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 41.08500 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 42.18000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2 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: 4310 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 10850 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -26.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, D REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 4360 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 10820 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -26.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: B, C 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 PRO A -8 REMARK 465 PRO C -8 REMARK 465 GLN C -7 REMARK 465 PHE C -6 REMARK 465 GLU C -5 REMARK 465 LYS C -4 REMARK 465 ILE C -3 REMARK 465 GLU C -2 REMARK 465 PRO D -8 REMARK 465 GLN D -7 REMARK 465 PHE D -6 REMARK 465 GLU D -5 REMARK 465 LYS D -4 REMARK 465 ILE D -3 REMARK 465 GLU D -2 REMARK 465 GLY D -1 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 OE1 GLU C 105 O HOH C 217 1.90 REMARK 500 OE1 GLU B 40 O HOH B 280 1.99 REMARK 500 OE1 GLU A 104 O HOH A 177 2.10 REMARK 500 O HOH C 268 O HOH C 316 2.12 REMARK 500 OE2 GLU B 40 O HOH C 217 2.15 REMARK 500 O ARG C 0 O HOH C 508 2.15 REMARK 500 OE2 GLU A 40 O HOH A 291 2.15 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 NE2 GLN A -7 O HOH C 175 1655 2.17 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 ASP D 50 42.97 -79.04 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH B 408 DISTANCE = 5.05 ANGSTROMS REMARK 525 HOH C 430 DISTANCE = 5.79 ANGSTROMS REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 4ML A 201 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 4ML A 202 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 4ML B 201 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 4ML B 202 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 4ML C 201 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 4ML C 202 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 4ML D 201 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3HDS RELATED DB: PDB REMARK 900 THE WILDTYPE PROTEIN COMPLEXED WITH A MES BUFFER MOLECULE REMARK 900 RELATED ID: 3HF5 RELATED DB: PDB REMARK 900 THE WILDTYPE PROTEIN COMPLEXED WITH 3-METHYLMUCONOLACTONE DBREF 3HFK A 1 107 UNP C5MR76 C5MR76_9PSED 1 107 DBREF 3HFK B 1 107 UNP C5MR76 C5MR76_9PSED 1 107 DBREF 3HFK C 1 107 UNP C5MR76 C5MR76_9PSED 1 107 DBREF 3HFK D 1 107 UNP C5MR76 C5MR76_9PSED 1 107 SEQADV 3HFK PRO A -8 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLN A -7 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK PHE A -6 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLU A -5 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK LYS A -4 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK ILE A -3 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLU A -2 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLY A -1 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK ARG A 0 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK ALA A 52 UNP C5MR76 HIS 52 ENGINEERED SEQADV 3HFK PRO B -8 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLN B -7 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK PHE B -6 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLU B -5 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK LYS B -4 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK ILE B -3 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLU B -2 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLY B -1 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK ARG B 0 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK ALA B 52 UNP C5MR76 HIS 52 ENGINEERED SEQADV 3HFK PRO C -8 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLN C -7 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK PHE C -6 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLU C -5 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK LYS C -4 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK ILE C -3 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLU C -2 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLY C -1 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK ARG C 0 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK ALA C 52 UNP C5MR76 HIS 52 ENGINEERED SEQADV 3HFK PRO D -8 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLN D -7 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK PHE D -6 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLU D -5 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK LYS D -4 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK ILE D -3 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLU D -2 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK GLY D -1 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK ARG D 0 UNP C5MR76 EXPRESSION TAG SEQADV 3HFK ALA D 52 UNP C5MR76 HIS 52 ENGINEERED SEQRES 1 A 116 PRO GLN PHE GLU LYS ILE GLU GLY ARG MET ILE ARG ILE SEQRES 2 A 116 LEU TYR LEU LEU VAL LYS PRO GLU SER MET SER HIS GLU SEQRES 3 A 116 GLN PHE ARG LYS GLU CYS VAL VAL HIS PHE GLN MET SER SEQRES 4 A 116 ALA GLY MET PRO GLY LEU HIS LYS TYR GLU VAL ARG LEU SEQRES 5 A 116 VAL ALA GLY ASN PRO THR ASP THR ALA VAL PRO TYR LEU SEQRES 6 A 116 ASP VAL GLY ARG ILE ASP ALA ILE GLY GLU CYS TRP PHE SEQRES 7 A 116 ALA SER GLU GLU GLN TYR GLN VAL TYR MET GLU SER ASP SEQRES 8 A 116 ILE ARG LYS ALA TRP PHE GLU HIS GLY LYS TYR PHE ILE SEQRES 9 A 116 GLY GLN LEU LYS PRO PHE VAL THR GLU GLU LEU VAL SEQRES 1 B 116 PRO GLN PHE GLU LYS ILE GLU GLY ARG MET ILE ARG ILE SEQRES 2 B 116 LEU TYR LEU LEU VAL LYS PRO GLU SER MET SER HIS GLU SEQRES 3 B 116 GLN PHE ARG LYS GLU CYS VAL VAL HIS PHE GLN MET SER SEQRES 4 B 116 ALA GLY MET PRO GLY LEU HIS LYS TYR GLU VAL ARG LEU SEQRES 5 B 116 VAL ALA GLY ASN PRO THR ASP THR ALA VAL PRO TYR LEU SEQRES 6 B 116 ASP VAL GLY ARG ILE ASP ALA ILE GLY GLU CYS TRP PHE SEQRES 7 B 116 ALA SER GLU GLU GLN TYR GLN VAL TYR MET GLU SER ASP SEQRES 8 B 116 ILE ARG LYS ALA TRP PHE GLU HIS GLY LYS TYR PHE ILE SEQRES 9 B 116 GLY GLN LEU LYS PRO PHE VAL THR GLU GLU LEU VAL SEQRES 1 C 116 PRO GLN PHE GLU LYS ILE GLU GLY ARG MET ILE ARG ILE SEQRES 2 C 116 LEU TYR LEU LEU VAL LYS PRO GLU SER MET SER HIS GLU SEQRES 3 C 116 GLN PHE ARG LYS GLU CYS VAL VAL HIS PHE GLN MET SER SEQRES 4 C 116 ALA GLY MET PRO GLY LEU HIS LYS TYR GLU VAL ARG LEU SEQRES 5 C 116 VAL ALA GLY ASN PRO THR ASP THR ALA VAL PRO TYR LEU SEQRES 6 C 116 ASP VAL GLY ARG ILE ASP ALA ILE GLY GLU CYS TRP PHE SEQRES 7 C 116 ALA SER GLU GLU GLN TYR GLN VAL TYR MET GLU SER ASP SEQRES 8 C 116 ILE ARG LYS ALA TRP PHE GLU HIS GLY LYS TYR PHE ILE SEQRES 9 C 116 GLY GLN LEU LYS PRO PHE VAL THR GLU GLU LEU VAL SEQRES 1 D 116 PRO GLN PHE GLU LYS ILE GLU GLY ARG MET ILE ARG ILE SEQRES 2 D 116 LEU TYR LEU LEU VAL LYS PRO GLU SER MET SER HIS GLU SEQRES 3 D 116 GLN PHE ARG LYS GLU CYS VAL VAL HIS PHE GLN MET SER SEQRES 4 D 116 ALA GLY MET PRO GLY LEU HIS LYS TYR GLU VAL ARG LEU SEQRES 5 D 116 VAL ALA GLY ASN PRO THR ASP THR ALA VAL PRO TYR LEU SEQRES 6 D 116 ASP VAL GLY ARG ILE ASP ALA ILE GLY GLU CYS TRP PHE SEQRES 7 D 116 ALA SER GLU GLU GLN TYR GLN VAL TYR MET GLU SER ASP SEQRES 8 D 116 ILE ARG LYS ALA TRP PHE GLU HIS GLY LYS TYR PHE ILE SEQRES 9 D 116 GLY GLN LEU LYS PRO PHE VAL THR GLU GLU LEU VAL HET 4ML A 201 11 HET 4ML A 202 11 HET 4ML B 201 11 HET 4ML B 202 11 HET 4ML C 201 11 HET 4ML C 202 11 HET 4ML D 201 11 HETNAM 4ML [(2S)-2-METHYL-5-OXO-2,5-DIHYDROFURAN-2-YL]ACETIC ACID HETSYN 4ML 4-METHYLMUCONOLACTONE FORMUL 5 4ML 7(C7 H8 O4) FORMUL 12 HOH *518(H2 O) HELIX 1 1 GLN A -7 ARG A 0 1 8 HELIX 2 2 SER A 15 MET A 29 1 15 HELIX 3 3 SER A 71 SER A 81 1 11 HELIX 4 4 SER A 81 ILE A 95 1 15 HELIX 5 5 PRO B -8 ARG B 0 1 9 HELIX 6 6 SER B 15 ALA B 31 1 17 HELIX 7 7 SER B 71 SER B 81 1 11 HELIX 8 8 SER B 81 ILE B 95 1 15 HELIX 9 9 SER C 15 SER C 30 1 16 HELIX 10 10 SER C 71 SER C 81 1 11 HELIX 11 11 SER C 81 ILE C 95 1 15 HELIX 12 12 SER D 15 SER D 30 1 16 HELIX 13 13 SER D 71 SER D 81 1 11 HELIX 14 14 SER D 81 ILE D 95 1 15 SHEET 1 A 9 ILE A 2 VAL A 9 0 SHEET 2 A 9 ALA A 63 PHE A 69 -1 O GLY A 65 N TYR A 6 SHEET 3 A 9 LYS A 38 GLY A 46 -1 N ARG A 42 O ILE A 64 SHEET 4 A 9 GLN D 97 GLU D 105 -1 O VAL D 102 N ALA A 45 SHEET 5 A 9 ILE D 2 VAL D 9 -1 N LEU D 5 O PHE D 101 SHEET 6 A 9 ALA D 63 PHE D 69 -1 O GLY D 65 N TYR D 6 SHEET 7 A 9 LYS D 38 GLY D 46 -1 N ARG D 42 O ILE D 64 SHEET 8 A 9 GLN A 97 GLU A 105 -1 N VAL A 102 O ALA D 45 SHEET 9 A 9 ILE A 2 VAL A 9 -1 N LEU A 5 O PHE A 101 SHEET 1 B 9 ILE B 2 VAL B 9 0 SHEET 2 B 9 ALA B 63 PHE B 69 -1 O GLY B 65 N TYR B 6 SHEET 3 B 9 LYS B 38 GLY B 46 -1 N ARG B 42 O ILE B 64 SHEET 4 B 9 GLN C 97 GLU C 105 -1 O VAL C 102 N ALA B 45 SHEET 5 B 9 ILE C 2 VAL C 9 -1 N LEU C 7 O LYS C 99 SHEET 6 B 9 ALA C 63 PHE C 69 -1 O GLY C 65 N TYR C 6 SHEET 7 B 9 LYS C 38 GLY C 46 -1 N ARG C 42 O ILE C 64 SHEET 8 B 9 GLN B 97 GLU B 105 -1 N VAL B 102 O ALA C 45 SHEET 9 B 9 ILE B 2 VAL B 9 -1 N LEU B 5 O PHE B 101 SITE *** AC1 9 TYR A 6 HIS A 26 TYR A 39 TYR A 78 SITE *** AC1 9 TRP A 87 PHE A 88 GLY A 91 ILE A 95 SITE *** AC1 9 4ML A 202 SITE *** AC2 10 ILE A 4 TYR A 6 TYR A 78 MET A 79 SITE *** AC2 10 ARG A 84 PHE A 88 4ML A 201 PRO D 48 SITE *** AC2 10 THR D 51 ALA D 52 SITE *** AC3 9 TYR B 6 HIS B 26 TYR B 39 TYR B 78 SITE *** AC3 9 TRP B 87 PHE B 88 GLY B 91 ILE B 95 SITE *** AC3 9 4ML B 202 SITE *** AC4 10 TYR B 6 TYR B 78 MET B 79 ARG B 84 SITE *** AC4 10 PHE B 88 LEU B 98 4ML B 201 PRO C 48 SITE *** AC4 10 THR C 51 ALA C 52 SITE *** AC5 7 TYR C 6 LEU C 8 HIS C 26 TYR C 39 SITE *** AC5 7 CYS C 67 PHE C 88 GLY C 91 SITE *** AC6 8 THR B 51 ALA B 52 HOH B 482 ILE C 4 SITE *** AC6 8 TYR C 6 TYR C 75 PHE C 88 HOH C 123 SITE *** AC7 7 TYR D 6 LEU D 8 HIS D 26 TYR D 39 SITE *** AC7 7 CYS D 67 PHE D 88 GLY D 91 CRYST1 82.170 84.360 150.470 90.00 90.00 90.00 C 2 2 21 32 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 0.012170 0.000000 0.000000 0.00000 SCALE2 0.000000 0.011854 0.000000 0.00000 SCALE3 0.000000 0.000000 0.006646 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 201 4MLHOAB : A 201 4ML OAB : A 201 4ML CAI :(short bond) USER MOD NoAdj-H: A 202 4MLHOAB : A 202 4ML OAB : A 202 4ML CAI :(short bond) USER MOD NoAdj-H: B 201 4MLHOAB : B 201 4ML OAB : B 201 4ML CAI :(short bond) USER MOD NoAdj-H: B 202 4MLHOAB : B 202 4ML OAB : B 202 4ML CAI :(short bond) USER MOD NoAdj-H: C 201 4MLHOAB : C 201 4ML OAB : C 201 4ML CAI :(short bond) USER MOD NoAdj-H: C 202 4MLHOAB : C 202 4ML OAB : C 202 4ML CAI :(short bond) USER MOD NoAdj-H: D 201 4MLHOAB : D 201 4ML OAB : D 201 4ML CAI :(short bond) USER MOD Set 1.1: D 26 HIS : no HD1:sc= 0.722 K(o=3.6,f=-6.4!) USER MOD Set 1.2: D 39 TYR OH : rot 15:sc= 0.279 USER MOD Set 1.3: D 90 HIS : +bothHN:sc= 2.59 K(o=3.6,f=-12!) USER MOD Set 2.1: D 67 CYS SG : rot 180:sc= -0.122 USER MOD Set 2.2: D 78 TYR OH : rot -125:sc= 1.24 USER MOD Set 3.1: A 99 LYS NZ :NH3+ 179:sc= 2.12 (180deg=1.2) USER MOD Set 3.2: D 47 ASN : amide:sc= 1.93 K(o=4.5,f=-2.3!) USER MOD Set 3.3: D 55 TYR OH : rot 180:sc= 0.43 USER MOD Set 4.1: D 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: D 37 HIS : no HE2:sc= 1.3 K(o=1.3,f=-1.1) USER MOD Set 5.1: C 67 CYS SG : rot 180:sc= -0.129 USER MOD Set 5.2: C 78 TYR OH : rot -123:sc= 1.35 USER MOD Set 6.1: C 1 MET CE :methyl 151:sc= -0.288 (180deg=-0.937) USER MOD Set 6.2: C 37 HIS :FLIP no HE2:sc= 0.731 F(o=-0.59,f=0.44) USER MOD Set 7.1: C 26 HIS : no HD1:sc= 0.0357 K(o=3,f=-6.5!) USER MOD Set 7.2: C 39 TYR OH : rot 13:sc= 0.535 USER MOD Set 7.3: C 90 HIS : +bothHN:sc= 2.47 K(o=3,f=-13!) USER MOD Set 8.1: B 99 LYS NZ :NH3+ -168:sc= 1.53 (180deg=0.922) USER MOD Set 8.2: C 47 ASN : amide:sc= 2.57 K(o=5.7,f=-1.5!) USER MOD Set 8.3: C 55 TYR OH : rot -179:sc= 1.63 USER MOD Set 9.1: B 6 TYR OH : rot -40:sc= 1.34 USER MOD Set 9.2: B 67 CYS SG : rot 97:sc= 0.0871 USER MOD Set10.1: B 47 ASN : amide:sc= 2.44 K(o=6.1,f=-1.9!) USER MOD Set10.2: B 55 TYR OH : rot -146:sc= 1.57 USER MOD Set10.3: C 99 LYS NZ :NH3+ -173:sc= 2.06 (180deg=1.33) USER MOD Set11.1: B 26 HIS : no HD1:sc= 0.204 K(o=2.5,f=-7.5!) USER MOD Set11.2: B 39 TYR OH : rot 16:sc= 0.635 USER MOD Set11.3: B 90 HIS : +bothHN:sc= 1.67 K(o=2.5,f=-12!) USER MOD Set12.1: A 18 GLN : amide:sc= 3.07 K(o=3.9,f=3.1) USER MOD Set12.2: A 93 TYR OH : rot 30:sc= 0.85 USER MOD Set13.1: A 75 TYR OH : rot -79:sc= 0.895 USER MOD Set13.2: A 79 MET CE :methyl 180:sc=-0.00027 (180deg=0) USER MOD Set14.1: A 47 ASN : amide:sc= 2.15 K(o=4.3,f=2.6) USER MOD Set14.2: A 55 TYR OH : rot 180:sc= 0.697 USER MOD Set14.3: D 99 LYS NZ :NH3+ -110:sc= 1.44 (180deg=0.538) USER MOD Set15.1: A 26 HIS : no HD1:sc= 0.299 K(o=2.4,f=-4.4!) USER MOD Set15.2: A 39 TYR OH : rot 14:sc= 0.741 USER MOD Set15.3: A 90 HIS : +bothHN:sc= 1.38 K(o=2.4,f=-8.7!) USER MOD Set16.1: A 6 TYR OH : rot -36:sc= 1.22 USER MOD Set16.2: A 67 CYS SG : rot 92:sc= 0.0446 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -4 LYS NZ :NH3+ -162:sc= -0.113 (180deg=-0.349) USER MOD Single : A -7 GLN : amide:sc= -0.14 X(o=-0.14,f=-0.4) USER MOD Single : A -7 GLN N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 169:sc= 0.837 (180deg=0.698) USER MOD Single : A 13 SER OG : rot 73:sc= 1.02 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot -73:sc= 0.159 USER MOD Single : A 16 HIS : no HD1:sc= 1.4 K(o=1.4,f=-6.7!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 CYS SG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 1.06 K(o=1.1,f=-0.14) USER MOD Single : A 29 MET CE :methyl 158:sc= -0.299 (180deg=-0.876) USER MOD Single : A 30 SER OG : rot -50:sc= 2.31 USER MOD Single : A 33 MET CE :methyl 170:sc= -1.64 (180deg=-1.95) USER MOD Single : A 37 HIS : no HD1:sc= 1.31 K(o=1.3,f=-5!) USER MOD Single : A 38 LYS NZ :NH3+ -109:sc= 0.522 (180deg=-0.0916) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 64:sc= 1.29 USER MOD Single : A 71 SER OG : rot 178:sc= 1.45 USER MOD Single : A 74 GLN :FLIP amide:sc= 0.516 F(o=-0.025,f=0.52) USER MOD Single : A 76 GLN : amide:sc= -0.388 X(o=-0.39,f=-0.2) USER MOD Single : A 78 TYR OH : rot 173:sc= 0.685 USER MOD Single : A 81 SER OG : rot 40:sc= -0.678 USER MOD Single : A 85 LYS NZ :NH3+ -139:sc= -1.1 (180deg=-3.4!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 THR OG1 : rot -90:sc= -0.045 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B -4 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.0124) USER MOD Single : B -7 GLN : amide:sc= 0.49 K(o=0.49,f=-7.3!) USER MOD Single : B 10 LYS NZ :NH3+ 166:sc= 1.35 (180deg=1.11) USER MOD Single : B 13 SER OG : rot -88:sc= 0 USER MOD Single : B 14 MET CE :methyl -161:sc= -0.0549 (180deg=-0.395) USER MOD Single : B 15 SER OG : rot 180:sc= 0.0485 USER MOD Single : B 16 HIS A: no HD1:sc= 0.135 K(o=0.14,f=-0.88) USER MOD Single : B 16 HIS B: no HD1:sc= 0 X(o=0,f=0.13) USER MOD Single : B 18 GLN : amide:sc= 3.19 K(o=3.2,f=-0.15) USER MOD Single : B 21 LYS NZ :NH3+ 170:sc= 0.562 (180deg=0.521) USER MOD Single : B 23 CYS SG : rot 69:sc= 0.00487 USER MOD Single : B 28 GLN : amide:sc= 0.608 K(o=0.61,f=-0.22) USER MOD Single : B 29 MET CE :methyl 159:sc= -0.268 (180deg=-0.797) USER MOD Single : B 30 SER OG : rot -73:sc= 2.37 USER MOD Single : B 33 MET CE :methyl 169:sc= -1.27 (180deg=-1.75!) USER MOD Single : B 37 HIS : no HD1:sc= 1.17 K(o=1.2,f=-4.3!) USER MOD Single : B 38 LYS NZ :NH3+ -107:sc= 0.678 (180deg=0.0424) USER MOD Single : B 49 THR OG1 : rot 180:sc= 0 USER MOD Single : B 51 THR OG1 : rot 128:sc= 1.29 USER MOD Single : B 71 SER OG : rot 158:sc= 1.34 USER MOD Single : B 74 GLN : amide:sc= 0.971 K(o=0.97,f=0.29) USER MOD Single : B 75 TYR OH : rot -89:sc= 0.121 USER MOD Single : B 76 GLN : amide:sc= -0.45 K(o=-0.45,f=-1.1) USER MOD Single : B 78 TYR OH : rot 170:sc= 0.735 USER MOD Single : B 79 MET CE :methyl -173:sc= 0 (180deg=-0.105) USER MOD Single : B 81 SER OG : rot 61:sc= -0.358! USER MOD Single : B 85 LYS NZ :NH3+ 171:sc= 1.61 (180deg=1.52) USER MOD Single : B 92 LYS NZ :NH3+ 163:sc= 0.0285 (180deg=0.0068) USER MOD Single : B 93 TYR OH : rot 102:sc= 1.66 USER MOD Single : B 97 GLN : amide:sc= 2.19 K(o=2.2,f=-0.56!) USER MOD Single : B 103 THR OG1 : rot -51:sc= 0.19 USER MOD Single : C 6 TYR OH : rot 145:sc= -1.05 USER MOD Single : C -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 10 LYS NZ :NH3+ 165:sc= 1.44 (180deg=0.503!) USER MOD Single : C 13 SER OG : rot -115:sc= 2.38 USER MOD Single : C 14 MET CE :methyl -141:sc= -0.259 (180deg=-1.24) USER MOD Single : C 15 SER OG : rot 180:sc= 0.389 USER MOD Single : C 16 HIS :FLIP no HE2:sc= 0.828 F(o=-3!,f=0.83) USER MOD Single : C 18 GLN : amide:sc= 2.21 K(o=2.2,f=-0.9) USER MOD Single : C 21 LYS NZ A:NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 21 LYS NZ B:NH3+ -145:sc= -0.163 (180deg=-0.53) USER MOD Single : C 23 CYS SG : rot 67:sc= 0.0448 USER MOD Single : C 28 GLN : amide:sc= 1.63 K(o=1.6,f=-0.27) USER MOD Single : C 29 MET CE :methyl 178:sc= 0 (180deg=-0.00423) USER MOD Single : C 30 SER OG : rot -65:sc= 2.28 USER MOD Single : C 33 MET CE :methyl 163:sc= -0.98 (180deg=-1.63!) USER MOD Single : C 38 LYS NZ :NH3+ 147:sc= 1.82 (180deg=1.3) USER MOD Single : C 49 THR OG1 : rot 117:sc= 0.657 USER MOD Single : C 51 THR OG1 : rot 99:sc= 1.07 USER MOD Single : C 71 SER OG : rot -153:sc= 1.37 USER MOD Single : C 74 GLN : amide:sc= -0.223 X(o=-0.22,f=0.026) USER MOD Single : C 75 TYR OH : rot 23:sc= 2.51 USER MOD Single : C 76 GLN : amide:sc= 1.46 K(o=1.5,f=0.14) USER MOD Single : C 79 MET CE :methyl -165:sc= -0.0267 (180deg=-0.382) USER MOD Single : C 81 SER OG : rot 80:sc= -0.282 USER MOD Single : C 85 LYS NZ :NH3+ 166:sc= 0.99 (180deg=0.861) USER MOD Single : C 92 LYS NZ A:NH3+ 158:sc= -4.4! (180deg=-7.54!) USER MOD Single : C 92 LYS NZ B:NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 93 TYR OH : rot 180:sc= 0 USER MOD Single : C 97 GLN : amide:sc= 0.313 X(o=0.31,f=0.63) USER MOD Single : C 103 THR OG1 : rot -47:sc= 0.809 USER MOD Single : D 0 ARG N :NH3+ -129:sc= 0.0464 (180deg=0) USER MOD Single : D 6 TYR OH : rot 30:sc= 1.05 USER MOD Single : D 10 LYS NZ :NH3+ 167:sc= 1.47 (180deg=0.988) USER MOD Single : D 13 SER OG : rot 67:sc= 1.81 USER MOD Single : D 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 15 SER OG : rot -173:sc= -2.56! USER MOD Single : D 16 HIS A:FLIP no HE2:sc= 1.04 F(o=0.13,f=1) USER MOD Single : D 16 HIS B:FLIP no HD1:sc= 0.748 F(o=-3.2!,f=0.75) USER MOD Single : D 18 GLN A: amide:sc= 1.15 K(o=1.1,f=-2.5!) USER MOD Single : D 18 GLN B: amide:sc= -0.45 X(o=-0.45,f=-0.12) USER MOD Single : D 21 LYS NZ :NH3+ -176:sc= 0.995 (180deg=0.973) USER MOD Single : D 23 CYS SG : rot 180:sc=-0.00833 USER MOD Single : D 28 GLN : amide:sc= 2.1 K(o=2.1,f=-0.7!) USER MOD Single : D 29 MET CE :methyl 166:sc= 0 (180deg=-0.172) USER MOD Single : D 30 SER OG : rot -49:sc= 2.4 USER MOD Single : D 33 MET CE :methyl 180:sc= -0.773 (180deg=-0.773) USER MOD Single : D 38 LYS NZ :NH3+ 140:sc= 0.715 (180deg=0.146) USER MOD Single : D 49 THR OG1 : rot 180:sc= 0 USER MOD Single : D 51 THR OG1 : rot 82:sc= 1.32 USER MOD Single : D 71 SER OG : rot 162:sc= 1.54 USER MOD Single : D 74 GLN :FLIP amide:sc= 0.833 F(o=-1,f=0.83) USER MOD Single : D 75 TYR OH : rot -178:sc= 2.61 USER MOD Single : D 76 GLN : amide:sc= -0.269 X(o=-0.27,f=-0.5) USER MOD Single : D 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 81 SER OG : rot 130:sc= -0.163 USER MOD Single : D 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 92 LYS NZ :NH3+ 164:sc= 0.983 (180deg=0.804) USER MOD Single : D 93 TYR OH : rot 180:sc= 0 USER MOD Single : D 97 GLN :FLIP amide:sc= 1.25 F(o=0.52,f=1.3) USER MOD Single : D 103 THR OG1 : rot -53:sc= 0.874 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A -7 36.045 35.811 16.839 1.00 31.32 N ATOM 2 CA GLN A -7 36.098 35.469 15.378 1.00 30.71 C ATOM 3 C GLN A -7 36.297 33.966 15.089 1.00 28.92 C ATOM 4 O GLN A -7 35.683 33.428 14.153 1.00 28.59 O ATOM 5 CB GLN A -7 37.199 36.268 14.701 1.00 31.17 C ATOM 6 CG GLN A -7 37.141 36.187 13.194 1.00 34.94 C ATOM 7 CD GLN A -7 38.416 35.576 12.614 1.00 38.32 C ATOM 8 OE1 GLN A -7 39.544 35.829 13.083 1.00 42.03 O ATOM 9 NE2 GLN A -7 38.242 34.770 11.582 1.00 42.21 N ATOM 0 H1 GLN A -7 35.929 36.688 16.935 1.00 31.32 H new ATOM 0 H2 GLN A -7 35.367 35.379 17.221 1.00 31.32 H new ATOM 0 H3 GLN A -7 36.808 35.569 17.229 1.00 31.32 H new ATOM 0 HA GLN A -7 35.229 35.703 15.017 1.00 30.71 H new ATOM 0 HB2 GLN A -7 37.133 37.197 14.973 1.00 31.17 H new ATOM 0 HB3 GLN A -7 38.061 35.944 15.005 1.00 31.17 H new ATOM 0 HG2 GLN A -7 36.376 35.654 12.927 1.00 34.94 H new ATOM 0 HG3 GLN A -7 37.011 37.075 12.826 1.00 34.94 H new ATOM 0 HE21 GLN A -7 37.450 34.618 11.284 1.00 42.21 H new ATOM 0 HE22 GLN A -7 38.921 34.398 11.208 1.00 42.21 H new ATOM 10 N PHE A -6 37.154 33.300 15.872 1.00 26.81 N ATOM 11 CA PHE A -6 37.224 31.833 15.844 1.00 23.57 C ATOM 12 C PHE A -6 35.870 31.220 16.215 1.00 22.23 C ATOM 13 O PHE A -6 35.370 30.344 15.517 1.00 20.30 O ATOM 14 CB PHE A -6 38.325 31.266 16.740 1.00 23.31 C ATOM 15 CG PHE A -6 38.591 29.803 16.510 1.00 21.13 C ATOM 16 CD1 PHE A -6 39.549 29.401 15.608 1.00 21.83 C ATOM 17 CD2 PHE A -6 37.898 28.822 17.216 1.00 18.56 C ATOM 18 CE1 PHE A -6 39.801 28.054 15.411 1.00 19.47 C ATOM 19 CE2 PHE A -6 38.130 27.490 17.004 1.00 18.07 C ATOM 20 CZ PHE A -6 39.075 27.093 16.105 1.00 19.06 C ATOM 0 H PHE A -6 37.699 33.675 16.422 1.00 26.81 H new ATOM 0 HA PHE A -6 37.451 31.588 14.933 1.00 23.57 H new ATOM 0 HB2 PHE A -6 39.144 31.764 16.589 1.00 23.31 H new ATOM 0 HB3 PHE A -6 38.078 31.401 17.668 1.00 23.31 H new ATOM 0 HD1 PHE A -6 40.029 30.037 15.129 1.00 21.83 H new ATOM 0 HD2 PHE A -6 37.263 29.078 17.846 1.00 18.56 H new ATOM 0 HE1 PHE A -6 40.460 27.790 14.810 1.00 19.47 H new ATOM 0 HE2 PHE A -6 37.642 26.854 17.475 1.00 18.07 H new ATOM 0 HZ PHE A -6 39.232 26.188 15.958 1.00 19.06 H new ATOM 21 N GLU A -5 35.272 31.692 17.301 1.00 21.97 N ATOM 22 CA GLU A -5 33.937 31.220 17.682 1.00 23.08 C ATOM 23 C GLU A -5 32.858 31.446 16.620 1.00 21.76 C ATOM 24 O GLU A -5 31.940 30.635 16.475 1.00 20.09 O ATOM 25 CB GLU A -5 33.517 31.830 19.010 1.00 24.03 C ATOM 26 CG GLU A -5 34.111 31.061 20.145 1.00 31.71 C ATOM 27 CD GLU A -5 33.824 31.674 21.488 1.00 39.69 C ATOM 28 OE1 GLU A -5 32.783 32.380 21.613 1.00 40.88 O ATOM 29 OE2 GLU A -5 34.656 31.434 22.406 1.00 44.13 O ATOM 0 H GLU A -5 35.613 32.279 17.829 1.00 21.97 H new ATOM 0 HA GLU A -5 34.015 30.257 17.771 1.00 23.08 H new ATOM 0 HB2 GLU A -5 33.804 32.756 19.053 1.00 24.03 H new ATOM 0 HB3 GLU A -5 32.550 31.829 19.082 1.00 24.03 H new ATOM 0 HG2 GLU A -5 33.767 30.154 20.129 1.00 31.71 H new ATOM 0 HG3 GLU A -5 35.071 31.002 20.021 1.00 31.71 H new ATOM 30 N LYS A -4 32.968 32.547 15.878 1.00 21.60 N ATOM 31 CA LYS A -4 31.992 32.805 14.828 1.00 21.56 C ATOM 32 C LYS A -4 32.085 31.776 13.711 1.00 20.15 C ATOM 33 O LYS A -4 31.046 31.292 13.250 1.00 19.80 O ATOM 34 CB LYS A -4 32.120 34.220 14.263 1.00 22.46 C ATOM 35 CG LYS A -4 30.798 34.731 13.730 1.00 26.96 C ATOM 36 CD LYS A -4 30.705 36.264 13.819 1.00 35.32 C ATOM 37 CE LYS A -4 30.997 36.929 12.494 1.00 36.06 C ATOM 38 NZ LYS A -4 32.185 36.352 11.791 1.00 41.92 N ATOM 0 H LYS A -4 33.584 33.141 15.964 1.00 21.60 H new ATOM 0 HA LYS A -4 31.117 32.728 15.239 1.00 21.56 H new ATOM 0 HB2 LYS A -4 32.443 34.817 14.956 1.00 22.46 H new ATOM 0 HB3 LYS A -4 32.780 34.227 13.552 1.00 22.46 H new ATOM 0 HG2 LYS A -4 30.691 34.453 12.807 1.00 26.96 H new ATOM 0 HG3 LYS A -4 30.070 34.332 14.232 1.00 26.96 H new ATOM 0 HD2 LYS A -4 29.817 36.516 14.117 1.00 35.32 H new ATOM 0 HD3 LYS A -4 31.331 36.587 14.486 1.00 35.32 H new ATOM 0 HE2 LYS A -4 30.219 36.848 11.920 1.00 36.06 H new ATOM 0 HE3 LYS A -4 31.144 37.876 12.640 1.00 36.06 H new ATOM 0 HZ1 LYS A -4 32.470 36.923 11.171 1.00 41.92 H new ATOM 0 HZ2 LYS A -4 32.836 36.205 12.380 1.00 41.92 H new ATOM 0 HZ3 LYS A -4 31.957 35.584 11.404 1.00 41.92 H new ATOM 39 N ILE A -3 33.310 31.463 13.259 1.00 18.14 N ATOM 40 CA ILE A -3 33.501 30.469 12.192 1.00 18.34 C ATOM 41 C ILE A -3 33.067 29.109 12.692 1.00 15.87 C ATOM 42 O ILE A -3 32.461 28.323 11.966 1.00 15.89 O ATOM 43 CB ILE A -3 34.984 30.384 11.689 1.00 18.57 C ATOM 44 CG1 ILE A -3 35.531 31.749 11.311 1.00 21.59 C ATOM 45 CG2 ILE A -3 35.126 29.414 10.503 1.00 18.53 C ATOM 46 CD1 ILE A -3 34.605 32.600 10.493 1.00 26.97 C ATOM 0 H ILE A -3 34.037 31.813 13.556 1.00 18.14 H new ATOM 0 HA ILE A -3 32.959 30.753 11.439 1.00 18.34 H new ATOM 0 HB ILE A -3 35.507 30.042 12.431 1.00 18.57 H new ATOM 0 HG12 ILE A -3 35.756 32.229 12.124 1.00 21.59 H new ATOM 0 HG13 ILE A -3 36.356 31.626 10.817 1.00 21.59 H new ATOM 0 HG21 ILE A -3 36.053 29.385 10.217 1.00 18.53 H new ATOM 0 HG22 ILE A -3 34.844 28.527 10.775 1.00 18.53 H new ATOM 0 HG23 ILE A -3 34.571 29.718 9.768 1.00 18.53 H new ATOM 0 HD11 ILE A -3 35.032 33.449 10.298 1.00 26.97 H new ATOM 0 HD12 ILE A -3 34.396 32.145 9.662 1.00 26.97 H new ATOM 0 HD13 ILE A -3 33.786 32.757 10.989 1.00 26.97 H new ATOM 47 N GLU A -2 33.410 28.840 13.944 1.00 15.19 N ATOM 48 CA GLU A -2 33.016 27.614 14.620 1.00 15.81 C ATOM 49 C GLU A -2 31.506 27.410 14.662 1.00 15.63 C ATOM 50 O GLU A -2 30.987 26.296 14.441 1.00 15.73 O ATOM 51 CB GLU A -2 33.553 27.678 16.049 1.00 16.91 C ATOM 52 CG GLU A -2 34.104 26.392 16.483 1.00 19.03 C ATOM 53 CD GLU A -2 34.628 26.403 17.910 1.00 21.30 C ATOM 54 OE1 GLU A -2 34.175 27.248 18.716 1.00 19.42 O ATOM 55 OE2 GLU A -2 35.502 25.557 18.202 1.00 17.28 O ATOM 0 H GLU A -2 33.883 29.369 14.430 1.00 15.19 H new ATOM 0 HA GLU A -2 33.383 26.866 14.124 1.00 15.81 H new ATOM 0 HB2 GLU A -2 34.241 28.360 16.106 1.00 16.91 H new ATOM 0 HB3 GLU A -2 32.840 27.944 16.651 1.00 16.91 H new ATOM 0 HG2 GLU A -2 33.417 25.712 16.404 1.00 19.03 H new ATOM 0 HG3 GLU A -2 34.824 26.139 15.884 1.00 19.03 H new ATOM 56 N GLY A -1 30.785 28.497 14.941 1.00 15.64 N ATOM 57 CA GLY A -1 29.313 28.465 14.958 1.00 14.54 C ATOM 58 C GLY A -1 28.683 28.128 13.624 1.00 14.57 C ATOM 59 O GLY A -1 27.578 27.561 13.576 1.00 14.81 O ATOM 0 H GLY A -1 31.126 29.265 15.124 1.00 15.64 H new ATOM 0 HA2 GLY A -1 29.022 27.814 15.615 1.00 14.54 H new ATOM 0 HA3 GLY A -1 28.984 29.330 15.250 1.00 14.54 H new ATOM 60 N AARG A 0 29.370 28.455 12.526 0.50 14.71 N ATOM 61 N BARG A 0 29.382 28.442 12.531 0.50 14.00 N ATOM 62 CA AARG A 0 28.854 28.170 11.186 0.50 14.81 C ATOM 63 CA BARG A 0 28.873 28.190 11.183 0.50 13.36 C ATOM 64 C AARG A 0 29.348 26.856 10.583 0.50 14.51 C ATOM 65 C BARG A 0 29.217 26.799 10.630 0.50 13.67 C ATOM 66 O AARG A 0 29.172 26.607 9.398 0.50 14.18 O ATOM 67 O BARG A 0 28.784 26.424 9.536 0.50 12.92 O ATOM 68 CB AARG A 0 29.222 29.301 10.227 0.50 15.88 C ATOM 69 CB BARG A 0 29.399 29.277 10.231 0.50 13.89 C ATOM 70 CG AARG A 0 28.384 30.551 10.370 0.50 18.82 C ATOM 71 CG BARG A 0 29.143 30.698 10.736 0.50 12.95 C ATOM 72 CD AARG A 0 28.616 31.469 9.160 0.50 25.87 C ATOM 73 CD BARG A 0 29.631 31.797 9.789 0.50 14.06 C ATOM 74 NE AARG A 0 27.476 32.348 8.898 0.50 30.85 N ATOM 75 NE BARG A 0 28.746 32.966 9.900 0.50 16.37 N ATOM 76 CZ AARG A 0 26.302 31.932 8.419 0.50 33.02 C ATOM 77 CZ BARG A 0 29.159 34.225 9.864 0.50 18.48 C ATOM 78 NH1AARG A 0 26.096 30.645 8.163 0.50 33.84 N ATOM 79 NH1BARG A 0 30.447 34.495 9.706 0.50 18.99 N ATOM 80 NH2AARG A 0 25.332 32.807 8.200 0.50 34.70 N ATOM 81 NH2BARG A 0 28.280 35.216 9.973 0.50 19.76 N ATOM 0 H AARG A 0 30.138 28.843 12.537 0.50 14.00 H new ATOM 0 H BARG A 0 30.161 28.805 12.551 0.50 14.00 H new ATOM 0 HA AARG A 0 27.894 28.092 11.298 0.50 13.36 H new ATOM 0 HA BARG A 0 27.905 28.218 11.244 0.50 13.36 H new ATOM 0 HB2AARG A 0 30.154 29.534 10.364 0.50 13.89 H new ATOM 0 HB2BARG A 0 30.352 29.153 10.103 0.50 13.89 H new ATOM 0 HB3AARG A 0 29.142 28.975 9.317 0.50 13.89 H new ATOM 0 HB3BARG A 0 28.980 29.168 9.363 0.50 13.89 H new ATOM 0 HG2AARG A 0 27.445 30.316 10.434 0.50 12.95 H new ATOM 0 HG2BARG A 0 28.191 30.811 10.884 0.50 12.95 H new ATOM 0 HG3AARG A 0 28.617 31.015 11.189 0.50 12.95 H new ATOM 0 HG3BARG A 0 29.579 30.809 11.596 0.50 12.95 H new ATOM 0 HD2AARG A 0 29.408 32.008 9.314 0.50 14.06 H new ATOM 0 HD2BARG A 0 30.542 32.047 10.009 0.50 14.06 H new ATOM 0 HD3AARG A 0 28.790 30.927 8.375 0.50 14.06 H new ATOM 0 HD3BARG A 0 29.639 31.471 8.876 0.50 14.06 H new ATOM 0 HE AARG A 0 27.569 33.187 9.063 0.50 16.37 H new ATOM 0 HE BARG A 0 27.903 32.823 9.995 0.50 16.37 H new ATOM 0 HH11AARG A 0 26.722 30.073 8.306 0.50 18.99 H new ATOM 0 HH11BARG A 0 31.014 33.853 9.627 0.50 18.99 H new ATOM 0 HH12AARG A 0 25.337 30.384 7.854 0.50 18.99 H new ATOM 0 HH12BARG A 0 30.715 35.312 9.683 0.50 18.99 H new ATOM 0 HH21AARG A 0 25.460 33.641 8.366 0.50 19.76 H new ATOM 0 HH21BARG A 0 27.443 35.040 10.067 0.50 19.76 H new ATOM 0 HH22AARG A 0 24.575 32.541 7.891 0.50 19.76 H new ATOM 0 HH22BARG A 0 28.548 36.033 9.950 0.50 19.76 H new ATOM 82 N MET A 1 29.973 26.019 11.396 1.00 13.61 N ATOM 83 CA MET A 1 30.370 24.679 10.954 1.00 12.80 C ATOM 84 C MET A 1 29.159 23.758 10.767 1.00 12.63 C ATOM 85 O MET A 1 28.065 24.067 11.224 1.00 12.28 O ATOM 86 CB MET A 1 31.343 24.090 11.987 1.00 12.40 C ATOM 87 CG MET A 1 32.745 24.701 11.897 1.00 9.50 C ATOM 88 SD MET A 1 33.803 23.857 13.063 1.00 12.26 S ATOM 89 CE MET A 1 35.413 24.688 12.828 1.00 8.11 C ATOM 0 H AMET A 1 30.180 26.202 12.210 0.50 13.61 H new ATOM 0 H BMET A 1 30.267 26.243 12.173 0.50 13.61 H new ATOM 0 HA MET A 1 30.804 24.750 10.089 1.00 12.80 H new ATOM 0 HB2 MET A 1 30.988 24.234 12.878 1.00 12.40 H new ATOM 0 HB3 MET A 1 31.404 23.131 11.858 1.00 12.40 H new ATOM 0 HG2 MET A 1 33.095 24.611 10.997 1.00 9.50 H new ATOM 0 HG3 MET A 1 32.713 25.650 12.096 1.00 9.50 H new ATOM 0 HE1 MET A 1 36.069 24.297 13.426 1.00 8.11 H new ATOM 0 HE2 MET A 1 35.705 24.575 11.910 1.00 8.11 H new ATOM 0 HE3 MET A 1 35.321 25.634 13.024 1.00 8.11 H new ATOM 90 N ILE A 2 29.347 22.620 10.111 1.00 12.36 N ATOM 91 CA ILE A 2 28.316 21.595 10.119 1.00 11.69 C ATOM 92 C ILE A 2 28.075 21.129 11.586 1.00 11.17 C ATOM 93 O ILE A 2 28.985 20.629 12.228 1.00 9.15 O ATOM 94 CB ILE A 2 28.782 20.386 9.273 1.00 12.86 C ATOM 95 CG1 ILE A 2 28.952 20.787 7.790 1.00 13.50 C ATOM 96 CG2 ILE A 2 27.793 19.227 9.417 1.00 10.73 C ATOM 97 CD1 ILE A 2 29.724 19.725 6.975 1.00 18.07 C ATOM 0 H ILE A 2 30.054 22.424 9.662 1.00 12.36 H new ATOM 0 HA ILE A 2 27.496 21.955 9.746 1.00 11.69 H new ATOM 0 HB ILE A 2 29.646 20.093 9.602 1.00 12.86 H new ATOM 0 HG12 ILE A 2 28.078 20.923 7.392 1.00 13.50 H new ATOM 0 HG13 ILE A 2 29.422 21.634 7.739 1.00 13.50 H new ATOM 0 HG21 ILE A 2 28.095 18.476 8.883 1.00 10.73 H new ATOM 0 HG22 ILE A 2 27.740 18.961 10.348 1.00 10.73 H new ATOM 0 HG23 ILE A 2 26.917 19.509 9.111 1.00 10.73 H new ATOM 0 HD11 ILE A 2 29.805 20.020 6.054 1.00 18.07 H new ATOM 0 HD12 ILE A 2 30.608 19.605 7.355 1.00 18.07 H new ATOM 0 HD13 ILE A 2 29.243 18.883 7.003 1.00 18.07 H new ATOM 98 N ARG A 3 26.855 21.240 12.098 1.00 11.30 N ATOM 99 CA ARG A 3 26.608 20.897 13.494 1.00 11.18 C ATOM 100 C ARG A 3 25.394 19.971 13.574 1.00 11.86 C ATOM 101 O ARG A 3 24.403 20.224 12.907 1.00 14.06 O ATOM 102 CB ARG A 3 26.411 22.148 14.349 1.00 10.79 C ATOM 103 CG ARG A 3 27.676 22.968 14.511 1.00 8.48 C ATOM 104 CD ARG A 3 27.434 24.379 14.992 1.00 10.37 C ATOM 105 NE ARG A 3 26.853 24.415 16.359 1.00 10.51 N ATOM 106 CZ ARG A 3 26.382 25.513 16.946 1.00 9.74 C ATOM 107 NH1 ARG A 3 26.416 26.670 16.307 1.00 7.97 N ATOM 108 NH2 ARG A 3 25.894 25.453 18.187 1.00 10.17 N ATOM 0 H ARG A 3 26.164 21.508 11.661 1.00 11.30 H new ATOM 0 HA ARG A 3 27.384 20.436 13.849 1.00 11.18 H new ATOM 0 HB2 ARG A 3 25.723 22.702 13.947 1.00 10.79 H new ATOM 0 HB3 ARG A 3 26.088 21.886 15.225 1.00 10.79 H new ATOM 0 HG2 ARG A 3 28.264 22.519 15.138 1.00 8.48 H new ATOM 0 HG3 ARG A 3 28.141 23.001 13.660 1.00 8.48 H new ATOM 0 HD2 ARG A 3 28.271 24.869 14.985 1.00 10.37 H new ATOM 0 HD3 ARG A 3 26.836 24.831 14.376 1.00 10.37 H new ATOM 0 HE ARG A 3 26.819 23.678 16.800 1.00 10.51 H new ATOM 0 HH11 ARG A 3 26.742 26.713 15.512 1.00 7.97 H new ATOM 0 HH12 ARG A 3 26.112 27.380 16.686 1.00 7.97 H new ATOM 0 HH21 ARG A 3 25.883 24.704 18.609 1.00 10.17 H new ATOM 0 HH22 ARG A 3 25.590 26.164 18.564 1.00 10.17 H new ATOM 109 N ILE A 4 25.532 18.873 14.312 1.00 9.90 N ATOM 110 CA ILE A 4 24.450 17.927 14.562 1.00 9.23 C ATOM 111 C ILE A 4 24.222 17.890 16.090 1.00 10.21 C ATOM 112 O ILE A 4 25.153 17.590 16.833 1.00 8.64 O ATOM 113 CB ILE A 4 24.813 16.505 14.056 1.00 9.31 C ATOM 114 CG1 ILE A 4 25.180 16.509 12.569 1.00 10.25 C ATOM 115 CG2 ILE A 4 23.618 15.555 14.261 1.00 10.76 C ATOM 116 CD1 ILE A 4 25.417 15.071 11.981 1.00 12.83 C ATOM 0 H ILE A 4 26.273 18.653 14.689 1.00 9.90 H new ATOM 0 HA ILE A 4 23.652 18.208 14.088 1.00 9.23 H new ATOM 0 HB ILE A 4 25.581 16.204 14.566 1.00 9.31 H new ATOM 0 HG12 ILE A 4 24.471 16.943 12.069 1.00 10.25 H new ATOM 0 HG13 ILE A 4 25.982 17.039 12.442 1.00 10.25 H new ATOM 0 HG21 ILE A 4 23.851 14.669 13.943 1.00 10.76 H new ATOM 0 HG22 ILE A 4 23.397 15.512 15.204 1.00 10.76 H new ATOM 0 HG23 ILE A 4 22.853 15.885 13.765 1.00 10.76 H new ATOM 0 HD11 ILE A 4 25.645 15.139 11.041 1.00 12.83 H new ATOM 0 HD12 ILE A 4 26.144 14.641 12.459 1.00 12.83 H new ATOM 0 HD13 ILE A 4 24.609 14.544 12.080 1.00 12.83 H new ATOM 117 N LEU A 5 22.976 18.155 16.522 1.00 10.81 N ATOM 118 CA LEU A 5 22.587 18.148 17.928 1.00 10.61 C ATOM 119 C LEU A 5 21.796 16.877 18.183 1.00 11.13 C ATOM 120 O LEU A 5 20.964 16.514 17.379 1.00 11.19 O ATOM 121 CB LEU A 5 21.673 19.316 18.226 1.00 11.21 C ATOM 122 CG LEU A 5 21.262 19.504 19.699 1.00 15.46 C ATOM 123 CD1 LEU A 5 22.261 20.349 20.430 1.00 15.53 C ATOM 124 CD2 LEU A 5 19.897 20.178 19.682 1.00 20.19 C ATOM 0 H LEU A 5 22.328 18.346 15.989 1.00 10.81 H new ATOM 0 HA LEU A 5 23.381 18.204 18.482 1.00 10.61 H new ATOM 0 HB2 LEU A 5 22.110 20.128 17.926 1.00 11.21 H new ATOM 0 HB3 LEU A 5 20.867 19.215 17.696 1.00 11.21 H new ATOM 0 HG LEU A 5 21.227 18.652 20.161 1.00 15.46 H new ATOM 0 HD11 LEU A 5 21.983 20.454 21.353 1.00 15.53 H new ATOM 0 HD12 LEU A 5 23.130 19.920 20.402 1.00 15.53 H new ATOM 0 HD13 LEU A 5 22.317 21.221 20.009 1.00 15.53 H new ATOM 0 HD21 LEU A 5 19.594 20.318 20.593 1.00 20.19 H new ATOM 0 HD22 LEU A 5 19.964 21.033 19.228 1.00 20.19 H new ATOM 0 HD23 LEU A 5 19.263 19.613 19.214 1.00 20.19 H new ATOM 125 N TYR A 6 22.051 16.205 19.304 1.00 9.10 N ATOM 126 CA TYR A 6 21.360 14.943 19.532 1.00 10.16 C ATOM 127 C TYR A 6 20.634 14.990 20.876 1.00 11.85 C ATOM 128 O TYR A 6 21.202 15.477 21.849 1.00 11.08 O ATOM 129 CB TYR A 6 22.351 13.797 19.610 1.00 10.78 C ATOM 130 CG TYR A 6 23.313 13.688 18.468 1.00 11.11 C ATOM 131 CD1 TYR A 6 23.165 12.696 17.491 1.00 12.44 C ATOM 132 CD2 TYR A 6 24.409 14.537 18.379 1.00 13.00 C ATOM 133 CE1 TYR A 6 24.086 12.607 16.411 1.00 14.06 C ATOM 134 CE2 TYR A 6 25.329 14.436 17.315 1.00 14.50 C ATOM 135 CZ TYR A 6 25.166 13.470 16.364 1.00 13.15 C ATOM 136 OH TYR A 6 26.132 13.420 15.349 1.00 15.35 O ATOM 0 H TYR A 6 22.598 16.451 19.921 1.00 9.10 H new ATOM 0 HA TYR A 6 20.741 14.809 18.797 1.00 10.16 H new ATOM 0 HB2 TYR A 6 22.859 13.887 20.431 1.00 10.78 H new ATOM 0 HB3 TYR A 6 21.854 12.966 19.673 1.00 10.78 H new ATOM 0 HD1 TYR A 6 22.460 12.092 17.549 1.00 12.44 H new ATOM 0 HD2 TYR A 6 24.539 15.185 19.034 1.00 13.00 H new ATOM 0 HE1 TYR A 6 23.963 11.973 15.741 1.00 14.06 H new ATOM 0 HE2 TYR A 6 26.046 15.026 17.261 1.00 14.50 H new ATOM 0 HH TYR A 6 26.265 12.621 15.128 1.00 15.35 H new ATOM 137 N LEU A 7 19.420 14.430 20.915 1.00 10.70 N ATOM 138 CA LEU A 7 18.735 14.158 22.181 1.00 12.40 C ATOM 139 C LEU A 7 19.015 12.696 22.510 1.00 13.21 C ATOM 140 O LEU A 7 18.847 11.834 21.641 1.00 12.94 O ATOM 141 CB LEU A 7 17.221 14.358 22.002 1.00 11.29 C ATOM 142 CG LEU A 7 16.801 15.733 21.462 1.00 11.69 C ATOM 143 CD1 LEU A 7 15.263 15.900 21.432 1.00 13.43 C ATOM 144 CD2 LEU A 7 17.450 16.910 22.225 1.00 12.87 C ATOM 0 H LEU A 7 18.976 14.200 20.215 1.00 10.70 H new ATOM 0 HA LEU A 7 19.042 14.750 22.885 1.00 12.40 H new ATOM 0 HB2 LEU A 7 16.888 13.675 21.399 1.00 11.29 H new ATOM 0 HB3 LEU A 7 16.787 14.217 22.858 1.00 11.29 H new ATOM 0 HG LEU A 7 17.133 15.762 20.551 1.00 11.69 H new ATOM 0 HD11 LEU A 7 15.039 16.778 21.086 1.00 13.43 H new ATOM 0 HD12 LEU A 7 14.874 15.219 20.861 1.00 13.43 H new ATOM 0 HD13 LEU A 7 14.910 15.807 22.331 1.00 13.43 H new ATOM 0 HD21 LEU A 7 17.150 17.749 21.842 1.00 12.87 H new ATOM 0 HD22 LEU A 7 17.193 16.871 23.159 1.00 12.87 H new ATOM 0 HD23 LEU A 7 18.415 16.849 22.153 1.00 12.87 H new ATOM 145 N ALEU A 8 19.489 12.435 23.726 0.50 13.52 N ATOM 146 N BLEU A 8 19.461 12.426 23.737 0.50 13.71 N ATOM 147 CA ALEU A 8 19.729 11.063 24.185 0.50 13.47 C ATOM 148 CA BLEU A 8 19.776 11.056 24.182 0.50 13.81 C ATOM 149 C ALEU A 8 18.744 10.723 25.311 0.50 14.14 C ATOM 150 C BLEU A 8 18.880 10.667 25.372 0.50 14.37 C ATOM 151 O ALEU A 8 18.429 11.563 26.156 0.50 13.37 O ATOM 152 O BLEU A 8 18.776 11.420 26.336 0.50 13.41 O ATOM 153 CB ALEU A 8 21.158 10.887 24.702 0.50 13.21 C ATOM 154 CB BLEU A 8 21.235 10.952 24.627 0.50 13.83 C ATOM 155 CG ALEU A 8 22.355 11.029 23.759 0.50 13.11 C ATOM 156 CG BLEU A 8 22.344 11.715 23.895 0.50 14.66 C ATOM 157 CD1ALEU A 8 22.346 12.419 23.151 0.50 11.92 C ATOM 158 CD1BLEU A 8 23.661 11.556 24.644 0.50 12.32 C ATOM 159 CD2ALEU A 8 23.607 10.831 24.541 0.50 11.67 C ATOM 160 CD2BLEU A 8 22.476 11.230 22.474 0.50 14.80 C ATOM 0 H ALEU A 8 19.680 13.041 24.306 0.50 13.71 H new ATOM 0 H BLEU A 8 19.591 13.027 24.338 0.50 13.71 H new ATOM 0 HA ALEU A 8 19.601 10.467 23.430 0.50 13.81 H new ATOM 0 HA BLEU A 8 19.620 10.459 23.434 0.50 13.81 H new ATOM 0 HB2ALEU A 8 21.283 11.528 25.419 0.50 13.83 H new ATOM 0 HB2BLEU A 8 21.268 11.227 25.557 0.50 13.83 H new ATOM 0 HB3ALEU A 8 21.211 10.003 25.099 0.50 13.83 H new ATOM 0 HB3BLEU A 8 21.473 10.012 24.601 0.50 13.83 H new ATOM 0 HG ALEU A 8 22.305 10.368 23.051 0.50 14.66 H new ATOM 0 HG BLEU A 8 22.111 12.656 23.868 0.50 14.66 H new ATOM 0 HD11ALEU A 8 23.103 12.515 22.552 0.50 12.32 H new ATOM 0 HD11BLEU A 8 24.360 12.040 24.177 0.50 12.32 H new ATOM 0 HD12ALEU A 8 21.523 12.550 22.655 0.50 12.32 H new ATOM 0 HD12BLEU A 8 23.567 11.910 25.542 0.50 12.32 H new ATOM 0 HD13ALEU A 8 22.407 13.082 23.857 0.50 12.32 H new ATOM 0 HD13BLEU A 8 23.896 10.616 24.690 0.50 12.32 H new ATOM 0 HD21ALEU A 8 24.373 10.919 23.953 0.50 14.80 H new ATOM 0 HD21BLEU A 8 23.182 11.724 22.028 0.50 14.80 H new ATOM 0 HD22ALEU A 8 23.660 11.499 25.242 0.50 14.80 H new ATOM 0 HD22BLEU A 8 22.693 10.285 22.473 0.50 14.80 H new ATOM 0 HD23ALEU A 8 23.604 9.946 24.938 0.50 14.80 H new ATOM 0 HD23BLEU A 8 21.638 11.369 22.005 0.50 14.80 H new ATOM 161 N VAL A 9 18.271 9.482 25.301 1.00 14.71 N ATOM 162 CA VAL A 9 17.432 8.924 26.383 1.00 16.27 C ATOM 163 C VAL A 9 18.191 7.639 26.814 1.00 16.66 C ATOM 164 O VAL A 9 18.597 6.850 25.947 1.00 15.65 O ATOM 165 CB VAL A 9 16.054 8.503 25.836 1.00 16.90 C ATOM 166 CG1 VAL A 9 15.185 7.854 26.936 1.00 19.67 C ATOM 167 CG2 VAL A 9 15.299 9.686 25.176 1.00 18.43 C ATOM 0 H AVAL A 9 18.424 8.926 24.663 0.50 14.71 H new ATOM 0 H BVAL A 9 18.331 8.967 24.615 0.50 14.71 H new ATOM 0 HA VAL A 9 17.289 9.563 27.098 1.00 16.27 H new ATOM 0 HB VAL A 9 16.221 7.841 25.147 1.00 16.90 H new ATOM 0 HG11 VAL A 9 14.326 7.600 26.563 1.00 19.67 H new ATOM 0 HG12 VAL A 9 15.633 7.066 27.280 1.00 19.67 H new ATOM 0 HG13 VAL A 9 15.049 8.488 27.657 1.00 19.67 H new ATOM 0 HG21 VAL A 9 14.440 9.378 24.847 1.00 18.43 H new ATOM 0 HG22 VAL A 9 15.161 10.388 25.831 1.00 18.43 H new ATOM 0 HG23 VAL A 9 15.823 10.033 24.437 1.00 18.43 H new ATOM 168 N LYS A 10 18.426 7.442 28.113 1.00 16.04 N ATOM 169 CA LYS A 10 19.244 6.298 28.559 1.00 16.50 C ATOM 170 C LYS A 10 18.461 5.003 28.394 1.00 16.56 C ATOM 171 O LYS A 10 17.239 5.039 28.348 1.00 16.88 O ATOM 172 CB LYS A 10 19.669 6.453 30.027 1.00 16.98 C ATOM 173 CG LYS A 10 18.549 6.276 31.035 1.00 19.09 C ATOM 174 CD LYS A 10 19.047 6.377 32.512 1.00 19.05 C ATOM 175 CE LYS A 10 17.849 6.257 33.444 1.00 17.32 C ATOM 176 NZ LYS A 10 17.193 4.908 33.249 1.00 15.07 N ATOM 0 H LYS A 10 18.130 7.945 28.744 1.00 16.04 H new ATOM 0 HA LYS A 10 20.043 6.272 28.009 1.00 16.50 H new ATOM 0 HB2 LYS A 10 20.365 5.806 30.219 1.00 16.98 H new ATOM 0 HB3 LYS A 10 20.059 7.333 30.147 1.00 16.98 H new ATOM 0 HG2 LYS A 10 17.869 6.951 30.880 1.00 19.09 H new ATOM 0 HG3 LYS A 10 18.128 5.413 30.898 1.00 19.09 H new ATOM 0 HD2 LYS A 10 19.689 5.674 32.699 1.00 19.05 H new ATOM 0 HD3 LYS A 10 19.501 7.222 32.656 1.00 19.05 H new ATOM 0 HE2 LYS A 10 18.132 6.360 34.366 1.00 17.32 H new ATOM 0 HE3 LYS A 10 17.213 6.966 33.262 1.00 17.32 H new ATOM 0 HZ1 LYS A 10 16.597 4.771 33.896 1.00 15.07 H new ATOM 0 HZ2 LYS A 10 16.783 4.889 32.460 1.00 15.07 H new ATOM 0 HZ3 LYS A 10 17.813 4.270 33.277 1.00 15.07 H new ATOM 177 N PRO A 11 19.153 3.858 28.292 1.00 16.94 N ATOM 178 CA PRO A 11 18.408 2.595 28.310 1.00 18.93 C ATOM 179 C PRO A 11 17.567 2.479 29.595 1.00 19.75 C ATOM 180 O PRO A 11 18.001 2.884 30.689 1.00 19.19 O ATOM 181 CB PRO A 11 19.517 1.534 28.271 1.00 18.03 C ATOM 182 CG PRO A 11 20.775 2.305 27.815 1.00 18.91 C ATOM 183 CD PRO A 11 20.599 3.626 28.440 1.00 17.52 C ATOM 0 HA PRO A 11 17.779 2.508 27.577 1.00 18.93 H new ATOM 0 HB2 PRO A 11 19.648 1.128 29.142 1.00 18.03 H new ATOM 0 HB3 PRO A 11 19.299 0.818 27.654 1.00 18.03 H new ATOM 0 HG2 PRO A 11 21.590 1.872 28.114 1.00 18.91 H new ATOM 0 HG3 PRO A 11 20.826 2.369 26.848 1.00 18.91 H new ATOM 0 HD2 PRO A 11 20.871 3.624 29.371 1.00 17.52 H new ATOM 0 HD3 PRO A 11 21.122 4.310 27.993 1.00 17.52 H new ATOM 184 N GLU A 12 16.342 1.994 29.443 1.00 21.50 N ATOM 185 CA GLU A 12 15.402 1.872 30.545 1.00 23.73 C ATOM 186 C GLU A 12 16.006 1.306 31.843 1.00 24.17 C ATOM 187 O GLU A 12 15.719 1.797 32.966 1.00 26.09 O ATOM 188 CB GLU A 12 14.240 0.971 30.108 1.00 24.47 C ATOM 189 CG GLU A 12 13.170 0.821 31.169 1.00 29.95 C ATOM 190 CD GLU A 12 12.439 2.110 31.469 1.00 34.28 C ATOM 191 OE1 GLU A 12 12.508 3.044 30.628 1.00 36.27 O ATOM 192 OE2 GLU A 12 11.789 2.181 32.546 1.00 37.60 O ATOM 0 H GLU A 12 16.031 1.724 28.688 1.00 21.50 H new ATOM 0 HA GLU A 12 15.111 2.774 30.752 1.00 23.73 H new ATOM 0 HB2 GLU A 12 13.840 1.336 29.303 1.00 24.47 H new ATOM 0 HB3 GLU A 12 14.586 0.094 29.880 1.00 24.47 H new ATOM 0 HG2 GLU A 12 12.529 0.153 30.880 1.00 29.95 H new ATOM 0 HG3 GLU A 12 13.577 0.490 31.985 1.00 29.95 H new ATOM 193 N SER A 13 16.839 0.303 31.670 1.00 23.48 N ATOM 194 CA SER A 13 17.397 -0.466 32.755 1.00 24.67 C ATOM 195 C SER A 13 18.677 0.113 33.358 1.00 23.47 C ATOM 196 O SER A 13 19.098 -0.321 34.437 1.00 25.32 O ATOM 197 CB SER A 13 17.698 -1.869 32.229 1.00 25.40 C ATOM 198 OG SER A 13 18.587 -1.788 31.124 1.00 28.18 O ATOM 0 H SER A 13 17.103 0.043 30.894 1.00 23.48 H new ATOM 0 HA SER A 13 16.740 -0.460 33.468 1.00 24.67 H new ATOM 0 HB2 SER A 13 18.091 -2.410 32.932 1.00 25.40 H new ATOM 0 HB3 SER A 13 16.875 -2.307 31.961 1.00 25.40 H new ATOM 0 HG SER A 13 19.358 -1.596 31.398 1.00 28.18 H new ATOM 199 N MET A 14 19.314 1.058 32.677 1.00 20.31 N ATOM 200 CA MET A 14 20.571 1.610 33.185 1.00 18.64 C ATOM 201 C MET A 14 20.259 2.642 34.260 1.00 16.78 C ATOM 202 O MET A 14 19.334 3.456 34.088 1.00 15.29 O ATOM 203 CB MET A 14 21.351 2.285 32.049 1.00 18.55 C ATOM 204 CG MET A 14 22.728 2.732 32.476 1.00 18.44 C ATOM 205 SD MET A 14 23.752 3.306 31.109 1.00 18.48 S ATOM 206 CE MET A 14 24.351 1.724 30.466 1.00 15.03 C ATOM 0 H MET A 14 19.044 1.391 31.931 1.00 20.31 H new ATOM 0 HA MET A 14 21.109 0.892 33.554 1.00 18.64 H new ATOM 0 HB2 MET A 14 21.431 1.668 31.305 1.00 18.55 H new ATOM 0 HB3 MET A 14 20.851 3.052 31.729 1.00 18.55 H new ATOM 0 HG2 MET A 14 22.641 3.445 33.128 1.00 18.44 H new ATOM 0 HG3 MET A 14 23.176 1.995 32.920 1.00 18.44 H new ATOM 0 HE1 MET A 14 24.931 1.883 29.705 1.00 15.03 H new ATOM 0 HE2 MET A 14 24.846 1.260 31.159 1.00 15.03 H new ATOM 0 HE3 MET A 14 23.597 1.181 30.189 1.00 15.03 H new ATOM 207 N SER A 15 21.007 2.622 35.369 1.00 14.67 N ATOM 208 CA SER A 15 20.725 3.603 36.419 1.00 13.55 C ATOM 209 C SER A 15 21.197 4.991 35.957 1.00 13.03 C ATOM 210 O SER A 15 22.090 5.095 35.108 1.00 12.70 O ATOM 211 CB SER A 15 21.437 3.250 37.728 1.00 13.15 C ATOM 212 OG SER A 15 22.832 3.335 37.557 1.00 13.54 O ATOM 0 H SER A 15 21.652 2.076 35.528 1.00 14.67 H new ATOM 0 HA SER A 15 19.769 3.600 36.580 1.00 13.55 H new ATOM 0 HB2 SER A 15 21.153 3.854 38.432 1.00 13.15 H new ATOM 0 HB3 SER A 15 21.192 2.354 38.006 1.00 13.15 H new ATOM 0 HG SER A 15 23.098 2.687 37.093 1.00 13.54 H new ATOM 213 N HIS A 16 20.628 6.045 36.527 1.00 13.31 N ATOM 214 CA HIS A 16 21.145 7.378 36.242 1.00 15.09 C ATOM 215 C HIS A 16 22.597 7.462 36.634 1.00 14.05 C ATOM 216 O HIS A 16 23.383 8.075 35.923 1.00 14.19 O ATOM 217 CB HIS A 16 20.331 8.496 36.932 1.00 15.72 C ATOM 218 CG HIS A 16 18.986 8.727 36.299 1.00 21.10 C ATOM 219 ND1 HIS A 16 18.809 9.560 35.213 1.00 23.74 N ATOM 220 CD2 HIS A 16 17.756 8.256 36.615 1.00 23.86 C ATOM 221 CE1 HIS A 16 17.532 9.557 34.859 1.00 24.90 C ATOM 222 NE2 HIS A 16 16.870 8.783 35.701 1.00 26.26 N ATOM 0 H HIS A 16 19.960 6.015 37.067 1.00 13.31 H new ATOM 0 HA HIS A 16 21.058 7.521 35.287 1.00 15.09 H new ATOM 0 HB2 HIS A 16 20.207 8.268 37.867 1.00 15.72 H new ATOM 0 HB3 HIS A 16 20.840 9.321 36.906 1.00 15.72 H new ATOM 0 HD2 HIS A 16 17.548 7.684 37.318 1.00 23.86 H new ATOM 0 HE1 HIS A 16 17.165 10.020 34.141 1.00 24.90 H new ATOM 0 HE2 HIS A 16 16.023 8.633 35.682 1.00 26.26 H new ATOM 223 N GLU A 17 22.980 6.829 37.749 1.00 14.86 N ATOM 224 CA GLU A 17 24.394 6.941 38.179 1.00 15.41 C ATOM 225 C GLU A 17 25.330 6.411 37.089 1.00 15.16 C ATOM 226 O GLU A 17 26.372 7.039 36.788 1.00 13.90 O ATOM 227 CB GLU A 17 24.651 6.218 39.529 1.00 16.37 C ATOM 228 CG GLU A 17 26.143 5.987 39.915 1.00 19.32 C ATOM 229 CD GLU A 17 26.314 5.102 41.209 1.00 24.31 C ATOM 230 OE1 GLU A 17 25.591 5.332 42.205 1.00 28.37 O ATOM 231 OE2 GLU A 17 27.168 4.186 41.250 1.00 23.57 O ATOM 0 H GLU A 17 22.472 6.352 38.252 1.00 14.86 H new ATOM 0 HA GLU A 17 24.582 7.882 38.320 1.00 15.41 H new ATOM 0 HB2 GLU A 17 24.230 6.733 40.235 1.00 16.37 H new ATOM 0 HB3 GLU A 17 24.206 5.356 39.502 1.00 16.37 H new ATOM 0 HG2 GLU A 17 26.601 5.560 39.174 1.00 19.32 H new ATOM 0 HG3 GLU A 17 26.572 6.845 40.057 1.00 19.32 H new ATOM 232 N GLN A 18 24.962 5.275 36.480 1.00 14.50 N ATOM 233 CA GLN A 18 25.833 4.679 35.465 1.00 14.65 C ATOM 234 C GLN A 18 25.764 5.500 34.177 1.00 13.82 C ATOM 235 O GLN A 18 26.758 5.663 33.505 1.00 14.27 O ATOM 236 CB GLN A 18 25.472 3.209 35.122 1.00 14.35 C ATOM 237 CG GLN A 18 26.513 2.627 34.186 1.00 17.88 C ATOM 238 CD GLN A 18 26.237 1.222 33.738 1.00 23.53 C ATOM 239 OE1 GLN A 18 25.175 0.641 34.035 1.00 24.95 O ATOM 240 NE2 GLN A 18 27.181 0.656 32.978 1.00 26.54 N ATOM 0 H GLN A 18 24.233 4.847 36.636 1.00 14.50 H new ATOM 0 HA GLN A 18 26.726 4.682 35.844 1.00 14.65 H new ATOM 0 HB2 GLN A 18 25.425 2.681 35.934 1.00 14.35 H new ATOM 0 HB3 GLN A 18 24.596 3.171 34.708 1.00 14.35 H new ATOM 0 HG2 GLN A 18 26.581 3.196 33.403 1.00 17.88 H new ATOM 0 HG3 GLN A 18 27.376 2.649 34.628 1.00 17.88 H new ATOM 0 HE21 GLN A 18 27.901 1.088 32.794 1.00 26.54 H new ATOM 0 HE22 GLN A 18 27.068 -0.140 32.673 1.00 26.54 H new ATOM 241 N PHE A 19 24.575 5.961 33.825 1.00 12.78 N ATOM 242 CA PHE A 19 24.394 6.761 32.619 1.00 13.58 C ATOM 243 C PHE A 19 25.330 7.972 32.620 1.00 13.92 C ATOM 244 O PHE A 19 25.989 8.225 31.611 1.00 13.57 O ATOM 245 CB PHE A 19 22.944 7.162 32.444 1.00 13.87 C ATOM 246 CG PHE A 19 22.704 8.001 31.225 1.00 14.14 C ATOM 247 CD1 PHE A 19 22.798 7.441 29.959 1.00 11.89 C ATOM 248 CD2 PHE A 19 22.447 9.369 31.346 1.00 10.82 C ATOM 249 CE1 PHE A 19 22.593 8.236 28.822 1.00 13.24 C ATOM 250 CE2 PHE A 19 22.278 10.153 30.228 1.00 11.46 C ATOM 251 CZ PHE A 19 22.338 9.597 28.962 1.00 11.26 C ATOM 0 H PHE A 19 23.854 5.822 34.272 1.00 12.78 H new ATOM 0 HA PHE A 19 24.632 6.215 31.853 1.00 13.58 H new ATOM 0 HB2 PHE A 19 22.398 6.362 32.391 1.00 13.87 H new ATOM 0 HB3 PHE A 19 22.654 7.652 33.229 1.00 13.87 H new ATOM 0 HD1 PHE A 19 22.997 6.538 29.864 1.00 11.89 H new ATOM 0 HD2 PHE A 19 22.390 9.754 32.191 1.00 10.82 H new ATOM 0 HE1 PHE A 19 22.627 7.854 27.975 1.00 13.24 H new ATOM 0 HE2 PHE A 19 22.122 11.065 30.324 1.00 11.46 H new ATOM 0 HZ PHE A 19 22.209 10.129 28.210 1.00 11.26 H new ATOM 252 N ARG A 20 25.402 8.696 33.745 1.00 14.60 N ATOM 253 CA AARG A 20 26.325 9.825 33.876 0.50 15.61 C ATOM 254 CA BARG A 20 26.325 9.826 33.886 0.50 15.49 C ATOM 255 C ARG A 20 27.787 9.403 33.651 1.00 16.09 C ATOM 256 O ARG A 20 28.544 10.102 32.948 1.00 15.16 O ATOM 257 CB AARG A 20 26.159 10.523 35.236 0.50 16.09 C ATOM 258 CB BARG A 20 26.145 10.513 35.255 0.50 15.89 C ATOM 259 CG AARG A 20 26.940 11.838 35.358 0.50 18.17 C ATOM 260 CG BARG A 20 27.135 11.661 35.532 0.50 17.47 C ATOM 261 CD AARG A 20 27.347 12.175 36.806 0.50 19.93 C ATOM 262 CD BARG A 20 27.164 12.106 37.012 0.50 18.12 C ATOM 263 NE AARG A 20 27.518 13.617 36.989 0.50 20.60 N ATOM 264 NE BARG A 20 25.895 12.668 37.478 0.50 17.79 N ATOM 265 CZ AARG A 20 28.614 14.301 36.670 0.50 22.36 C ATOM 266 CZ BARG A 20 25.647 13.974 37.642 0.50 19.61 C ATOM 267 NH1AARG A 20 29.670 13.685 36.148 0.50 23.55 N ATOM 268 NH1BARG A 20 26.581 14.895 37.372 0.50 15.22 N ATOM 269 NH2AARG A 20 28.651 15.609 36.872 0.50 24.86 N ATOM 270 NH2BARG A 20 24.447 14.356 38.076 0.50 17.30 N ATOM 0 H AARG A 20 24.923 8.547 34.443 0.50 14.60 H new ATOM 0 H BARG A 20 24.920 8.545 34.441 0.50 14.60 H new ATOM 0 HA AARG A 20 26.097 10.460 33.179 0.50 15.49 H new ATOM 0 HA BARG A 20 26.106 10.473 33.197 0.50 15.49 H new ATOM 0 HB2AARG A 20 25.217 10.701 35.386 0.50 15.89 H new ATOM 0 HB2BARG A 20 25.241 10.860 35.313 0.50 15.89 H new ATOM 0 HB3AARG A 20 26.448 9.919 35.937 0.50 15.89 H new ATOM 0 HB3BARG A 20 26.238 9.846 35.953 0.50 15.89 H new ATOM 0 HG2AARG A 20 27.738 11.785 34.809 0.50 17.47 H new ATOM 0 HG2BARG A 20 28.026 11.381 35.268 0.50 17.47 H new ATOM 0 HG3AARG A 20 26.400 12.562 35.004 0.50 17.47 H new ATOM 0 HG3BARG A 20 26.901 12.422 34.977 0.50 17.47 H new ATOM 0 HD2AARG A 20 26.670 11.847 37.419 0.50 18.12 H new ATOM 0 HD2BARG A 20 27.395 11.345 37.567 0.50 18.12 H new ATOM 0 HD3AARG A 20 28.174 11.719 37.026 0.50 18.12 H new ATOM 0 HD3BARG A 20 27.865 12.766 37.130 0.50 18.12 H new ATOM 0 HE AARG A 20 26.861 14.055 37.328 0.50 17.79 H new ATOM 0 HE BARG A 20 25.260 12.117 37.660 0.50 17.79 H new ATOM 0 HH11AARG A 20 29.649 12.836 36.013 0.50 15.22 H new ATOM 0 HH11BARG A 20 27.355 14.652 37.088 0.50 15.22 H new ATOM 0 HH12AARG A 20 30.374 14.136 35.945 0.50 15.22 H new ATOM 0 HH12BARG A 20 26.406 15.730 37.482 0.50 15.22 H new ATOM 0 HH21AARG A 20 27.969 16.012 37.208 0.50 17.30 H new ATOM 0 HH21BARG A 20 23.844 13.767 38.247 0.50 17.30 H new ATOM 0 HH22AARG A 20 29.357 16.056 36.668 0.50 17.30 H new ATOM 0 HH22BARG A 20 24.275 15.192 38.185 0.50 17.30 H new ATOM 271 N LYS A 21 28.191 8.260 34.228 1.00 16.20 N ATOM 272 CA LYS A 21 29.573 7.743 34.016 1.00 16.93 C ATOM 273 C LYS A 21 29.843 7.428 32.555 1.00 16.24 C ATOM 274 O LYS A 21 30.937 7.757 32.025 1.00 17.21 O ATOM 275 CB LYS A 21 29.856 6.486 34.839 1.00 16.45 C ATOM 276 CG LYS A 21 30.157 6.741 36.347 1.00 21.50 C ATOM 277 CD LYS A 21 30.129 5.370 37.083 1.00 27.20 C ATOM 278 CE LYS A 21 30.739 5.389 38.471 1.00 32.51 C ATOM 279 NZ LYS A 21 29.695 5.617 39.508 1.00 33.78 N ATOM 0 H LYS A 21 27.698 7.772 34.737 1.00 16.20 H new ATOM 0 HA LYS A 21 30.162 8.456 34.310 1.00 16.93 H new ATOM 0 HB2 LYS A 21 29.092 5.892 34.771 1.00 16.45 H new ATOM 0 HB3 LYS A 21 30.612 6.022 34.446 1.00 16.45 H new ATOM 0 HG2 LYS A 21 31.023 7.165 36.453 1.00 21.50 H new ATOM 0 HG3 LYS A 21 29.498 7.343 36.727 1.00 21.50 H new ATOM 0 HD2 LYS A 21 29.209 5.071 37.151 1.00 27.20 H new ATOM 0 HD3 LYS A 21 30.601 4.716 36.544 1.00 27.20 H new ATOM 0 HE2 LYS A 21 31.191 4.548 38.641 1.00 32.51 H new ATOM 0 HE3 LYS A 21 31.410 6.087 38.524 1.00 32.51 H new ATOM 0 HZ1 LYS A 21 30.073 5.625 40.314 1.00 33.78 H new ATOM 0 HZ2 LYS A 21 29.296 6.399 39.361 1.00 33.78 H new ATOM 0 HZ3 LYS A 21 29.091 4.964 39.470 1.00 33.78 H new ATOM 280 N GLU A 22 28.872 6.808 31.892 1.00 15.52 N ATOM 281 CA GLU A 22 29.027 6.480 30.472 1.00 16.05 C ATOM 282 C GLU A 22 29.024 7.717 29.531 1.00 15.84 C ATOM 283 O GLU A 22 29.644 7.672 28.457 1.00 15.12 O ATOM 284 CB GLU A 22 27.965 5.489 30.010 1.00 15.90 C ATOM 285 CG GLU A 22 27.963 4.159 30.793 1.00 18.36 C ATOM 286 CD GLU A 22 29.254 3.313 30.657 1.00 21.29 C ATOM 287 OE1 GLU A 22 30.061 3.485 29.700 1.00 19.72 O ATOM 288 OE2 GLU A 22 29.463 2.456 31.550 1.00 21.19 O ATOM 0 H GLU A 22 28.122 6.569 32.239 1.00 15.52 H new ATOM 0 HA GLU A 22 29.906 6.076 30.406 1.00 16.05 H new ATOM 0 HB2 GLU A 22 27.092 5.903 30.092 1.00 15.90 H new ATOM 0 HB3 GLU A 22 28.101 5.299 29.069 1.00 15.90 H new ATOM 0 HG2 GLU A 22 27.818 4.353 31.732 1.00 18.36 H new ATOM 0 HG3 GLU A 22 27.210 3.625 30.494 1.00 18.36 H new ATOM 289 N CYS A 23 28.330 8.797 29.914 1.00 14.99 N ATOM 290 CA CYS A 23 28.453 10.058 29.157 1.00 13.94 C ATOM 291 C CYS A 23 29.893 10.570 29.224 1.00 14.26 C ATOM 292 O CYS A 23 30.472 11.014 28.225 1.00 12.35 O ATOM 293 CB CYS A 23 27.512 11.129 29.704 1.00 14.04 C ATOM 294 SG CYS A 23 25.752 10.915 29.371 1.00 13.86 S ATOM 0 H CYS A 23 27.797 8.825 30.588 1.00 14.99 H new ATOM 0 HA CYS A 23 28.210 9.875 28.236 1.00 13.94 H new ATOM 0 HB2 CYS A 23 27.634 11.176 30.665 1.00 14.04 H new ATOM 0 HB3 CYS A 23 27.786 11.986 29.341 1.00 14.04 H new ATOM 0 HG CYS A 23 25.139 11.824 29.859 1.00 13.86 H new ATOM 295 N VAL A 24 30.471 10.544 30.429 1.00 14.46 N ATOM 296 CA VAL A 24 31.853 10.949 30.608 1.00 14.13 C ATOM 297 C VAL A 24 32.820 10.096 29.808 1.00 14.29 C ATOM 298 O VAL A 24 33.703 10.649 29.146 1.00 15.87 O ATOM 299 CB VAL A 24 32.263 11.008 32.100 1.00 14.93 C ATOM 300 CG1 VAL A 24 33.738 11.227 32.237 1.00 16.20 C ATOM 301 CG2 VAL A 24 31.520 12.103 32.786 1.00 13.65 C ATOM 0 H VAL A 24 30.074 10.294 31.150 1.00 14.46 H new ATOM 0 HA VAL A 24 31.909 11.851 30.256 1.00 14.13 H new ATOM 0 HB VAL A 24 32.040 10.160 32.514 1.00 14.93 H new ATOM 0 HG11 VAL A 24 33.974 11.261 33.177 1.00 16.20 H new ATOM 0 HG12 VAL A 24 34.215 10.498 31.810 1.00 16.20 H new ATOM 0 HG13 VAL A 24 33.982 12.064 31.812 1.00 16.20 H new ATOM 0 HG21 VAL A 24 31.780 12.135 33.720 1.00 13.65 H new ATOM 0 HG22 VAL A 24 31.729 12.951 32.363 1.00 13.65 H new ATOM 0 HG23 VAL A 24 30.566 11.937 32.722 1.00 13.65 H new ATOM 302 N VAL A 25 32.688 8.767 29.862 1.00 14.12 N ATOM 303 CA VAL A 25 33.474 7.868 29.001 1.00 14.19 C ATOM 304 C VAL A 25 33.301 8.247 27.503 1.00 14.84 C ATOM 305 O VAL A 25 34.297 8.380 26.796 1.00 15.27 O ATOM 306 CB VAL A 25 33.104 6.394 29.261 1.00 13.98 C ATOM 307 CG1 VAL A 25 33.634 5.481 28.177 1.00 16.19 C ATOM 308 CG2 VAL A 25 33.627 5.987 30.675 1.00 16.44 C ATOM 0 H VAL A 25 32.146 8.362 30.393 1.00 14.12 H new ATOM 0 HA VAL A 25 34.412 7.976 29.223 1.00 14.19 H new ATOM 0 HB VAL A 25 32.139 6.298 29.240 1.00 13.98 H new ATOM 0 HG11 VAL A 25 33.383 4.565 28.374 1.00 16.19 H new ATOM 0 HG12 VAL A 25 33.259 5.742 27.322 1.00 16.19 H new ATOM 0 HG13 VAL A 25 34.601 5.550 28.140 1.00 16.19 H new ATOM 0 HG21 VAL A 25 33.400 5.060 30.850 1.00 16.44 H new ATOM 0 HG22 VAL A 25 34.590 6.095 30.707 1.00 16.44 H new ATOM 0 HG23 VAL A 25 33.216 6.553 31.347 1.00 16.44 H new ATOM 309 N HIS A 26 32.051 8.460 27.055 1.00 14.22 N ATOM 310 CA HIS A 26 31.760 8.834 25.666 1.00 14.57 C ATOM 311 C HIS A 26 32.495 10.094 25.219 1.00 14.57 C ATOM 312 O HIS A 26 32.966 10.148 24.049 1.00 14.69 O ATOM 313 CB HIS A 26 30.250 8.985 25.429 1.00 14.72 C ATOM 314 CG HIS A 26 29.832 8.742 24.008 1.00 13.92 C ATOM 315 ND1 HIS A 26 29.971 7.520 23.384 1.00 16.32 N ATOM 316 CD2 HIS A 26 29.286 9.568 23.087 1.00 14.10 C ATOM 317 CE1 HIS A 26 29.506 7.592 22.152 1.00 17.31 C ATOM 318 NE2 HIS A 26 29.074 8.825 21.948 1.00 14.96 N ATOM 0 H HIS A 26 31.352 8.391 27.551 1.00 14.22 H new ATOM 0 HA HIS A 26 32.091 8.103 25.121 1.00 14.57 H new ATOM 0 HB2 HIS A 26 29.777 8.366 26.007 1.00 14.72 H new ATOM 0 HB3 HIS A 26 29.978 9.879 25.689 1.00 14.72 H new ATOM 0 HD2 HIS A 26 29.090 10.470 23.202 1.00 14.10 H new ATOM 0 HE1 HIS A 26 29.485 6.897 21.534 1.00 17.31 H new ATOM 0 HE2 HIS A 26 28.718 9.116 21.221 1.00 14.96 H new ATOM 319 N PHE A 27 32.580 11.090 26.114 1.00 13.64 N ATOM 320 CA PHE A 27 33.351 12.312 25.850 1.00 15.81 C ATOM 321 C PHE A 27 34.838 12.009 25.747 1.00 17.26 C ATOM 322 O PHE A 27 35.518 12.531 24.867 1.00 16.10 O ATOM 323 CB PHE A 27 33.151 13.397 26.922 1.00 15.69 C ATOM 324 CG PHE A 27 33.919 14.636 26.626 1.00 17.49 C ATOM 325 CD1 PHE A 27 33.400 15.601 25.763 1.00 17.06 C ATOM 326 CD2 PHE A 27 35.184 14.837 27.182 1.00 16.92 C ATOM 327 CE1 PHE A 27 34.150 16.747 25.456 1.00 18.81 C ATOM 328 CE2 PHE A 27 35.939 15.955 26.855 1.00 20.05 C ATOM 329 CZ PHE A 27 35.419 16.914 26.006 1.00 21.00 C ATOM 0 H PHE A 27 32.196 11.075 26.883 1.00 13.64 H new ATOM 0 HA PHE A 27 33.014 12.652 25.006 1.00 15.81 H new ATOM 0 HB2 PHE A 27 32.208 13.612 26.988 1.00 15.69 H new ATOM 0 HB3 PHE A 27 33.424 13.049 27.785 1.00 15.69 H new ATOM 0 HD1 PHE A 27 32.556 15.485 25.390 1.00 17.06 H new ATOM 0 HD2 PHE A 27 35.526 14.212 27.780 1.00 16.92 H new ATOM 0 HE1 PHE A 27 33.800 17.394 24.886 1.00 18.81 H new ATOM 0 HE2 PHE A 27 36.794 16.059 27.207 1.00 20.05 H new ATOM 0 HZ PHE A 27 35.917 17.672 25.802 1.00 21.00 H new ATOM 330 N GLN A 28 35.365 11.218 26.677 1.00 18.59 N ATOM 331 CA GLN A 28 36.777 10.810 26.593 1.00 20.57 C ATOM 332 C GLN A 28 37.075 10.150 25.263 1.00 20.63 C ATOM 333 O GLN A 28 38.101 10.443 24.644 1.00 21.60 O ATOM 334 CB GLN A 28 37.189 9.913 27.783 1.00 20.78 C ATOM 335 CG GLN A 28 37.249 10.726 29.087 1.00 23.51 C ATOM 336 CD GLN A 28 37.232 9.885 30.376 1.00 27.97 C ATOM 337 OE1 GLN A 28 36.786 8.733 30.390 1.00 30.16 O ATOM 338 NE2 GLN A 28 37.707 10.484 31.471 1.00 30.08 N ATOM 0 H GLN A 28 34.936 10.908 27.355 1.00 18.59 H new ATOM 0 HA GLN A 28 37.317 11.614 26.649 1.00 20.57 H new ATOM 0 HB2 GLN A 28 36.555 9.186 27.880 1.00 20.78 H new ATOM 0 HB3 GLN A 28 38.055 9.513 27.607 1.00 20.78 H new ATOM 0 HG2 GLN A 28 38.055 11.266 29.079 1.00 23.51 H new ATOM 0 HG3 GLN A 28 36.497 11.338 29.106 1.00 23.51 H new ATOM 0 HE21 GLN A 28 38.010 11.288 31.424 1.00 30.08 H new ATOM 0 HE22 GLN A 28 37.710 10.066 32.223 1.00 30.08 H new ATOM 339 N MET A 29 36.173 9.291 24.806 1.00 21.25 N ATOM 340 CA MET A 29 36.359 8.605 23.537 1.00 21.86 C ATOM 341 C MET A 29 36.326 9.561 22.303 1.00 22.66 C ATOM 342 O MET A 29 36.762 9.191 21.211 1.00 22.80 O ATOM 343 CB MET A 29 35.300 7.508 23.375 1.00 22.79 C ATOM 344 CG MET A 29 35.397 6.294 24.380 1.00 23.49 C ATOM 345 SD MET A 29 34.112 5.139 23.916 1.00 23.82 S ATOM 346 CE MET A 29 34.797 4.496 22.382 1.00 25.99 C ATOM 0 H MET A 29 35.445 9.091 25.217 1.00 21.25 H new ATOM 0 HA MET A 29 37.247 8.215 23.562 1.00 21.86 H new ATOM 0 HB2 MET A 29 34.424 7.913 23.470 1.00 22.79 H new ATOM 0 HB3 MET A 29 35.356 7.161 22.471 1.00 22.79 H new ATOM 0 HG2 MET A 29 36.271 5.875 24.331 1.00 23.49 H new ATOM 0 HG3 MET A 29 35.277 6.594 25.295 1.00 23.49 H new ATOM 0 HE1 MET A 29 34.402 3.631 22.188 1.00 25.99 H new ATOM 0 HE2 MET A 29 34.601 5.110 21.657 1.00 25.99 H new ATOM 0 HE3 MET A 29 35.758 4.399 22.472 1.00 25.99 H new ATOM 347 N SER A 30 35.794 10.777 22.462 1.00 21.80 N ATOM 348 CA SER A 30 35.678 11.686 21.313 1.00 20.62 C ATOM 349 C SER A 30 37.034 12.302 20.931 1.00 21.99 C ATOM 350 O SER A 30 37.204 12.774 19.786 1.00 21.52 O ATOM 351 CB SER A 30 34.611 12.775 21.544 1.00 18.76 C ATOM 352 OG SER A 30 34.968 13.710 22.526 1.00 15.36 O ATOM 0 H SER A 30 35.500 11.090 23.207 1.00 21.80 H new ATOM 0 HA SER A 30 35.382 11.149 20.561 1.00 20.62 H new ATOM 0 HB2 SER A 30 34.448 13.240 20.709 1.00 18.76 H new ATOM 0 HB3 SER A 30 33.777 12.351 21.800 1.00 18.76 H new ATOM 0 HG SER A 30 35.212 13.307 23.221 1.00 15.36 H new ATOM 353 N ALA A 31 37.979 12.315 21.881 1.00 22.47 N ATOM 354 CA ALA A 31 39.262 12.958 21.670 1.00 23.48 C ATOM 355 C ALA A 31 39.952 12.292 20.491 1.00 24.32 C ATOM 356 O ALA A 31 39.959 11.057 20.373 1.00 24.50 O ATOM 357 CB ALA A 31 40.137 12.897 22.927 1.00 23.78 C ATOM 0 H ALA A 31 37.886 11.952 22.655 1.00 22.47 H new ATOM 0 HA ALA A 31 39.119 13.898 21.476 1.00 23.48 H new ATOM 0 HB1 ALA A 31 40.985 13.334 22.753 1.00 23.78 H new ATOM 0 HB2 ALA A 31 39.686 13.347 23.658 1.00 23.78 H new ATOM 0 HB3 ALA A 31 40.295 11.971 23.167 1.00 23.78 H new ATOM 358 N GLY A 32 40.515 13.114 19.598 1.00 24.27 N ATOM 359 CA GLY A 32 41.150 12.596 18.389 1.00 24.11 C ATOM 360 C GLY A 32 40.291 11.836 17.396 1.00 23.78 C ATOM 361 O GLY A 32 40.829 11.179 16.517 1.00 24.64 O ATOM 0 H GLY A 32 40.538 13.970 19.676 1.00 24.27 H new ATOM 0 HA2 GLY A 32 41.551 13.345 17.921 1.00 24.11 H new ATOM 0 HA3 GLY A 32 41.874 12.011 18.662 1.00 24.11 H new ATOM 362 N MET A 33 38.964 11.921 17.518 1.00 21.99 N ATOM 363 CA MET A 33 38.016 11.314 16.569 1.00 21.39 C ATOM 364 C MET A 33 38.212 11.913 15.172 1.00 21.96 C ATOM 365 O MET A 33 38.107 13.154 15.005 1.00 20.51 O ATOM 366 CB MET A 33 36.579 11.602 17.027 1.00 21.18 C ATOM 367 CG MET A 33 35.476 11.088 16.152 1.00 17.85 C ATOM 368 SD MET A 33 35.318 9.294 16.126 1.00 25.45 S ATOM 369 CE MET A 33 35.392 8.886 17.878 1.00 15.92 C ATOM 0 H MET A 33 38.580 12.339 18.164 1.00 21.99 H new ATOM 0 HA MET A 33 38.174 10.358 16.539 1.00 21.39 H new ATOM 0 HB2 MET A 33 36.463 11.225 17.913 1.00 21.18 H new ATOM 0 HB3 MET A 33 36.475 12.563 17.112 1.00 21.18 H new ATOM 0 HG2 MET A 33 34.636 11.471 16.451 1.00 17.85 H new ATOM 0 HG3 MET A 33 35.624 11.401 15.246 1.00 17.85 H new ATOM 0 HE1 MET A 33 35.159 7.953 18.003 1.00 15.92 H new ATOM 0 HE2 MET A 33 36.290 9.042 18.209 1.00 15.92 H new ATOM 0 HE3 MET A 33 34.767 9.443 18.367 1.00 15.92 H new ATOM 370 N PRO A 34 38.510 11.052 14.173 1.00 21.99 N ATOM 371 CA PRO A 34 38.860 11.551 12.848 1.00 21.37 C ATOM 372 C PRO A 34 37.752 12.433 12.282 1.00 19.97 C ATOM 373 O PRO A 34 36.582 12.039 12.328 1.00 20.31 O ATOM 374 CB PRO A 34 38.979 10.266 12.007 1.00 22.14 C ATOM 375 CG PRO A 34 39.419 9.219 13.001 1.00 22.78 C ATOM 376 CD PRO A 34 38.721 9.590 14.296 1.00 23.25 C ATOM 0 HA PRO A 34 39.665 12.092 12.856 1.00 21.37 H new ATOM 0 HB2 PRO A 34 38.133 10.031 11.595 1.00 22.14 H new ATOM 0 HB3 PRO A 34 39.624 10.369 11.290 1.00 22.14 H new ATOM 0 HG2 PRO A 34 39.167 8.329 12.709 1.00 22.78 H new ATOM 0 HG3 PRO A 34 40.383 9.220 13.109 1.00 22.78 H new ATOM 0 HD2 PRO A 34 37.881 9.116 14.397 1.00 23.25 H new ATOM 0 HD3 PRO A 34 39.265 9.372 15.069 1.00 23.25 H new ATOM 377 N GLY A 35 38.118 13.615 11.766 1.00 18.96 N ATOM 378 CA GLY A 35 37.129 14.508 11.107 1.00 16.65 C ATOM 379 C GLY A 35 36.357 15.425 12.064 1.00 15.63 C ATOM 380 O GLY A 35 35.738 16.411 11.645 1.00 14.31 O ATOM 0 H GLY A 35 38.921 13.921 11.783 1.00 18.96 H new ATOM 0 HA2 GLY A 35 37.591 15.057 10.455 1.00 16.65 H new ATOM 0 HA3 GLY A 35 36.493 13.962 10.618 1.00 16.65 H new ATOM 381 N LEU A 36 36.412 15.134 13.361 1.00 13.92 N ATOM 382 CA LEU A 36 35.585 15.864 14.342 1.00 13.94 C ATOM 383 C LEU A 36 36.302 17.118 14.869 1.00 13.27 C ATOM 384 O LEU A 36 37.413 17.022 15.394 1.00 13.41 O ATOM 385 CB LEU A 36 35.259 14.938 15.534 1.00 13.67 C ATOM 386 CG LEU A 36 34.309 15.528 16.625 1.00 13.54 C ATOM 387 CD1 LEU A 36 32.848 15.590 16.129 1.00 12.37 C ATOM 388 CD2 LEU A 36 34.369 14.597 17.847 1.00 15.94 C ATOM 0 H LEU A 36 36.915 14.524 13.699 1.00 13.92 H new ATOM 0 HA LEU A 36 34.771 16.142 13.893 1.00 13.94 H new ATOM 0 HB2 LEU A 36 34.859 14.125 15.188 1.00 13.67 H new ATOM 0 HB3 LEU A 36 36.093 14.684 15.960 1.00 13.67 H new ATOM 0 HG LEU A 36 34.595 16.430 16.840 1.00 13.54 H new ATOM 0 HD11 LEU A 36 32.285 15.960 16.827 1.00 12.37 H new ATOM 0 HD12 LEU A 36 32.797 16.153 15.341 1.00 12.37 H new ATOM 0 HD13 LEU A 36 32.543 14.696 15.907 1.00 12.37 H new ATOM 0 HD21 LEU A 36 33.787 14.939 18.544 1.00 15.94 H new ATOM 0 HD22 LEU A 36 34.078 13.708 17.591 1.00 15.94 H new ATOM 0 HD23 LEU A 36 35.280 14.556 18.178 1.00 15.94 H new ATOM 389 N HIS A 37 35.681 18.287 14.771 1.00 11.86 N ATOM 390 CA HIS A 37 36.276 19.467 15.359 1.00 11.03 C ATOM 391 C HIS A 37 35.977 19.585 16.866 1.00 12.07 C ATOM 392 O HIS A 37 36.841 20.034 17.651 1.00 12.26 O ATOM 393 CB HIS A 37 35.763 20.717 14.647 1.00 12.39 C ATOM 394 CG HIS A 37 36.177 21.979 15.326 1.00 12.29 C ATOM 395 ND1 HIS A 37 37.498 22.328 15.480 1.00 12.43 N ATOM 396 CD2 HIS A 37 35.458 22.919 15.983 1.00 13.40 C ATOM 397 CE1 HIS A 37 37.573 23.488 16.125 1.00 12.48 C ATOM 398 NE2 HIS A 37 36.351 23.851 16.465 1.00 14.65 N ATOM 0 H HIS A 37 34.928 18.413 14.375 1.00 11.86 H new ATOM 0 HA HIS A 37 37.237 19.386 15.252 1.00 11.03 H new ATOM 0 HB2 HIS A 37 36.092 20.723 13.735 1.00 12.39 H new ATOM 0 HB3 HIS A 37 34.795 20.683 14.599 1.00 12.39 H new ATOM 0 HD2 HIS A 37 34.534 22.933 16.089 1.00 13.40 H new ATOM 0 HE1 HIS A 37 38.353 23.962 16.305 1.00 12.48 H new ATOM 0 HE2 HIS A 37 36.145 24.555 16.914 1.00 14.65 H new ATOM 399 N LYS A 38 34.758 19.196 17.278 1.00 11.21 N ATOM 400 CA LYS A 38 34.304 19.441 18.673 1.00 11.52 C ATOM 401 C LYS A 38 33.126 18.510 19.008 1.00 11.24 C ATOM 402 O LYS A 38 32.313 18.176 18.144 1.00 10.29 O ATOM 403 CB LYS A 38 33.874 20.938 18.863 1.00 11.53 C ATOM 404 CG LYS A 38 33.475 21.334 20.303 1.00 14.37 C ATOM 405 CD LYS A 38 33.035 22.830 20.390 1.00 19.57 C ATOM 406 CE LYS A 38 32.848 23.221 21.861 1.00 24.45 C ATOM 407 NZ LYS A 38 32.239 24.561 21.941 1.00 27.80 N ATOM 0 H LYS A 38 34.184 18.795 16.779 1.00 11.21 H new ATOM 0 HA LYS A 38 35.042 19.256 19.275 1.00 11.52 H new ATOM 0 HB2 LYS A 38 34.605 21.508 18.578 1.00 11.53 H new ATOM 0 HB3 LYS A 38 33.125 21.121 18.274 1.00 11.53 H new ATOM 0 HG2 LYS A 38 32.750 20.765 20.606 1.00 14.37 H new ATOM 0 HG3 LYS A 38 34.224 21.182 20.900 1.00 14.37 H new ATOM 0 HD2 LYS A 38 33.703 23.399 19.976 1.00 19.57 H new ATOM 0 HD3 LYS A 38 32.207 22.963 19.902 1.00 19.57 H new ATOM 0 HE2 LYS A 38 32.284 22.572 22.309 1.00 24.45 H new ATOM 0 HE3 LYS A 38 33.704 23.216 22.318 1.00 24.45 H new ATOM 0 HZ1 LYS A 38 32.843 25.145 22.234 1.00 27.80 H new ATOM 0 HZ2 LYS A 38 31.956 24.808 21.134 1.00 27.80 H new ATOM 0 HZ3 LYS A 38 31.549 24.541 22.503 1.00 27.80 H new ATOM 408 N TYR A 39 33.107 18.027 20.256 1.00 12.18 N ATOM 409 CA TYR A 39 32.003 17.291 20.804 1.00 10.78 C ATOM 410 C TYR A 39 31.670 17.872 22.152 1.00 10.35 C ATOM 411 O TYR A 39 32.582 18.286 22.896 1.00 11.00 O ATOM 412 CB TYR A 39 32.392 15.828 21.008 1.00 12.09 C ATOM 413 CG TYR A 39 31.307 14.985 21.645 1.00 12.33 C ATOM 414 CD1 TYR A 39 30.121 14.728 20.960 1.00 9.95 C ATOM 415 CD2 TYR A 39 31.491 14.389 22.931 1.00 11.34 C ATOM 416 CE1 TYR A 39 29.108 13.956 21.504 1.00 10.16 C ATOM 417 CE2 TYR A 39 30.470 13.586 23.479 1.00 13.68 C ATOM 418 CZ TYR A 39 29.293 13.371 22.749 1.00 11.24 C ATOM 419 OH TYR A 39 28.270 12.597 23.266 1.00 13.25 O ATOM 0 H TYR A 39 33.759 18.129 20.808 1.00 12.18 H new ATOM 0 HA TYR A 39 31.249 17.346 20.196 1.00 10.78 H new ATOM 0 HB2 TYR A 39 32.626 15.442 20.149 1.00 12.09 H new ATOM 0 HB3 TYR A 39 33.187 15.789 21.563 1.00 12.09 H new ATOM 0 HD1 TYR A 39 30.006 15.087 20.110 1.00 9.95 H new ATOM 0 HD2 TYR A 39 32.280 14.530 23.403 1.00 11.34 H new ATOM 0 HE1 TYR A 39 28.312 13.831 21.040 1.00 10.16 H new ATOM 0 HE2 TYR A 39 30.577 13.202 24.319 1.00 13.68 H new ATOM 0 HH TYR A 39 27.716 12.423 22.659 1.00 13.25 H new ATOM 420 N AGLU A 40 30.378 17.917 22.478 0.50 10.09 N ATOM 421 N BGLU A 40 30.367 17.918 22.452 0.50 9.16 N ATOM 422 CA AGLU A 40 29.920 18.300 23.804 0.50 10.27 C ATOM 423 CA BGLU A 40 29.838 18.278 23.760 0.50 8.50 C ATOM 424 C AGLU A 40 28.773 17.387 24.238 0.50 9.37 C ATOM 425 C BGLU A 40 28.818 17.251 24.206 0.50 8.32 C ATOM 426 O AGLU A 40 27.910 17.027 23.434 0.50 9.58 O ATOM 427 O BGLU A 40 28.065 16.711 23.389 0.50 8.52 O ATOM 428 CB AGLU A 40 29.490 19.794 23.833 0.50 10.76 C ATOM 429 CB BGLU A 40 29.134 19.655 23.712 0.50 8.03 C ATOM 430 CG AGLU A 40 28.839 20.217 25.136 0.50 13.97 C ATOM 431 CG BGLU A 40 30.079 20.818 23.748 0.50 6.84 C ATOM 432 CD AGLU A 40 29.203 21.626 25.593 0.50 17.43 C ATOM 433 CD BGLU A 40 29.385 22.195 23.791 0.50 6.36 C ATOM 434 OE1AGLU A 40 29.053 22.559 24.781 0.50 20.30 O ATOM 435 OE1BGLU A 40 28.133 22.278 23.912 0.50 2.00 O ATOM 436 OE2AGLU A 40 29.607 21.787 26.772 0.50 15.77 O ATOM 437 OE2BGLU A 40 30.167 23.185 23.729 0.50 6.66 O ATOM 0 H AGLU A 40 29.743 17.725 21.931 0.50 9.16 H new ATOM 0 H BGLU A 40 29.753 17.734 21.878 0.50 9.16 H new ATOM 0 HA AGLU A 40 30.653 18.197 24.431 0.50 8.50 H new ATOM 0 HA BGLU A 40 30.584 18.312 24.379 0.50 8.50 H new ATOM 0 HB2AGLU A 40 30.269 20.350 23.675 0.50 8.03 H new ATOM 0 HB2BGLU A 40 28.600 19.708 22.904 0.50 8.03 H new ATOM 0 HB3AGLU A 40 28.872 19.958 23.104 0.50 8.03 H new ATOM 0 HB3BGLU A 40 28.522 19.723 24.462 0.50 8.03 H new ATOM 0 HG2AGLU A 40 27.876 20.159 25.037 0.50 6.84 H new ATOM 0 HG2BGLU A 40 30.653 20.732 24.525 0.50 6.84 H new ATOM 0 HG3AGLU A 40 29.091 19.588 25.830 0.50 6.84 H new ATOM 0 HG3BGLU A 40 30.652 20.780 22.967 0.50 6.84 H new ATOM 438 N VAL A 41 28.774 16.988 25.506 1.00 8.91 N ATOM 439 CA VAL A 41 27.653 16.218 26.051 1.00 9.22 C ATOM 440 C VAL A 41 27.294 16.826 27.399 1.00 10.07 C ATOM 441 O VAL A 41 28.196 17.190 28.174 1.00 9.15 O ATOM 442 CB VAL A 41 27.955 14.667 26.148 1.00 9.49 C ATOM 443 CG1 VAL A 41 29.163 14.365 27.044 1.00 9.75 C ATOM 444 CG2 VAL A 41 26.686 13.878 26.634 1.00 10.64 C ATOM 0 H AVAL A 41 29.407 17.149 26.065 0.50 8.91 H new ATOM 0 H BVAL A 41 29.364 17.237 26.080 0.50 8.91 H new ATOM 0 HA VAL A 41 26.896 16.275 25.447 1.00 9.22 H new ATOM 0 HB VAL A 41 28.182 14.365 25.254 1.00 9.49 H new ATOM 0 HG11 VAL A 41 29.312 13.407 27.075 1.00 9.75 H new ATOM 0 HG12 VAL A 41 29.950 14.802 26.684 1.00 9.75 H new ATOM 0 HG13 VAL A 41 28.992 14.694 27.940 1.00 9.75 H new ATOM 0 HG21 VAL A 41 26.893 12.932 26.686 1.00 10.64 H new ATOM 0 HG22 VAL A 41 26.421 14.199 27.510 1.00 10.64 H new ATOM 0 HG23 VAL A 41 25.959 14.015 26.006 1.00 10.64 H new ATOM 445 N ARG A 42 25.984 16.966 27.652 1.00 11.17 N ATOM 446 CA ARG A 42 25.493 17.579 28.899 1.00 10.93 C ATOM 447 C ARG A 42 24.345 16.786 29.395 1.00 11.06 C ATOM 448 O ARG A 42 23.605 16.250 28.585 1.00 12.25 O ATOM 449 CB ARG A 42 24.967 18.978 28.641 1.00 11.05 C ATOM 450 CG ARG A 42 25.986 19.953 28.152 1.00 12.04 C ATOM 451 CD ARG A 42 25.241 21.264 27.842 1.00 15.16 C ATOM 452 NE ARG A 42 24.863 21.352 26.424 1.00 14.15 N ATOM 453 CZ ARG A 42 24.108 22.324 25.920 1.00 15.78 C ATOM 454 NH1 ARG A 42 23.615 23.264 26.734 1.00 10.66 N ATOM 455 NH2 ARG A 42 23.870 22.370 24.602 1.00 14.96 N ATOM 0 H ARG A 42 25.363 16.712 27.114 1.00 11.17 H new ATOM 0 HA ARG A 42 26.227 17.606 29.533 1.00 10.93 H new ATOM 0 HB2 ARG A 42 24.251 18.925 27.989 1.00 11.05 H new ATOM 0 HB3 ARG A 42 24.579 19.320 29.462 1.00 11.05 H new ATOM 0 HG2 ARG A 42 26.672 20.098 28.822 1.00 12.04 H new ATOM 0 HG3 ARG A 42 26.431 19.615 27.359 1.00 12.04 H new ATOM 0 HD2 ARG A 42 24.445 21.323 28.394 1.00 15.16 H new ATOM 0 HD3 ARG A 42 25.804 22.019 28.075 1.00 15.16 H new ATOM 0 HE ARG A 42 25.146 20.740 25.890 1.00 14.15 H new ATOM 0 HH11 ARG A 42 23.787 23.237 27.576 1.00 10.66 H new ATOM 0 HH12 ARG A 42 23.126 23.896 26.415 1.00 10.66 H new ATOM 0 HH21 ARG A 42 24.205 21.772 24.083 1.00 14.96 H new ATOM 0 HH22 ARG A 42 23.382 22.998 24.275 1.00 14.96 H new ATOM 456 N LEU A 43 24.147 16.701 30.716 1.00 11.72 N ATOM 457 CA LEU A 43 22.873 16.120 31.210 1.00 11.93 C ATOM 458 C LEU A 43 21.746 17.106 31.141 1.00 13.29 C ATOM 459 O LEU A 43 22.000 18.325 31.224 1.00 12.94 O ATOM 460 CB LEU A 43 22.977 15.640 32.690 1.00 12.38 C ATOM 461 CG LEU A 43 23.994 14.562 33.012 1.00 16.13 C ATOM 462 CD1 LEU A 43 23.981 14.262 34.539 1.00 17.85 C ATOM 463 CD2 LEU A 43 23.696 13.314 32.181 1.00 13.23 C ATOM 0 H LEU A 43 24.701 16.957 31.321 1.00 11.72 H new ATOM 0 HA LEU A 43 22.697 15.364 30.628 1.00 11.93 H new ATOM 0 HB2 LEU A 43 23.177 16.413 33.241 1.00 12.38 H new ATOM 0 HB3 LEU A 43 22.104 15.317 32.961 1.00 12.38 H new ATOM 0 HG LEU A 43 24.886 14.866 32.782 1.00 16.13 H new ATOM 0 HD11 LEU A 43 24.633 13.572 34.739 1.00 17.85 H new ATOM 0 HD12 LEU A 43 24.204 15.069 35.029 1.00 17.85 H new ATOM 0 HD13 LEU A 43 23.098 13.958 34.802 1.00 17.85 H new ATOM 0 HD21 LEU A 43 24.347 12.625 32.387 1.00 13.23 H new ATOM 0 HD22 LEU A 43 22.806 12.991 32.390 1.00 13.23 H new ATOM 0 HD23 LEU A 43 23.746 13.534 31.238 1.00 13.23 H new ATOM 464 N VAL A 44 20.516 16.601 31.001 1.00 12.31 N ATOM 465 CA VAL A 44 19.315 17.411 31.261 1.00 13.23 C ATOM 466 C VAL A 44 19.063 17.401 32.765 1.00 15.31 C ATOM 467 O VAL A 44 18.805 16.324 33.345 1.00 15.66 O ATOM 468 CB VAL A 44 18.074 16.864 30.507 1.00 12.59 C ATOM 469 CG1 VAL A 44 16.829 17.691 30.802 1.00 12.84 C ATOM 470 CG2 VAL A 44 18.318 16.864 28.951 1.00 11.72 C ATOM 0 H VAL A 44 20.354 15.793 30.757 1.00 12.31 H new ATOM 0 HA VAL A 44 19.463 18.314 30.940 1.00 13.23 H new ATOM 0 HB VAL A 44 17.935 15.956 30.820 1.00 12.59 H new ATOM 0 HG11 VAL A 44 16.074 17.324 30.317 1.00 12.84 H new ATOM 0 HG12 VAL A 44 16.643 17.668 31.754 1.00 12.84 H new ATOM 0 HG13 VAL A 44 16.976 18.608 30.524 1.00 12.84 H new ATOM 0 HG21 VAL A 44 17.532 16.519 28.500 1.00 11.72 H new ATOM 0 HG22 VAL A 44 18.491 17.770 28.650 1.00 11.72 H new ATOM 0 HG23 VAL A 44 19.082 16.303 28.743 1.00 11.72 H new ATOM 471 N ALA A 45 19.149 18.575 33.390 1.00 16.97 N ATOM 472 CA ALA A 45 19.052 18.696 34.839 1.00 19.43 C ATOM 473 C ALA A 45 17.682 19.233 35.255 1.00 21.46 C ATOM 474 O ALA A 45 17.172 18.905 36.345 1.00 23.68 O ATOM 475 CB ALA A 45 20.165 19.612 35.362 1.00 19.72 C ATOM 0 H ALA A 45 19.265 19.323 32.983 1.00 16.97 H new ATOM 0 HA ALA A 45 19.158 17.814 35.228 1.00 19.43 H new ATOM 0 HB1 ALA A 45 20.095 19.688 36.326 1.00 19.72 H new ATOM 0 HB2 ALA A 45 21.029 19.237 35.130 1.00 19.72 H new ATOM 0 HB3 ALA A 45 20.076 20.491 34.961 1.00 19.72 H new ATOM 476 N GLY A 46 17.086 20.061 34.403 1.00 20.82 N ATOM 477 CA GLY A 46 15.805 20.663 34.711 1.00 21.08 C ATOM 478 C GLY A 46 14.889 20.625 33.506 1.00 21.93 C ATOM 479 O GLY A 46 15.352 20.769 32.367 1.00 18.62 O ATOM 0 H GLY A 46 17.412 20.285 33.639 1.00 20.82 H new ATOM 0 HA2 GLY A 46 15.392 20.192 35.452 1.00 21.08 H new ATOM 0 HA3 GLY A 46 15.935 21.581 34.995 1.00 21.08 H new ATOM 480 N ASN A 47 13.593 20.440 33.791 1.00 21.59 N ATOM 481 CA ASN A 47 12.526 20.418 32.815 1.00 23.87 C ATOM 482 C ASN A 47 11.397 21.401 33.208 1.00 25.95 C ATOM 483 O ASN A 47 10.290 20.967 33.588 1.00 26.70 O ATOM 484 CB ASN A 47 11.979 18.990 32.672 1.00 23.02 C ATOM 485 CG ASN A 47 12.986 18.055 32.028 1.00 22.03 C ATOM 486 OD1 ASN A 47 13.058 17.961 30.809 1.00 20.99 O ATOM 487 ND2 ASN A 47 13.787 17.396 32.839 1.00 19.94 N ATOM 0 H ASN A 47 13.313 20.320 34.595 1.00 21.59 H new ATOM 0 HA ASN A 47 12.882 20.704 31.959 1.00 23.87 H new ATOM 0 HB2 ASN A 47 11.736 18.649 33.547 1.00 23.02 H new ATOM 0 HB3 ASN A 47 11.169 19.007 32.139 1.00 23.02 H new ATOM 0 HD21 ASN A 47 14.390 16.874 32.517 1.00 19.94 H new ATOM 0 HD22 ASN A 47 13.707 17.487 33.690 1.00 19.94 H new ATOM 488 N PRO A 48 11.670 22.722 33.130 1.00 27.00 N ATOM 489 CA PRO A 48 10.602 23.650 33.561 1.00 28.31 C ATOM 490 C PRO A 48 9.378 23.552 32.627 1.00 29.80 C ATOM 491 O PRO A 48 9.542 23.354 31.418 1.00 29.31 O ATOM 492 CB PRO A 48 11.277 25.027 33.527 1.00 28.84 C ATOM 493 CG PRO A 48 12.661 24.836 32.882 1.00 26.58 C ATOM 494 CD PRO A 48 12.964 23.385 32.844 1.00 26.86 C ATOM 0 HA PRO A 48 10.248 23.452 34.442 1.00 28.31 H new ATOM 0 HB2 PRO A 48 10.745 25.657 33.017 1.00 28.84 H new ATOM 0 HB3 PRO A 48 11.363 25.389 34.423 1.00 28.84 H new ATOM 0 HG2 PRO A 48 12.669 25.206 31.985 1.00 26.58 H new ATOM 0 HG3 PRO A 48 13.338 25.309 33.390 1.00 26.58 H new ATOM 0 HD2 PRO A 48 13.312 23.120 31.978 1.00 26.86 H new ATOM 0 HD3 PRO A 48 13.635 23.148 33.503 1.00 26.86 H new ATOM 495 N THR A 49 8.158 23.602 33.170 1.00 31.33 N ATOM 496 CA THR A 49 6.970 23.404 32.304 1.00 33.29 C ATOM 497 C THR A 49 6.088 24.636 32.188 1.00 34.04 C ATOM 498 O THR A 49 5.117 24.622 31.423 1.00 34.92 O ATOM 499 CB THR A 49 6.060 22.232 32.749 1.00 33.36 C ATOM 500 OG1 THR A 49 5.578 22.489 34.075 1.00 33.58 O ATOM 501 CG2 THR A 49 6.803 20.906 32.691 1.00 33.34 C ATOM 0 H THR A 49 7.991 23.743 34.002 1.00 31.33 H new ATOM 0 HA THR A 49 7.368 23.201 31.443 1.00 33.29 H new ATOM 0 HB THR A 49 5.308 22.167 32.140 1.00 33.36 H new ATOM 0 HG1 THR A 49 5.083 21.857 34.321 1.00 33.58 H new ATOM 0 HG21 THR A 49 6.212 20.191 32.974 1.00 33.34 H new ATOM 0 HG22 THR A 49 7.099 20.740 31.782 1.00 33.34 H new ATOM 0 HG23 THR A 49 7.573 20.940 33.280 1.00 33.34 H new ATOM 502 N ASP A 50 6.419 25.668 32.956 1.00 34.62 N ATOM 503 CA ASP A 50 5.676 26.918 32.944 1.00 35.87 C ATOM 504 C ASP A 50 6.240 27.848 31.867 1.00 35.91 C ATOM 505 O ASP A 50 6.869 28.871 32.147 1.00 36.10 O ATOM 506 CB ASP A 50 5.685 27.577 34.337 1.00 36.65 C ATOM 507 CG ASP A 50 7.103 27.819 34.889 1.00 39.36 C ATOM 508 OD1 ASP A 50 7.224 28.575 35.888 1.00 42.59 O ATOM 509 OD2 ASP A 50 8.087 27.271 34.345 1.00 41.42 O ATOM 0 H ASP A 50 7.084 25.661 33.501 1.00 34.62 H new ATOM 0 HA ASP A 50 4.749 26.734 32.726 1.00 35.87 H new ATOM 0 HB2 ASP A 50 5.214 28.424 34.290 1.00 36.65 H new ATOM 0 HB3 ASP A 50 5.195 27.014 34.957 1.00 36.65 H new ATOM 510 N THR A 51 6.033 27.461 30.623 1.00 35.46 N ATOM 511 CA THR A 51 6.524 28.239 29.510 1.00 35.30 C ATOM 512 C THR A 51 5.480 29.311 29.210 1.00 35.21 C ATOM 513 O THR A 51 4.286 29.096 29.428 1.00 34.76 O ATOM 514 CB THR A 51 6.820 27.340 28.270 1.00 35.60 C ATOM 515 OG1 THR A 51 5.672 26.551 27.963 1.00 34.63 O ATOM 516 CG2 THR A 51 7.984 26.384 28.538 1.00 34.30 C ATOM 0 H THR A 51 5.608 26.747 30.402 1.00 35.46 H new ATOM 0 HA THR A 51 7.370 28.657 29.734 1.00 35.30 H new ATOM 0 HB THR A 51 7.048 27.928 27.533 1.00 35.60 H new ATOM 0 HG1 THR A 51 5.036 27.054 27.745 1.00 34.63 H new ATOM 0 HG21 THR A 51 8.144 25.840 27.751 1.00 34.30 H new ATOM 0 HG22 THR A 51 8.782 26.895 28.744 1.00 34.30 H new ATOM 0 HG23 THR A 51 7.765 25.810 29.289 1.00 34.30 H new ATOM 517 N ALA A 52 5.947 30.471 28.752 1.00 35.52 N ATOM 518 CA ALA A 52 5.079 31.604 28.380 1.00 35.35 C ATOM 519 C ALA A 52 4.205 31.219 27.181 1.00 34.91 C ATOM 520 O ALA A 52 3.051 31.640 27.084 1.00 35.59 O ATOM 521 CB ALA A 52 5.933 32.847 28.049 1.00 35.51 C ATOM 0 H ALA A 52 6.785 30.630 28.645 1.00 35.52 H new ATOM 0 HA ALA A 52 4.503 31.820 29.130 1.00 35.35 H new ATOM 0 HB1 ALA A 52 5.351 33.584 27.806 1.00 35.51 H new ATOM 0 HB2 ALA A 52 6.460 33.094 28.825 1.00 35.51 H new ATOM 0 HB3 ALA A 52 6.525 32.645 27.308 1.00 35.51 H new ATOM 522 N VAL A 53 4.769 30.402 26.294 1.00 33.25 N ATOM 523 CA VAL A 53 4.076 29.863 25.140 1.00 31.65 C ATOM 524 C VAL A 53 3.742 28.396 25.443 1.00 30.21 C ATOM 525 O VAL A 53 4.321 27.826 26.378 1.00 28.25 O ATOM 526 CB VAL A 53 4.931 30.028 23.809 1.00 32.90 C ATOM 527 CG1 VAL A 53 5.703 31.365 23.794 1.00 32.51 C ATOM 528 CG2 VAL A 53 5.900 28.889 23.619 1.00 32.04 C ATOM 0 H VAL A 53 5.587 30.142 26.353 1.00 33.25 H new ATOM 0 HA VAL A 53 3.256 30.356 24.979 1.00 31.65 H new ATOM 0 HB VAL A 53 4.297 30.021 23.075 1.00 32.90 H new ATOM 0 HG11 VAL A 53 6.213 31.435 22.972 1.00 32.51 H new ATOM 0 HG12 VAL A 53 5.075 32.102 23.848 1.00 32.51 H new ATOM 0 HG13 VAL A 53 6.307 31.399 24.552 1.00 32.51 H new ATOM 0 HG21 VAL A 53 6.402 29.024 22.800 1.00 32.04 H new ATOM 0 HG22 VAL A 53 6.512 28.856 24.371 1.00 32.04 H new ATOM 0 HG23 VAL A 53 5.411 28.053 23.564 1.00 32.04 H new ATOM 529 N PRO A 54 2.791 27.783 24.678 1.00 29.24 N ATOM 530 CA PRO A 54 2.411 26.390 25.006 1.00 28.47 C ATOM 531 C PRO A 54 3.589 25.409 25.108 1.00 28.22 C ATOM 532 O PRO A 54 4.564 25.454 24.316 1.00 26.57 O ATOM 533 CB PRO A 54 1.444 26.020 23.882 1.00 28.57 C ATOM 534 CG PRO A 54 0.762 27.339 23.575 1.00 28.50 C ATOM 535 CD PRO A 54 1.880 28.367 23.667 1.00 29.15 C ATOM 0 HA PRO A 54 2.022 26.330 25.893 1.00 28.47 H new ATOM 0 HB2 PRO A 54 1.910 25.668 23.108 1.00 28.57 H new ATOM 0 HB3 PRO A 54 0.808 25.343 24.163 1.00 28.57 H new ATOM 0 HG2 PRO A 54 0.358 27.332 22.693 1.00 28.50 H new ATOM 0 HG3 PRO A 54 0.054 27.528 24.210 1.00 28.50 H new ATOM 0 HD2 PRO A 54 2.324 28.492 22.814 1.00 29.15 H new ATOM 0 HD3 PRO A 54 1.547 29.235 23.943 1.00 29.15 H new ATOM 536 N TYR A 55 3.510 24.555 26.122 1.00 28.13 N ATOM 537 CA TYR A 55 4.613 23.686 26.477 1.00 27.81 C ATOM 538 C TYR A 55 4.634 22.452 25.548 1.00 27.75 C ATOM 539 O TYR A 55 3.582 21.852 25.283 1.00 27.06 O ATOM 540 CB TYR A 55 4.477 23.297 27.945 1.00 28.28 C ATOM 541 CG TYR A 55 5.367 22.156 28.323 1.00 30.81 C ATOM 542 CD1 TYR A 55 6.728 22.366 28.565 1.00 31.11 C ATOM 543 CD2 TYR A 55 4.856 20.836 28.412 1.00 31.92 C ATOM 544 CE1 TYR A 55 7.574 21.285 28.902 1.00 32.23 C ATOM 545 CE2 TYR A 55 5.677 19.770 28.774 1.00 30.87 C ATOM 546 CZ TYR A 55 7.039 19.994 29.007 1.00 31.44 C ATOM 547 OH TYR A 55 7.855 18.934 29.343 1.00 30.52 O ATOM 0 H TYR A 55 2.815 24.466 26.620 1.00 28.13 H new ATOM 0 HA TYR A 55 5.459 24.145 26.359 1.00 27.81 H new ATOM 0 HB2 TYR A 55 4.687 24.064 28.500 1.00 28.28 H new ATOM 0 HB3 TYR A 55 3.555 23.058 28.129 1.00 28.28 H new ATOM 0 HD1 TYR A 55 7.080 23.225 28.504 1.00 31.11 H new ATOM 0 HD2 TYR A 55 3.958 20.679 28.226 1.00 31.92 H new ATOM 0 HE1 TYR A 55 8.480 21.430 29.053 1.00 32.23 H new ATOM 0 HE2 TYR A 55 5.322 18.915 28.860 1.00 30.87 H new ATOM 0 HH TYR A 55 7.401 18.228 29.369 1.00 30.52 H new ATOM 548 N LEU A 56 5.811 22.106 25.019 1.00 25.60 N ATOM 549 CA LEU A 56 5.928 20.965 24.126 1.00 24.23 C ATOM 550 C LEU A 56 6.412 19.765 24.914 1.00 24.35 C ATOM 551 O LEU A 56 7.494 19.793 25.485 1.00 23.39 O ATOM 552 CB LEU A 56 6.891 21.278 22.963 1.00 23.84 C ATOM 553 CG LEU A 56 7.066 20.114 21.974 1.00 23.27 C ATOM 554 CD1 LEU A 56 5.755 19.888 21.246 1.00 24.10 C ATOM 555 CD2 LEU A 56 8.178 20.394 20.985 1.00 21.44 C ATOM 0 H LEU A 56 6.549 22.522 25.168 1.00 25.60 H new ATOM 0 HA LEU A 56 5.059 20.768 23.743 1.00 24.23 H new ATOM 0 HB2 LEU A 56 6.563 22.054 22.482 1.00 23.84 H new ATOM 0 HB3 LEU A 56 7.758 21.516 23.327 1.00 23.84 H new ATOM 0 HG LEU A 56 7.312 19.316 22.467 1.00 23.27 H new ATOM 0 HD11 LEU A 56 5.855 19.155 20.619 1.00 24.10 H new ATOM 0 HD12 LEU A 56 5.061 19.671 21.888 1.00 24.10 H new ATOM 0 HD13 LEU A 56 5.509 20.693 20.764 1.00 24.10 H new ATOM 0 HD21 LEU A 56 8.265 19.645 20.375 1.00 21.44 H new ATOM 0 HD22 LEU A 56 7.970 21.197 20.482 1.00 21.44 H new ATOM 0 HD23 LEU A 56 9.012 20.520 21.463 1.00 21.44 H new ATOM 556 N ASP A 57 5.617 18.704 24.959 1.00 25.03 N ATOM 557 CA ASP A 57 6.051 17.510 25.660 1.00 25.77 C ATOM 558 C ASP A 57 6.729 16.590 24.667 1.00 25.31 C ATOM 559 O ASP A 57 6.129 16.185 23.670 1.00 25.49 O ATOM 560 CB ASP A 57 4.864 16.809 26.338 1.00 26.85 C ATOM 561 CG ASP A 57 5.288 15.601 27.208 1.00 29.87 C ATOM 562 OD1 ASP A 57 6.476 15.503 27.657 1.00 29.00 O ATOM 563 OD2 ASP A 57 4.392 14.748 27.452 1.00 34.31 O ATOM 0 H ASP A 57 4.838 18.656 24.597 1.00 25.03 H new ATOM 0 HA ASP A 57 6.677 17.752 26.360 1.00 25.77 H new ATOM 0 HB2 ASP A 57 4.391 17.449 26.892 1.00 26.85 H new ATOM 0 HB3 ASP A 57 4.242 16.508 25.658 1.00 26.85 H new ATOM 564 N VAL A 58 7.999 16.287 24.910 1.00 24.86 N ATOM 565 CA VAL A 58 8.699 15.318 24.089 1.00 24.01 C ATOM 566 C VAL A 58 9.165 14.158 24.978 1.00 24.01 C ATOM 567 O VAL A 58 10.074 13.421 24.599 1.00 24.07 O ATOM 568 CB VAL A 58 9.909 15.957 23.358 1.00 23.98 C ATOM 569 CG1 VAL A 58 9.453 17.111 22.451 1.00 22.51 C ATOM 570 CG2 VAL A 58 10.961 16.443 24.385 1.00 23.68 C ATOM 0 H VAL A 58 8.469 16.631 25.543 1.00 24.86 H new ATOM 0 HA VAL A 58 8.092 14.991 23.407 1.00 24.01 H new ATOM 0 HB VAL A 58 10.320 15.282 22.795 1.00 23.98 H new ATOM 0 HG11 VAL A 58 10.223 17.496 22.004 1.00 22.51 H new ATOM 0 HG12 VAL A 58 8.830 16.775 21.788 1.00 22.51 H new ATOM 0 HG13 VAL A 58 9.018 17.792 22.987 1.00 22.51 H new ATOM 0 HG21 VAL A 58 11.712 16.840 23.916 1.00 23.68 H new ATOM 0 HG22 VAL A 58 10.560 17.104 24.971 1.00 23.68 H new ATOM 0 HG23 VAL A 58 11.271 15.690 24.912 1.00 23.68 H new ATOM 571 N GLY A 59 8.574 14.023 26.167 1.00 23.63 N ATOM 572 CA GLY A 59 8.950 12.931 27.086 1.00 23.58 C ATOM 573 C GLY A 59 10.246 13.224 27.830 1.00 23.41 C ATOM 574 O GLY A 59 10.654 14.389 27.938 1.00 24.75 O ATOM 0 H GLY A 59 7.958 14.545 26.463 1.00 23.63 H new ATOM 0 HA2 GLY A 59 8.236 12.790 27.727 1.00 23.58 H new ATOM 0 HA3 GLY A 59 9.047 12.107 26.584 1.00 23.58 H new ATOM 575 N ARG A 60 10.878 12.190 28.384 1.00 22.46 N ATOM 576 CA ARG A 60 12.057 12.399 29.221 1.00 21.84 C ATOM 577 C ARG A 60 13.327 12.261 28.394 1.00 20.49 C ATOM 578 O ARG A 60 13.615 11.183 27.870 1.00 20.16 O ATOM 579 CB ARG A 60 12.122 11.405 30.382 1.00 23.16 C ATOM 580 CG ARG A 60 12.913 11.933 31.624 1.00 26.51 C ATOM 581 CD ARG A 60 13.316 10.824 32.620 1.00 30.44 C ATOM 582 NE ARG A 60 14.293 9.888 32.046 1.00 34.85 N ATOM 583 CZ ARG A 60 14.010 8.686 31.523 1.00 34.90 C ATOM 584 NH1 ARG A 60 12.762 8.218 31.514 1.00 35.25 N ATOM 585 NH2 ARG A 60 14.983 7.929 31.022 1.00 34.36 N ATOM 0 H ARG A 60 10.643 11.368 28.289 1.00 22.46 H new ATOM 0 HA ARG A 60 11.986 13.296 29.584 1.00 21.84 H new ATOM 0 HB2 ARG A 60 11.219 11.181 30.656 1.00 23.16 H new ATOM 0 HB3 ARG A 60 12.535 10.584 30.071 1.00 23.16 H new ATOM 0 HG2 ARG A 60 13.713 12.389 31.318 1.00 26.51 H new ATOM 0 HG3 ARG A 60 12.371 12.591 32.087 1.00 26.51 H new ATOM 0 HD2 ARG A 60 13.689 11.229 33.418 1.00 30.44 H new ATOM 0 HD3 ARG A 60 12.524 10.335 32.894 1.00 30.44 H new ATOM 0 HE ARG A 60 15.118 10.132 32.045 1.00 34.85 H new ATOM 0 HH11 ARG A 60 12.124 8.689 31.847 1.00 35.25 H new ATOM 0 HH12 ARG A 60 12.595 7.445 31.175 1.00 35.25 H new ATOM 0 HH21 ARG A 60 15.796 8.210 31.033 1.00 34.36 H new ATOM 0 HH22 ARG A 60 14.799 7.158 30.687 1.00 34.36 H new ATOM 586 N ILE A 61 14.100 13.348 28.322 1.00 17.95 N ATOM 587 CA ILE A 61 15.392 13.328 27.631 1.00 16.03 C ATOM 588 C ILE A 61 16.450 13.382 28.713 1.00 14.63 C ATOM 589 O ILE A 61 16.340 14.168 29.650 1.00 15.62 O ATOM 590 CB ILE A 61 15.510 14.538 26.619 1.00 16.07 C ATOM 591 CG1 ILE A 61 14.301 14.546 25.673 1.00 15.16 C ATOM 592 CG2 ILE A 61 16.892 14.574 25.934 1.00 13.95 C ATOM 593 CD1 ILE A 61 14.128 13.309 24.783 1.00 14.16 C ATOM 0 H ILE A 61 13.893 14.108 28.668 1.00 17.95 H new ATOM 0 HA ILE A 61 15.499 12.527 27.094 1.00 16.03 H new ATOM 0 HB ILE A 61 15.472 15.380 27.100 1.00 16.07 H new ATOM 0 HG12 ILE A 61 13.498 14.653 26.206 1.00 15.16 H new ATOM 0 HG13 ILE A 61 14.367 15.326 25.101 1.00 15.16 H new ATOM 0 HG21 ILE A 61 16.931 15.326 25.322 1.00 13.95 H new ATOM 0 HG22 ILE A 61 17.584 14.669 26.607 1.00 13.95 H new ATOM 0 HG23 ILE A 61 17.031 13.750 25.442 1.00 13.95 H new ATOM 0 HD11 ILE A 61 13.339 13.417 24.229 1.00 14.16 H new ATOM 0 HD12 ILE A 61 14.909 13.205 24.217 1.00 14.16 H new ATOM 0 HD13 ILE A 61 14.026 12.521 25.340 1.00 14.16 H new ATOM 594 N ASP A 62 17.452 12.517 28.614 1.00 14.00 N ATOM 595 CA ASP A 62 18.443 12.384 29.671 1.00 12.94 C ATOM 596 C ASP A 62 19.702 13.197 29.431 1.00 12.20 C ATOM 597 O ASP A 62 20.293 13.731 30.379 1.00 10.25 O ATOM 598 CB ASP A 62 18.742 10.904 29.897 1.00 13.15 C ATOM 599 CG ASP A 62 17.510 10.167 30.407 1.00 17.85 C ATOM 600 OD1 ASP A 62 16.946 10.625 31.444 1.00 18.12 O ATOM 601 OD2 ASP A 62 17.055 9.201 29.738 1.00 18.54 O ATOM 0 H ASP A 62 17.575 11.997 27.940 1.00 14.00 H new ATOM 0 HA ASP A 62 18.064 12.760 30.481 1.00 12.94 H new ATOM 0 HB2 ASP A 62 19.043 10.501 29.067 1.00 13.15 H new ATOM 0 HB3 ASP A 62 19.466 10.811 30.536 1.00 13.15 H new ATOM 602 N ALA A 63 20.102 13.319 28.165 1.00 11.19 N ATOM 603 CA ALA A 63 21.317 14.087 27.843 1.00 11.68 C ATOM 604 C ALA A 63 21.182 14.708 26.433 1.00 11.32 C ATOM 605 O ALA A 63 20.286 14.312 25.644 1.00 12.39 O ATOM 606 CB ALA A 63 22.578 13.180 27.941 1.00 12.69 C ATOM 0 H ALA A 63 19.698 12.975 27.488 1.00 11.19 H new ATOM 0 HA ALA A 63 21.421 14.805 28.487 1.00 11.68 H new ATOM 0 HB1 ALA A 63 23.368 13.700 27.726 1.00 12.69 H new ATOM 0 HB2 ALA A 63 22.656 12.831 28.843 1.00 12.69 H new ATOM 0 HB3 ALA A 63 22.496 12.443 27.315 1.00 12.69 H new ATOM 607 N ILE A 64 22.060 15.682 26.162 1.00 11.68 N ATOM 608 CA AILE A 64 22.136 16.377 24.870 0.50 11.65 C ATOM 609 CA BILE A 64 22.139 16.393 24.877 0.50 11.19 C ATOM 610 C ILE A 64 23.554 16.259 24.358 1.00 11.25 C ATOM 611 O ILE A 64 24.503 16.565 25.068 1.00 11.90 O ATOM 612 CB AILE A 64 21.799 17.877 25.007 0.50 11.68 C ATOM 613 CB BILE A 64 21.860 17.906 25.041 0.50 10.84 C ATOM 614 CG1AILE A 64 20.372 18.056 25.527 0.50 12.67 C ATOM 615 CG1BILE A 64 20.582 18.134 25.854 0.50 10.13 C ATOM 616 CG2AILE A 64 21.959 18.628 23.658 0.50 11.94 C ATOM 617 CG2BILE A 64 21.760 18.617 23.659 0.50 11.15 C ATOM 618 CD1AILE A 64 20.010 19.500 25.771 0.50 12.41 C ATOM 619 CD1BILE A 64 19.324 17.674 25.140 0.50 5.15 C ATOM 0 H AILE A 64 22.638 15.962 26.734 0.50 11.68 H new ATOM 0 H BILE A 64 22.641 15.954 26.735 0.50 11.68 H new ATOM 0 HA AILE A 64 21.495 15.973 24.265 0.50 11.19 H new ATOM 0 HA BILE A 64 21.479 16.011 24.278 0.50 11.19 H new ATOM 0 HB AILE A 64 22.427 18.258 25.641 0.50 10.84 H new ATOM 0 HB BILE A 64 22.608 18.294 25.522 0.50 10.84 H new ATOM 0 HG12AILE A 64 19.750 17.676 24.887 0.50 10.13 H new ATOM 0 HG12BILE A 64 20.656 17.664 26.699 0.50 10.13 H new ATOM 0 HG13AILE A 64 20.269 17.558 26.353 0.50 10.13 H new ATOM 0 HG13BILE A 64 20.502 19.078 26.060 0.50 10.13 H new ATOM 0 HG21AILE A 64 21.740 19.565 23.781 0.50 11.15 H new ATOM 0 HG21BILE A 64 21.585 19.562 23.793 0.50 11.15 H new ATOM 0 HG22AILE A 64 22.875 18.548 23.350 0.50 11.15 H new ATOM 0 HG22BILE A 64 22.595 18.508 23.178 0.50 11.15 H new ATOM 0 HG23AILE A 64 21.362 18.241 22.999 0.50 11.15 H new ATOM 0 HG23BILE A 64 21.037 18.225 23.145 0.50 11.15 H new ATOM 0 HD11AILE A 64 19.099 19.554 26.098 0.50 5.15 H new ATOM 0 HD11BILE A 64 18.552 17.844 25.702 0.50 5.15 H new ATOM 0 HD12AILE A 64 20.613 19.878 26.430 0.50 5.15 H new ATOM 0 HD12BILE A 64 19.229 18.160 24.306 0.50 5.15 H new ATOM 0 HD13AILE A 64 20.085 19.997 24.942 0.50 5.15 H new ATOM 0 HD13BILE A 64 19.386 16.724 24.955 0.50 5.15 H new ATOM 620 N GLY A 65 23.699 15.784 23.115 1.00 11.10 N ATOM 621 CA GLY A 65 25.030 15.696 22.534 1.00 11.23 C ATOM 622 C GLY A 65 25.130 16.663 21.365 1.00 10.17 C ATOM 623 O GLY A 65 24.103 17.032 20.794 1.00 9.68 O ATOM 0 H GLY A 65 23.056 15.517 22.610 1.00 11.10 H new ATOM 0 HA2 GLY A 65 25.701 15.908 23.202 1.00 11.23 H new ATOM 0 HA3 GLY A 65 25.205 14.790 22.234 1.00 11.23 H new ATOM 624 N GLU A 66 26.351 17.060 21.003 1.00 9.34 N ATOM 625 CA GLU A 66 26.534 17.896 19.792 1.00 9.35 C ATOM 626 C GLU A 66 27.907 17.650 19.157 1.00 9.75 C ATOM 627 O GLU A 66 28.890 17.538 19.883 1.00 11.38 O ATOM 628 CB GLU A 66 26.363 19.385 20.129 1.00 7.87 C ATOM 629 CG GLU A 66 26.200 20.245 18.869 1.00 7.42 C ATOM 630 CD GLU A 66 25.774 21.683 19.175 1.00 9.33 C ATOM 631 OE1 GLU A 66 25.403 21.990 20.357 1.00 9.85 O ATOM 632 OE2 GLU A 66 25.756 22.485 18.223 1.00 10.07 O ATOM 0 H GLU A 66 27.074 16.867 21.426 1.00 9.34 H new ATOM 0 HA GLU A 66 25.852 17.643 19.150 1.00 9.35 H new ATOM 0 HB2 GLU A 66 25.587 19.499 20.700 1.00 7.87 H new ATOM 0 HB3 GLU A 66 27.133 19.692 20.632 1.00 7.87 H new ATOM 0 HG2 GLU A 66 27.039 20.259 18.382 1.00 7.42 H new ATOM 0 HG3 GLU A 66 25.541 19.835 18.287 1.00 7.42 H new ATOM 633 N CYS A 67 27.955 17.563 17.825 1.00 9.78 N ATOM 634 CA CYS A 67 29.201 17.433 17.075 1.00 10.65 C ATOM 635 C CYS A 67 29.351 18.606 16.113 1.00 10.44 C ATOM 636 O CYS A 67 28.360 19.064 15.550 1.00 10.26 O ATOM 637 CB CYS A 67 29.143 16.187 16.210 1.00 11.19 C ATOM 638 SG CYS A 67 29.146 14.648 17.158 1.00 11.91 S ATOM 0 H CYS A 67 27.253 17.578 17.328 1.00 9.78 H new ATOM 0 HA CYS A 67 29.934 17.398 17.710 1.00 10.65 H new ATOM 0 HB2 CYS A 67 28.343 16.219 15.663 1.00 11.19 H new ATOM 0 HB3 CYS A 67 29.901 16.187 15.605 1.00 11.19 H new ATOM 0 HG CYS A 67 28.016 14.310 17.376 1.00 11.91 H new ATOM 639 N TRP A 68 30.583 19.083 15.940 1.00 10.38 N ATOM 640 CA TRP A 68 30.904 20.165 15.000 1.00 10.26 C ATOM 641 C TRP A 68 31.877 19.553 13.998 1.00 11.11 C ATOM 642 O TRP A 68 32.856 18.889 14.407 1.00 12.23 O ATOM 643 CB TRP A 68 31.686 21.250 15.702 1.00 9.62 C ATOM 644 CG TRP A 68 30.918 22.291 16.569 1.00 10.08 C ATOM 645 CD1 TRP A 68 30.721 23.632 16.283 1.00 9.07 C ATOM 646 CD2 TRP A 68 30.305 22.054 17.836 1.00 9.01 C ATOM 647 NE1 TRP A 68 30.019 24.228 17.313 1.00 13.13 N ATOM 648 CE2 TRP A 68 29.752 23.280 18.275 1.00 9.32 C ATOM 649 CE3 TRP A 68 30.169 20.910 18.653 1.00 10.02 C ATOM 650 CZ2 TRP A 68 29.085 23.399 19.506 1.00 11.20 C ATOM 651 CZ3 TRP A 68 29.519 21.040 19.882 1.00 8.55 C ATOM 652 CH2 TRP A 68 28.968 22.246 20.283 1.00 7.48 C ATOM 0 H TRP A 68 31.266 18.785 16.369 1.00 10.38 H new ATOM 0 HA TRP A 68 30.092 20.528 14.612 1.00 10.26 H new ATOM 0 HB2 TRP A 68 32.339 20.817 16.274 1.00 9.62 H new ATOM 0 HB3 TRP A 68 32.180 21.739 15.026 1.00 9.62 H new ATOM 0 HD1 TRP A 68 31.016 24.065 15.515 1.00 9.07 H new ATOM 0 HE1 TRP A 68 29.787 25.055 17.348 1.00 13.13 H new ATOM 0 HE3 TRP A 68 30.505 20.088 18.378 1.00 10.02 H new ATOM 0 HZ2 TRP A 68 28.736 24.213 19.791 1.00 11.20 H new ATOM 0 HZ3 TRP A 68 29.455 20.301 20.443 1.00 8.55 H new ATOM 0 HH2 TRP A 68 28.509 22.288 21.090 1.00 7.48 H new ATOM 653 N PHE A 69 31.668 19.816 12.710 1.00 10.36 N ATOM 654 CA PHE A 69 32.577 19.365 11.636 1.00 10.59 C ATOM 655 C PHE A 69 32.962 20.549 10.789 1.00 10.35 C ATOM 656 O PHE A 69 32.099 21.294 10.335 1.00 10.14 O ATOM 657 CB PHE A 69 31.884 18.319 10.757 1.00 10.35 C ATOM 658 CG PHE A 69 31.342 17.144 11.527 1.00 10.79 C ATOM 659 CD1 PHE A 69 32.192 16.096 11.879 1.00 12.08 C ATOM 660 CD2 PHE A 69 29.981 17.086 11.907 1.00 12.06 C ATOM 661 CE1 PHE A 69 31.704 14.976 12.615 1.00 11.66 C ATOM 662 CE2 PHE A 69 29.480 15.972 12.637 1.00 14.08 C ATOM 663 CZ PHE A 69 30.344 14.923 13.004 1.00 13.17 C ATOM 0 H PHE A 69 30.992 20.264 12.425 1.00 10.36 H new ATOM 0 HA PHE A 69 33.367 18.967 12.034 1.00 10.59 H new ATOM 0 HB2 PHE A 69 31.157 18.743 10.276 1.00 10.35 H new ATOM 0 HB3 PHE A 69 32.514 17.998 10.093 1.00 10.35 H new ATOM 0 HD1 PHE A 69 33.088 16.128 11.631 1.00 12.08 H new ATOM 0 HD2 PHE A 69 29.408 17.782 11.678 1.00 12.06 H new ATOM 0 HE1 PHE A 69 32.279 14.281 12.839 1.00 11.66 H new ATOM 0 HE2 PHE A 69 28.581 15.937 12.872 1.00 14.08 H new ATOM 0 HZ PHE A 69 30.024 14.202 13.497 1.00 13.17 H new ATOM 664 N ALA A 70 34.255 20.735 10.559 1.00 10.36 N ATOM 665 CA ALA A 70 34.737 21.979 9.953 1.00 10.96 C ATOM 666 C ALA A 70 34.482 22.070 8.441 1.00 12.38 C ATOM 667 O ALA A 70 34.548 23.176 7.872 1.00 12.75 O ATOM 668 CB ALA A 70 36.177 22.155 10.216 1.00 11.36 C ATOM 0 H ALA A 70 34.869 20.161 10.743 1.00 10.36 H new ATOM 0 HA ALA A 70 34.226 22.690 10.369 1.00 10.96 H new ATOM 0 HB1 ALA A 70 36.482 22.981 9.810 1.00 11.36 H new ATOM 0 HB2 ALA A 70 36.329 22.191 11.173 1.00 11.36 H new ATOM 0 HB3 ALA A 70 36.669 21.409 9.838 1.00 11.36 H new ATOM 669 N SER A 71 34.192 20.944 7.799 1.00 12.42 N ATOM 670 CA SER A 71 33.927 20.953 6.332 1.00 12.91 C ATOM 671 C SER A 71 33.239 19.664 5.927 1.00 14.08 C ATOM 672 O SER A 71 33.212 18.672 6.699 1.00 12.79 O ATOM 673 CB SER A 71 35.266 21.027 5.573 1.00 13.00 C ATOM 674 OG SER A 71 35.963 19.792 5.768 1.00 15.28 O ATOM 0 H SER A 71 34.141 20.171 8.172 1.00 12.42 H new ATOM 0 HA SER A 71 33.367 21.716 6.120 1.00 12.91 H new ATOM 0 HB2 SER A 71 35.111 21.182 4.628 1.00 13.00 H new ATOM 0 HB3 SER A 71 35.798 21.770 5.898 1.00 13.00 H new ATOM 0 HG SER A 71 36.686 19.807 5.340 1.00 15.28 H new ATOM 675 N GLU A 72 32.693 19.677 4.711 1.00 14.80 N ATOM 676 CA AGLU A 72 32.055 18.504 4.136 0.50 16.14 C ATOM 677 CA BGLU A 72 32.052 18.511 4.153 0.50 16.16 C ATOM 678 C GLU A 72 33.061 17.368 4.056 1.00 16.12 C ATOM 679 O GLU A 72 32.733 16.218 4.357 1.00 16.33 O ATOM 680 CB AGLU A 72 31.498 18.813 2.736 0.50 16.67 C ATOM 681 CB BGLU A 72 31.456 18.865 2.786 0.50 16.76 C ATOM 682 CG AGLU A 72 32.210 18.141 1.561 0.50 18.82 C ATOM 683 CG BGLU A 72 30.358 19.936 2.898 0.50 18.88 C ATOM 684 CD AGLU A 72 31.296 17.993 0.365 0.50 22.11 C ATOM 685 CD BGLU A 72 29.808 20.380 1.557 0.50 22.96 C ATOM 686 OE1AGLU A 72 31.646 17.253 -0.575 0.50 25.42 O ATOM 687 OE1BGLU A 72 30.527 20.265 0.537 0.50 24.76 O ATOM 688 OE2AGLU A 72 30.214 18.611 0.378 0.50 23.19 O ATOM 689 OE2BGLU A 72 28.658 20.868 1.529 0.50 25.01 O ATOM 0 H AGLU A 72 32.684 20.368 4.200 0.50 14.80 H new ATOM 0 H BGLU A 72 32.689 20.365 4.195 0.50 14.80 H new ATOM 0 HA AGLU A 72 31.314 18.243 4.705 0.50 16.16 H new ATOM 0 HA BGLU A 72 31.328 18.217 4.728 0.50 16.16 H new ATOM 0 HB2AGLU A 72 30.564 18.552 2.715 0.50 16.76 H new ATOM 0 HB2BGLU A 72 32.160 19.184 2.200 0.50 16.76 H new ATOM 0 HB3AGLU A 72 31.528 19.773 2.601 0.50 16.76 H new ATOM 0 HB3BGLU A 72 31.087 18.066 2.378 0.50 16.76 H new ATOM 0 HG2AGLU A 72 32.988 18.664 1.312 0.50 18.88 H new ATOM 0 HG2BGLU A 72 29.631 19.589 3.439 0.50 18.88 H new ATOM 0 HG3AGLU A 72 32.531 17.267 1.834 0.50 18.88 H new ATOM 0 HG3BGLU A 72 30.715 20.708 3.365 0.50 18.88 H new ATOM 690 N GLU A 73 34.295 17.679 3.670 1.00 15.23 N ATOM 691 CA GLU A 73 35.312 16.613 3.628 1.00 16.66 C ATOM 692 C GLU A 73 35.604 16.019 5.014 1.00 16.47 C ATOM 693 O GLU A 73 35.842 14.810 5.146 1.00 17.19 O ATOM 694 CB GLU A 73 36.612 17.090 2.966 1.00 15.50 C ATOM 695 CG GLU A 73 36.396 17.506 1.476 1.00 18.28 C ATOM 696 CD GLU A 73 36.195 19.026 1.284 1.00 19.52 C ATOM 697 OE1 GLU A 73 35.690 19.715 2.195 1.00 20.97 O ATOM 698 OE2 GLU A 73 36.530 19.531 0.197 1.00 18.31 O ATOM 0 H GLU A 73 34.563 18.462 3.437 1.00 15.23 H new ATOM 0 HA GLU A 73 34.933 15.906 3.082 1.00 16.66 H new ATOM 0 HB2 GLU A 73 36.968 17.843 3.462 1.00 15.50 H new ATOM 0 HB3 GLU A 73 37.274 16.383 3.010 1.00 15.50 H new ATOM 0 HG2 GLU A 73 37.161 17.220 0.953 1.00 18.28 H new ATOM 0 HG3 GLU A 73 35.622 17.038 1.126 1.00 18.28 H new ATOM 699 N GLN A 74 35.657 16.865 6.027 1.00 16.52 N ATOM 700 CA GLN A 74 35.971 16.364 7.359 1.00 17.25 C ATOM 701 C GLN A 74 34.805 15.504 7.849 1.00 17.61 C ATOM 702 O GLN A 74 35.007 14.437 8.430 1.00 17.31 O ATOM 703 CB GLN A 74 36.315 17.503 8.317 1.00 16.26 C ATOM 704 CG GLN A 74 37.701 18.146 8.057 1.00 18.37 C ATOM 705 CD GLN A 74 38.890 17.273 8.473 1.00 22.02 C ATOM 706 OE1 GLN A 74 39.018 17.039 9.751 1.00 25.98 O flip ATOM 707 NE2 GLN A 74 39.686 16.840 7.644 1.00 17.89 N flip ATOM 0 H GLN A 74 35.519 17.712 5.973 1.00 16.52 H new ATOM 0 HA GLN A 74 36.765 15.808 7.324 1.00 17.25 H new ATOM 0 HB2 GLN A 74 35.632 18.189 8.248 1.00 16.26 H new ATOM 0 HB3 GLN A 74 36.290 17.167 9.227 1.00 16.26 H new ATOM 0 HG2 GLN A 74 37.779 18.351 7.112 1.00 18.37 H new ATOM 0 HG3 GLN A 74 37.749 18.989 8.535 1.00 18.37 H new ATOM 0 HE21 GLN A 74 39.573 17.012 6.809 1.00 17.89 H new ATOM 0 HE22 GLN A 74 40.356 16.365 7.899 1.00 17.89 H new ATOM 708 N TYR A 75 33.575 15.941 7.571 1.00 18.29 N ATOM 709 CA TYR A 75 32.429 15.096 7.916 1.00 20.03 C ATOM 710 C TYR A 75 32.537 13.728 7.253 1.00 20.76 C ATOM 711 O TYR A 75 32.278 12.696 7.884 1.00 19.83 O ATOM 712 CB TYR A 75 31.124 15.765 7.530 1.00 19.44 C ATOM 713 CG TYR A 75 29.922 14.941 7.878 1.00 24.22 C ATOM 714 CD1 TYR A 75 29.567 14.725 9.208 1.00 25.08 C ATOM 715 CD2 TYR A 75 29.113 14.386 6.879 1.00 25.97 C ATOM 716 CE1 TYR A 75 28.437 13.967 9.541 1.00 29.66 C ATOM 717 CE2 TYR A 75 27.968 13.638 7.210 1.00 28.86 C ATOM 718 CZ TYR A 75 27.652 13.430 8.535 1.00 31.22 C ATOM 719 OH TYR A 75 26.547 12.683 8.888 1.00 34.67 O ATOM 0 H TYR A 75 33.386 16.693 7.198 1.00 18.29 H new ATOM 0 HA TYR A 75 32.437 14.971 8.878 1.00 20.03 H new ATOM 0 HB2 TYR A 75 31.062 16.624 7.976 1.00 19.44 H new ATOM 0 HB3 TYR A 75 31.125 15.940 6.576 1.00 19.44 H new ATOM 0 HD1 TYR A 75 30.089 15.090 9.886 1.00 25.08 H new ATOM 0 HD2 TYR A 75 29.335 14.513 5.985 1.00 25.97 H new ATOM 0 HE1 TYR A 75 28.215 13.825 10.433 1.00 29.66 H new ATOM 0 HE2 TYR A 75 27.428 13.286 6.539 1.00 28.86 H new ATOM 0 HH TYR A 75 26.790 11.910 9.110 1.00 34.67 H new ATOM 720 N GLN A 76 32.922 13.715 5.978 1.00 21.37 N ATOM 721 CA GLN A 76 33.144 12.425 5.304 1.00 22.98 C ATOM 722 C GLN A 76 34.257 11.559 5.909 1.00 22.84 C ATOM 723 O GLN A 76 34.090 10.361 5.969 1.00 24.55 O ATOM 724 CB GLN A 76 33.293 12.584 3.770 1.00 23.60 C ATOM 725 CG GLN A 76 32.028 13.041 3.095 1.00 25.79 C ATOM 726 CD GLN A 76 30.849 12.079 3.325 1.00 32.61 C ATOM 727 OE1 GLN A 76 29.731 12.524 3.595 1.00 35.90 O ATOM 728 NE2 GLN A 76 31.100 10.764 3.237 1.00 32.55 N ATOM 0 H GLN A 76 33.058 14.413 5.495 1.00 21.37 H new ATOM 0 HA GLN A 76 32.331 11.923 5.471 1.00 22.98 H new ATOM 0 HB2 GLN A 76 34.000 13.221 3.584 1.00 23.60 H new ATOM 0 HB3 GLN A 76 33.568 11.736 3.388 1.00 23.60 H new ATOM 0 HG2 GLN A 76 31.790 13.922 3.425 1.00 25.79 H new ATOM 0 HG3 GLN A 76 32.188 13.128 2.142 1.00 25.79 H new ATOM 0 HE21 GLN A 76 31.892 10.489 3.047 1.00 32.55 H new ATOM 0 HE22 GLN A 76 30.469 10.196 3.371 1.00 32.55 H new ATOM 729 N VAL A 77 35.366 12.145 6.364 1.00 23.27 N ATOM 730 CA VAL A 77 36.436 11.378 7.016 1.00 24.12 C ATOM 731 C VAL A 77 35.861 10.681 8.291 1.00 25.29 C ATOM 732 O VAL A 77 36.101 9.472 8.556 1.00 24.96 O ATOM 733 CB VAL A 77 37.630 12.286 7.370 1.00 24.30 C ATOM 734 CG1 VAL A 77 38.595 11.631 8.384 1.00 24.02 C ATOM 735 CG2 VAL A 77 38.389 12.762 6.079 1.00 24.18 C ATOM 0 H VAL A 77 35.520 12.989 6.305 1.00 23.27 H new ATOM 0 HA VAL A 77 36.763 10.701 6.403 1.00 24.12 H new ATOM 0 HB VAL A 77 37.262 13.070 7.806 1.00 24.30 H new ATOM 0 HG11 VAL A 77 39.327 12.239 8.574 1.00 24.02 H new ATOM 0 HG12 VAL A 77 38.117 11.434 9.205 1.00 24.02 H new ATOM 0 HG13 VAL A 77 38.948 10.808 8.010 1.00 24.02 H new ATOM 0 HG21 VAL A 77 39.133 13.330 6.332 1.00 24.18 H new ATOM 0 HG22 VAL A 77 38.722 11.990 5.596 1.00 24.18 H new ATOM 0 HG23 VAL A 77 37.781 13.260 5.511 1.00 24.18 H new ATOM 736 N TYR A 78 35.090 11.455 9.051 1.00 24.84 N ATOM 737 CA TYR A 78 34.371 10.945 10.220 1.00 25.77 C ATOM 738 C TYR A 78 33.448 9.789 9.847 1.00 26.86 C ATOM 739 O TYR A 78 33.586 8.688 10.382 1.00 27.73 O ATOM 740 CB TYR A 78 33.587 12.097 10.871 1.00 24.59 C ATOM 741 CG TYR A 78 32.562 11.704 11.914 1.00 21.61 C ATOM 742 CD1 TYR A 78 32.970 11.311 13.188 1.00 18.20 C ATOM 743 CD2 TYR A 78 31.174 11.789 11.635 1.00 19.82 C ATOM 744 CE1 TYR A 78 32.009 10.988 14.173 1.00 21.06 C ATOM 745 CE2 TYR A 78 30.211 11.494 12.610 1.00 19.57 C ATOM 746 CZ TYR A 78 30.656 11.079 13.880 1.00 19.28 C ATOM 747 OH TYR A 78 29.741 10.752 14.840 1.00 21.14 O ATOM 0 H TYR A 78 34.968 12.293 8.904 1.00 24.84 H new ATOM 0 HA TYR A 78 35.013 10.595 10.858 1.00 25.77 H new ATOM 0 HB2 TYR A 78 34.222 12.704 11.282 1.00 24.59 H new ATOM 0 HB3 TYR A 78 33.134 12.592 10.170 1.00 24.59 H new ATOM 0 HD1 TYR A 78 33.876 11.261 13.390 1.00 18.20 H new ATOM 0 HD2 TYR A 78 30.896 12.046 10.786 1.00 19.82 H new ATOM 0 HE1 TYR A 78 32.284 10.714 15.018 1.00 21.06 H new ATOM 0 HE2 TYR A 78 29.303 11.570 12.423 1.00 19.57 H new ATOM 0 HH TYR A 78 28.969 10.936 14.566 1.00 21.14 H new ATOM 748 N MET A 79 32.519 10.046 8.925 1.00 29.07 N ATOM 749 CA MET A 79 31.505 9.072 8.532 1.00 31.50 C ATOM 750 C MET A 79 32.096 7.799 7.970 1.00 33.12 C ATOM 751 O MET A 79 31.442 6.753 7.989 1.00 33.49 O ATOM 752 CB MET A 79 30.518 9.654 7.518 1.00 31.30 C ATOM 753 CG MET A 79 29.582 10.704 8.069 1.00 33.37 C ATOM 754 SD MET A 79 28.382 10.171 9.328 1.00 37.92 S ATOM 755 CE MET A 79 27.147 9.375 8.313 1.00 37.93 C ATOM 0 H MET A 79 32.461 10.796 8.508 1.00 29.07 H new ATOM 0 HA MET A 79 31.034 8.852 9.351 1.00 31.50 H new ATOM 0 HB2 MET A 79 31.020 10.041 6.784 1.00 31.30 H new ATOM 0 HB3 MET A 79 29.989 8.929 7.149 1.00 31.30 H new ATOM 0 HG2 MET A 79 30.120 11.416 8.449 1.00 33.37 H new ATOM 0 HG3 MET A 79 29.089 11.086 7.326 1.00 33.37 H new ATOM 0 HE1 MET A 79 26.433 9.038 8.876 1.00 37.93 H new ATOM 0 HE2 MET A 79 26.785 10.016 7.681 1.00 37.93 H new ATOM 0 HE3 MET A 79 27.552 8.638 7.829 1.00 37.93 H new ATOM 756 N GLU A 80 33.337 7.884 7.494 1.00 35.36 N ATOM 757 CA GLU A 80 34.061 6.711 6.990 1.00 37.15 C ATOM 758 C GLU A 80 34.894 6.021 8.072 1.00 37.39 C ATOM 759 O GLU A 80 35.360 4.908 7.867 1.00 38.47 O ATOM 760 CB GLU A 80 34.984 7.114 5.819 1.00 37.57 C ATOM 761 CG GLU A 80 34.248 7.381 4.520 1.00 40.14 C ATOM 762 CD GLU A 80 34.974 8.379 3.595 1.00 43.16 C ATOM 763 OE1 GLU A 80 36.203 8.621 3.769 1.00 43.82 O ATOM 764 OE2 GLU A 80 34.296 8.922 2.684 1.00 43.08 O ATOM 0 H GLU A 80 33.783 8.618 7.453 1.00 35.36 H new ATOM 0 HA GLU A 80 33.389 6.080 6.687 1.00 37.15 H new ATOM 0 HB2 GLU A 80 35.480 7.909 6.069 1.00 37.57 H new ATOM 0 HB3 GLU A 80 35.634 6.409 5.673 1.00 37.57 H new ATOM 0 HG2 GLU A 80 34.126 6.543 4.047 1.00 40.14 H new ATOM 0 HG3 GLU A 80 33.363 7.723 4.722 1.00 40.14 H new ATOM 765 N SER A 81 35.095 6.680 9.208 1.00 37.45 N ATOM 766 CA SER A 81 36.058 6.227 10.206 1.00 37.58 C ATOM 767 C SER A 81 35.622 4.926 10.923 1.00 37.70 C ATOM 768 O SER A 81 34.435 4.738 11.239 1.00 37.46 O ATOM 769 CB SER A 81 36.303 7.334 11.238 1.00 37.44 C ATOM 770 OG SER A 81 37.316 6.979 12.175 1.00 39.07 O ATOM 0 H SER A 81 34.678 7.401 9.422 1.00 37.45 H new ATOM 0 HA SER A 81 36.879 6.025 9.731 1.00 37.58 H new ATOM 0 HB2 SER A 81 36.559 8.150 10.780 1.00 37.44 H new ATOM 0 HB3 SER A 81 35.477 7.521 11.712 1.00 37.44 H new ATOM 0 HG SER A 81 37.938 6.579 11.777 1.00 39.07 H new ATOM 771 N ASP A 82 36.598 4.042 11.138 1.00 37.66 N ATOM 772 CA ASP A 82 36.444 2.827 11.937 1.00 37.78 C ATOM 773 C ASP A 82 36.270 3.257 13.383 1.00 37.09 C ATOM 774 O ASP A 82 35.465 2.680 14.127 1.00 36.86 O ATOM 775 CB ASP A 82 37.717 1.981 11.837 1.00 38.01 C ATOM 776 CG ASP A 82 37.650 0.923 10.741 1.00 39.64 C ATOM 777 OD1 ASP A 82 36.578 0.731 10.121 1.00 42.56 O ATOM 778 OD2 ASP A 82 38.681 0.260 10.516 1.00 40.97 O ATOM 0 H ASP A 82 37.389 4.136 10.814 1.00 37.66 H new ATOM 0 HA ASP A 82 35.686 2.309 11.623 1.00 37.78 H new ATOM 0 HB2 ASP A 82 38.474 2.564 11.670 1.00 38.01 H new ATOM 0 HB3 ASP A 82 37.877 1.546 12.689 1.00 38.01 H new ATOM 779 N ILE A 83 37.059 4.264 13.761 1.00 36.45 N ATOM 780 CA ILE A 83 37.026 4.853 15.099 1.00 35.58 C ATOM 781 C ILE A 83 35.645 5.421 15.474 1.00 34.89 C ATOM 782 O ILE A 83 35.248 5.317 16.648 1.00 35.09 O ATOM 783 CB ILE A 83 38.140 5.878 15.287 1.00 35.81 C ATOM 784 CG1 ILE A 83 39.494 5.162 15.178 1.00 34.84 C ATOM 785 CG2 ILE A 83 37.976 6.635 16.624 1.00 35.36 C ATOM 786 CD1 ILE A 83 40.707 6.064 15.312 1.00 35.97 C ATOM 0 H ILE A 83 37.637 4.629 13.239 1.00 36.45 H new ATOM 0 HA ILE A 83 37.190 4.128 15.722 1.00 35.58 H new ATOM 0 HB ILE A 83 38.093 6.551 14.590 1.00 35.81 H new ATOM 0 HG12 ILE A 83 39.539 4.477 15.864 1.00 34.84 H new ATOM 0 HG13 ILE A 83 39.537 4.709 14.321 1.00 34.84 H new ATOM 0 HG21 ILE A 83 38.694 7.280 16.721 1.00 35.36 H new ATOM 0 HG22 ILE A 83 37.123 7.098 16.632 1.00 35.36 H new ATOM 0 HG23 ILE A 83 38.007 6.003 17.360 1.00 35.36 H new ATOM 0 HD11 ILE A 83 41.515 5.534 15.232 1.00 35.97 H new ATOM 0 HD12 ILE A 83 40.690 6.735 14.612 1.00 35.97 H new ATOM 0 HD13 ILE A 83 40.692 6.500 16.178 1.00 35.97 H new ATOM 787 N ARG A 84 34.935 5.995 14.489 1.00 33.49 N ATOM 788 CA AARG A 84 33.568 6.410 14.706 0.50 32.70 C ATOM 789 CA BARG A 84 33.525 6.407 14.643 0.50 32.14 C ATOM 790 C ARG A 84 32.682 5.186 14.956 1.00 32.38 C ATOM 791 O ARG A 84 31.814 5.216 15.829 1.00 31.08 O ATOM 792 CB AARG A 84 33.068 7.208 13.513 0.50 32.73 C ATOM 793 CB BARG A 84 32.954 7.080 13.371 0.50 31.79 C ATOM 794 CG AARG A 84 31.639 7.644 13.638 0.50 32.51 C ATOM 795 CG BARG A 84 31.391 7.226 13.367 0.50 28.95 C ATOM 796 CD AARG A 84 31.117 7.964 12.284 0.50 32.29 C ATOM 797 CD BARG A 84 30.785 7.612 11.995 0.50 25.30 C ATOM 798 NE AARG A 84 31.594 6.971 11.332 0.50 32.02 N ATOM 799 NE BARG A 84 29.331 7.845 12.000 0.50 18.36 N ATOM 800 CZ AARG A 84 31.000 5.800 11.132 0.50 29.86 C ATOM 801 CZ BARG A 84 28.408 6.933 11.682 0.50 18.21 C ATOM 802 NH1AARG A 84 29.908 5.491 11.818 0.50 28.99 N ATOM 803 NH1BARG A 84 27.118 7.238 11.719 0.50 17.61 N ATOM 804 NH2AARG A 84 31.490 4.958 10.245 0.50 26.37 N ATOM 805 NH2BARG A 84 28.759 5.712 11.317 0.50 14.75 N ATOM 0 H AARG A 84 35.237 6.146 13.698 0.50 33.49 H new ATOM 0 H BARG A 84 35.259 6.157 13.709 0.50 33.49 H new ATOM 0 HA AARG A 84 33.529 6.980 15.490 0.50 32.14 H new ATOM 0 HA BARG A 84 33.495 7.057 15.363 0.50 32.14 H new ATOM 0 HB2AARG A 84 33.628 7.992 13.400 0.50 31.79 H new ATOM 0 HB2BARG A 84 33.351 7.960 13.277 0.50 31.79 H new ATOM 0 HB3AARG A 84 33.165 6.671 12.711 0.50 31.79 H new ATOM 0 HB3BARG A 84 33.223 6.563 12.595 0.50 31.79 H new ATOM 0 HG2AARG A 84 31.108 6.942 14.046 0.50 28.95 H new ATOM 0 HG2BARG A 84 30.999 6.388 13.657 0.50 28.95 H new ATOM 0 HG3AARG A 84 31.574 8.421 14.215 0.50 28.95 H new ATOM 0 HG3BARG A 84 31.139 7.898 14.020 0.50 28.95 H new ATOM 0 HD2AARG A 84 30.147 7.976 12.295 0.50 25.30 H new ATOM 0 HD2BARG A 84 31.226 8.415 11.676 0.50 25.30 H new ATOM 0 HD3AARG A 84 31.408 8.849 12.016 0.50 25.30 H new ATOM 0 HD3BARG A 84 30.984 6.907 11.359 0.50 25.30 H new ATOM 0 HE AARG A 84 32.299 7.153 10.874 0.50 18.36 H new ATOM 0 HE BARG A 84 29.055 8.628 12.225 0.50 18.36 H new ATOM 0 HH11AARG A 84 29.587 6.048 12.390 0.50 17.61 H new ATOM 0 HH11BARG A 84 26.869 8.028 11.949 0.50 17.61 H new ATOM 0 HH12AARG A 84 29.521 4.734 11.691 0.50 17.61 H new ATOM 0 HH12BARG A 84 26.530 6.645 11.513 0.50 17.61 H new ATOM 0 HH21AARG A 84 32.193 5.167 9.797 0.50 14.75 H new ATOM 0 HH21BARG A 84 29.591 5.496 11.282 0.50 14.75 H new ATOM 0 HH22AARG A 84 31.106 4.199 10.114 0.50 14.75 H new ATOM 0 HH22BARG A 84 28.156 5.134 11.115 0.50 14.75 H new ATOM 806 N LYS A 85 32.913 4.111 14.195 1.00 31.52 N ATOM 807 CA LYS A 85 32.138 2.882 14.355 1.00 30.39 C ATOM 808 C LYS A 85 32.239 2.351 15.787 1.00 28.87 C ATOM 809 O LYS A 85 31.227 1.977 16.368 1.00 29.48 O ATOM 810 CB LYS A 85 32.579 1.820 13.338 1.00 31.11 C ATOM 811 CG LYS A 85 32.371 2.248 11.892 1.00 32.34 C ATOM 812 CD LYS A 85 31.792 1.098 11.042 1.00 34.88 C ATOM 813 CE LYS A 85 32.123 1.245 9.548 1.00 33.84 C ATOM 814 NZ LYS A 85 31.371 2.338 8.849 1.00 32.76 N ATOM 0 H LYS A 85 33.515 4.076 13.581 1.00 31.52 H new ATOM 0 HA LYS A 85 31.207 3.091 14.182 1.00 30.39 H new ATOM 0 HB2 LYS A 85 33.517 1.618 13.477 1.00 31.11 H new ATOM 0 HB3 LYS A 85 32.085 1.001 13.500 1.00 31.11 H new ATOM 0 HG2 LYS A 85 31.770 3.009 11.861 1.00 32.34 H new ATOM 0 HG3 LYS A 85 33.216 2.538 11.514 1.00 32.34 H new ATOM 0 HD2 LYS A 85 32.141 0.253 11.366 1.00 34.88 H new ATOM 0 HD3 LYS A 85 30.829 1.069 11.155 1.00 34.88 H new ATOM 0 HE2 LYS A 85 33.074 1.411 9.454 1.00 33.84 H new ATOM 0 HE3 LYS A 85 31.936 0.404 9.103 1.00 33.84 H new ATOM 0 HZ1 LYS A 85 31.115 2.055 8.045 1.00 32.76 H new ATOM 0 HZ2 LYS A 85 30.654 2.558 9.328 1.00 32.76 H new ATOM 0 HZ3 LYS A 85 31.897 3.050 8.759 1.00 32.76 H new ATOM 815 N ALA A 86 33.451 2.374 16.332 1.00 27.07 N ATOM 816 CA ALA A 86 33.745 1.965 17.698 1.00 26.76 C ATOM 817 C ALA A 86 33.180 2.940 18.736 1.00 26.54 C ATOM 818 O ALA A 86 32.935 2.563 19.888 1.00 25.56 O ATOM 819 CB ALA A 86 35.230 1.834 17.896 1.00 26.58 C ATOM 0 H ALA A 86 34.147 2.637 15.901 1.00 27.07 H new ATOM 0 HA ALA A 86 33.314 1.106 17.832 1.00 26.76 H new ATOM 0 HB1 ALA A 86 35.412 1.561 18.809 1.00 26.58 H new ATOM 0 HB2 ALA A 86 35.581 1.168 17.284 1.00 26.58 H new ATOM 0 HB3 ALA A 86 35.656 2.688 17.723 1.00 26.58 H new ATOM 820 N TRP A 87 33.015 4.205 18.347 1.00 25.65 N ATOM 821 CA TRP A 87 32.412 5.184 19.254 1.00 23.86 C ATOM 822 C TRP A 87 30.930 4.852 19.344 1.00 23.37 C ATOM 823 O TRP A 87 30.346 4.824 20.444 1.00 23.70 O ATOM 824 CB TRP A 87 32.641 6.601 18.699 1.00 23.61 C ATOM 825 CG TRP A 87 32.400 7.763 19.645 1.00 20.01 C ATOM 826 CD1 TRP A 87 32.581 7.797 21.009 1.00 20.01 C ATOM 827 CD2 TRP A 87 32.017 9.087 19.258 1.00 18.34 C ATOM 828 NE1 TRP A 87 32.294 9.060 21.488 1.00 19.28 N ATOM 829 CE2 TRP A 87 31.969 9.872 20.428 1.00 17.22 C ATOM 830 CE3 TRP A 87 31.719 9.690 18.020 1.00 18.30 C ATOM 831 CZ2 TRP A 87 31.608 11.238 20.407 1.00 16.33 C ATOM 832 CZ3 TRP A 87 31.369 11.050 18.000 1.00 16.74 C ATOM 833 CH2 TRP A 87 31.304 11.798 19.186 1.00 16.62 C ATOM 0 H TRP A 87 33.241 4.513 17.576 1.00 25.65 H new ATOM 0 HA TRP A 87 32.809 5.151 20.138 1.00 23.86 H new ATOM 0 HB2 TRP A 87 33.556 6.656 18.382 1.00 23.61 H new ATOM 0 HB3 TRP A 87 32.066 6.718 17.926 1.00 23.61 H new ATOM 0 HD1 TRP A 87 32.855 7.077 21.530 1.00 20.01 H new ATOM 0 HE1 TRP A 87 32.315 9.299 22.314 1.00 19.28 H new ATOM 0 HE3 TRP A 87 31.753 9.197 17.232 1.00 18.30 H new ATOM 0 HZ2 TRP A 87 31.577 11.740 21.189 1.00 16.33 H new ATOM 0 HZ3 TRP A 87 31.177 11.461 17.188 1.00 16.74 H new ATOM 0 HH2 TRP A 87 31.050 12.692 19.146 1.00 16.62 H new ATOM 834 N PHE A 88 30.309 4.597 18.196 1.00 22.31 N ATOM 835 CA PHE A 88 28.898 4.230 18.160 1.00 22.34 C ATOM 836 C PHE A 88 28.621 2.914 18.882 1.00 22.60 C ATOM 837 O PHE A 88 27.503 2.711 19.367 1.00 22.01 O ATOM 838 CB PHE A 88 28.324 4.167 16.720 1.00 23.11 C ATOM 839 CG PHE A 88 27.681 5.473 16.237 1.00 23.24 C ATOM 840 CD1 PHE A 88 28.419 6.389 15.508 1.00 21.79 C ATOM 841 CD2 PHE A 88 26.345 5.783 16.545 1.00 26.42 C ATOM 842 CE1 PHE A 88 27.864 7.593 15.055 1.00 20.63 C ATOM 843 CE2 PHE A 88 25.757 7.008 16.108 1.00 26.33 C ATOM 844 CZ PHE A 88 26.538 7.919 15.351 1.00 24.67 C ATOM 0 H PHE A 88 30.689 4.631 17.425 1.00 22.31 H new ATOM 0 HA PHE A 88 28.442 4.944 18.632 1.00 22.34 H new ATOM 0 HB2 PHE A 88 29.038 3.925 16.109 1.00 23.11 H new ATOM 0 HB3 PHE A 88 27.663 3.459 16.678 1.00 23.11 H new ATOM 0 HD1 PHE A 88 29.309 6.200 15.313 1.00 21.79 H new ATOM 0 HD2 PHE A 88 25.837 5.182 17.040 1.00 26.42 H new ATOM 0 HE1 PHE A 88 28.382 8.180 14.553 1.00 20.63 H new ATOM 0 HE2 PHE A 88 24.873 7.207 16.317 1.00 26.33 H new ATOM 0 HZ PHE A 88 26.173 8.722 15.056 1.00 24.67 H new ATOM 845 N GLU A 89 29.597 1.995 18.910 1.00 22.39 N ATOM 846 CA AGLU A 89 29.427 0.761 19.690 0.50 22.15 C ATOM 847 CA BGLU A 89 29.415 0.763 19.691 0.50 22.66 C ATOM 848 C GLU A 89 29.232 1.112 21.171 1.00 22.28 C ATOM 849 O GLU A 89 28.358 0.538 21.847 1.00 22.61 O ATOM 850 CB AGLU A 89 30.618 -0.185 19.512 0.50 22.13 C ATOM 851 CB BGLU A 89 30.572 -0.224 19.505 0.50 22.95 C ATOM 852 CG AGLU A 89 30.729 -0.780 18.123 0.50 21.67 C ATOM 853 CG BGLU A 89 30.180 -1.534 18.827 0.50 24.98 C ATOM 854 CD AGLU A 89 29.468 -1.518 17.715 0.50 20.93 C ATOM 855 CD BGLU A 89 31.079 -2.692 19.245 0.50 27.26 C ATOM 856 OE1AGLU A 89 29.119 -2.527 18.356 0.50 19.15 O ATOM 857 OE1BGLU A 89 30.575 -3.655 19.874 0.50 27.36 O ATOM 858 OE2AGLU A 89 28.830 -1.099 16.735 0.50 23.01 O ATOM 859 OE2BGLU A 89 32.296 -2.632 18.964 0.50 30.07 O ATOM 0 H AGLU A 89 30.347 2.064 18.495 0.50 22.39 H new ATOM 0 H BGLU A 89 30.349 2.062 18.498 0.50 22.39 H new ATOM 0 HA AGLU A 89 28.640 0.298 19.363 0.50 22.66 H new ATOM 0 HA BGLU A 89 28.617 0.320 19.362 0.50 22.66 H new ATOM 0 HB2AGLU A 89 31.435 0.297 19.714 0.50 22.95 H new ATOM 0 HB2BGLU A 89 31.267 0.204 18.980 0.50 22.95 H new ATOM 0 HB3AGLU A 89 30.547 -0.905 20.158 0.50 22.95 H new ATOM 0 HB3BGLU A 89 30.955 -0.424 20.373 0.50 22.95 H new ATOM 0 HG2AGLU A 89 30.910 -0.073 17.483 0.50 24.98 H new ATOM 0 HG2BGLU A 89 29.259 -1.746 19.046 0.50 24.98 H new ATOM 0 HG3AGLU A 89 31.483 -1.390 18.093 0.50 24.98 H new ATOM 0 HG3BGLU A 89 30.224 -1.424 17.864 0.50 24.98 H new ATOM 860 N HIS A 90 30.039 2.048 21.678 1.00 21.04 N ATOM 861 CA HIS A 90 29.838 2.491 23.059 1.00 20.25 C ATOM 862 C HIS A 90 28.476 3.184 23.164 1.00 20.16 C ATOM 863 O HIS A 90 27.693 2.931 24.087 1.00 19.19 O ATOM 864 CB HIS A 90 30.966 3.384 23.552 1.00 19.32 C ATOM 865 CG HIS A 90 30.722 3.921 24.923 1.00 19.22 C ATOM 866 ND1 HIS A 90 30.433 5.249 25.163 1.00 15.07 N ATOM 867 CD2 HIS A 90 30.646 3.291 26.124 1.00 17.06 C ATOM 868 CE1 HIS A 90 30.236 5.419 26.460 1.00 18.86 C ATOM 869 NE2 HIS A 90 30.345 4.248 27.061 1.00 16.63 N ATOM 0 H HIS A 90 30.686 2.427 21.257 1.00 21.04 H new ATOM 0 HA HIS A 90 29.849 1.714 23.639 1.00 20.25 H new ATOM 0 HB2 HIS A 90 31.796 2.881 23.549 1.00 19.32 H new ATOM 0 HB3 HIS A 90 31.080 4.124 22.935 1.00 19.32 H new ATOM 0 HD1 HIS A 90 30.388 5.866 24.566 1.00 15.07 H new ATOM 0 HD2 HIS A 90 30.774 2.383 26.282 1.00 17.06 H new ATOM 0 HE1 HIS A 90 30.051 6.229 26.879 1.00 18.86 H new ATOM 0 HE2 HIS A 90 30.244 4.108 27.903 1.00 16.63 H new ATOM 870 N GLY A 91 28.161 4.017 22.178 1.00 19.22 N ATOM 871 CA GLY A 91 26.829 4.587 22.075 1.00 18.01 C ATOM 872 C GLY A 91 25.700 3.583 22.213 1.00 18.82 C ATOM 873 O GLY A 91 24.746 3.832 22.947 1.00 17.41 O ATOM 0 H GLY A 91 28.706 4.263 21.560 1.00 19.22 H new ATOM 0 HA2 GLY A 91 26.727 5.267 22.759 1.00 18.01 H new ATOM 0 HA3 GLY A 91 26.746 5.033 21.218 1.00 18.01 H new ATOM 874 N LYS A 92 25.768 2.445 21.507 1.00 19.55 N ATOM 875 CA LYS A 92 24.693 1.436 21.620 1.00 20.40 C ATOM 876 C LYS A 92 24.522 0.922 23.061 1.00 20.42 C ATOM 877 O LYS A 92 23.413 0.531 23.455 1.00 20.02 O ATOM 878 CB LYS A 92 24.947 0.227 20.693 1.00 21.92 C ATOM 879 CG LYS A 92 25.252 0.605 19.261 1.00 24.38 C ATOM 880 CD LYS A 92 25.190 -0.575 18.307 1.00 31.11 C ATOM 881 CE LYS A 92 25.568 -0.109 16.879 1.00 33.45 C ATOM 882 NZ LYS A 92 25.622 -1.265 15.932 1.00 35.93 N ATOM 0 H LYS A 92 26.408 2.239 20.971 1.00 19.55 H new ATOM 0 HA LYS A 92 23.879 1.889 21.349 1.00 20.40 H new ATOM 0 HB2 LYS A 92 25.688 -0.290 21.046 1.00 21.92 H new ATOM 0 HB3 LYS A 92 24.167 -0.349 20.707 1.00 21.92 H new ATOM 0 HG2 LYS A 92 24.622 1.283 18.970 1.00 24.38 H new ATOM 0 HG3 LYS A 92 26.136 1.002 19.218 1.00 24.38 H new ATOM 0 HD2 LYS A 92 25.797 -1.272 18.601 1.00 31.11 H new ATOM 0 HD3 LYS A 92 24.298 -0.956 18.307 1.00 31.11 H new ATOM 0 HE2 LYS A 92 24.919 0.540 16.565 1.00 33.45 H new ATOM 0 HE3 LYS A 92 26.429 0.337 16.899 1.00 33.45 H new ATOM 0 HZ1 LYS A 92 25.840 -0.974 15.120 1.00 35.93 H new ATOM 0 HZ2 LYS A 92 26.232 -1.850 16.211 1.00 35.93 H new ATOM 0 HZ3 LYS A 92 24.825 -1.661 15.900 1.00 35.93 H new ATOM 883 N TYR A 93 25.615 0.903 23.825 1.00 20.18 N ATOM 884 CA TYR A 93 25.588 0.469 25.236 1.00 21.03 C ATOM 885 C TYR A 93 24.818 1.426 26.170 1.00 20.77 C ATOM 886 O TYR A 93 23.980 0.987 26.950 1.00 22.21 O ATOM 887 CB TYR A 93 27.000 0.257 25.770 1.00 20.60 C ATOM 888 CG TYR A 93 27.049 -0.130 27.227 1.00 23.17 C ATOM 889 CD1 TYR A 93 26.376 -1.269 27.672 1.00 27.38 C ATOM 890 CD2 TYR A 93 27.782 0.617 28.151 1.00 24.95 C ATOM 891 CE1 TYR A 93 26.418 -1.648 28.990 1.00 29.48 C ATOM 892 CE2 TYR A 93 27.822 0.247 29.492 1.00 28.81 C ATOM 893 CZ TYR A 93 27.143 -0.909 29.890 1.00 29.03 C ATOM 894 OH TYR A 93 27.145 -1.326 31.187 1.00 30.52 O ATOM 0 H TYR A 93 26.393 1.139 23.546 1.00 20.18 H new ATOM 0 HA TYR A 93 25.105 -0.372 25.236 1.00 21.03 H new ATOM 0 HB2 TYR A 93 27.434 -0.434 25.246 1.00 20.60 H new ATOM 0 HB3 TYR A 93 27.510 1.072 25.643 1.00 20.60 H new ATOM 0 HD1 TYR A 93 25.891 -1.780 27.065 1.00 27.38 H new ATOM 0 HD2 TYR A 93 28.249 1.370 27.867 1.00 24.95 H new ATOM 0 HE1 TYR A 93 25.956 -2.404 29.273 1.00 29.48 H new ATOM 0 HE2 TYR A 93 28.291 0.758 30.111 1.00 28.81 H new ATOM 0 HH TYR A 93 27.055 -2.161 31.213 1.00 30.52 H new ATOM 895 N PHE A 94 25.065 2.730 26.081 1.00 19.96 N ATOM 896 CA PHE A 94 24.504 3.664 27.082 1.00 18.12 C ATOM 897 C PHE A 94 23.441 4.598 26.510 1.00 17.86 C ATOM 898 O PHE A 94 22.839 5.355 27.243 1.00 18.06 O ATOM 899 CB PHE A 94 25.623 4.476 27.763 1.00 17.23 C ATOM 900 CG PHE A 94 26.055 5.719 26.995 1.00 16.62 C ATOM 901 CD1 PHE A 94 25.684 6.997 27.450 1.00 13.98 C ATOM 902 CD2 PHE A 94 26.792 5.609 25.813 1.00 14.40 C ATOM 903 CE1 PHE A 94 26.045 8.145 26.729 1.00 16.25 C ATOM 904 CE2 PHE A 94 27.190 6.773 25.087 1.00 14.44 C ATOM 905 CZ PHE A 94 26.819 8.030 25.557 1.00 14.10 C ATOM 0 H PHE A 94 25.543 3.097 25.467 1.00 19.96 H new ATOM 0 HA PHE A 94 24.060 3.112 27.745 1.00 18.12 H new ATOM 0 HB2 PHE A 94 25.323 4.743 28.646 1.00 17.23 H new ATOM 0 HB3 PHE A 94 26.395 3.902 27.887 1.00 17.23 H new ATOM 0 HD1 PHE A 94 25.195 7.082 28.236 1.00 13.98 H new ATOM 0 HD2 PHE A 94 27.026 4.767 25.495 1.00 14.40 H new ATOM 0 HE1 PHE A 94 25.773 8.984 27.025 1.00 16.25 H new ATOM 0 HE2 PHE A 94 27.692 6.692 24.308 1.00 14.44 H new ATOM 0 HZ PHE A 94 27.082 8.794 25.097 1.00 14.10 H new ATOM 906 N ILE A 95 23.214 4.545 25.204 1.00 17.45 N ATOM 907 CA ILE A 95 22.113 5.301 24.608 1.00 16.47 C ATOM 908 C ILE A 95 20.991 4.400 24.127 1.00 17.34 C ATOM 909 O ILE A 95 21.108 3.700 23.075 1.00 16.15 O ATOM 910 CB ILE A 95 22.558 6.214 23.421 1.00 16.94 C ATOM 911 CG1 ILE A 95 23.727 7.130 23.822 1.00 12.96 C ATOM 912 CG2 ILE A 95 21.389 6.983 22.922 1.00 15.91 C ATOM 913 CD1 ILE A 95 24.500 7.704 22.639 1.00 13.43 C ATOM 0 H ILE A 95 23.679 4.083 24.647 1.00 17.45 H new ATOM 0 HA ILE A 95 21.792 5.867 25.328 1.00 16.47 H new ATOM 0 HB ILE A 95 22.887 5.656 22.699 1.00 16.94 H new ATOM 0 HG12 ILE A 95 23.383 7.862 24.358 1.00 12.96 H new ATOM 0 HG13 ILE A 95 24.339 6.630 24.385 1.00 12.96 H new ATOM 0 HG21 ILE A 95 21.665 7.550 22.185 1.00 15.91 H new ATOM 0 HG22 ILE A 95 20.703 6.368 22.617 1.00 15.91 H new ATOM 0 HG23 ILE A 95 21.034 7.534 23.638 1.00 15.91 H new ATOM 0 HD11 ILE A 95 25.218 8.269 22.965 1.00 13.43 H new ATOM 0 HD12 ILE A 95 24.872 6.979 22.113 1.00 13.43 H new ATOM 0 HD13 ILE A 95 23.902 8.230 22.086 1.00 13.43 H new ATOM 914 N GLY A 96 19.875 4.484 24.857 1.00 17.93 N ATOM 915 CA GLY A 96 18.652 3.744 24.527 1.00 17.96 C ATOM 916 C GLY A 96 17.933 4.213 23.268 1.00 18.95 C ATOM 917 O GLY A 96 17.566 3.388 22.418 1.00 19.10 O ATOM 0 H GLY A 96 19.806 4.974 25.560 1.00 17.93 H new ATOM 0 HA2 GLY A 96 18.876 2.806 24.424 1.00 17.96 H new ATOM 0 HA3 GLY A 96 18.039 3.809 25.276 1.00 17.96 H new ATOM 918 N GLN A 97 17.723 5.536 23.140 1.00 18.33 N ATOM 919 CA GLN A 97 17.096 6.125 21.937 1.00 18.08 C ATOM 920 C GLN A 97 17.760 7.478 21.676 1.00 17.04 C ATOM 921 O GLN A 97 18.155 8.173 22.630 1.00 15.60 O ATOM 922 CB GLN A 97 15.599 6.372 22.120 1.00 18.05 C ATOM 923 CG GLN A 97 14.715 5.150 22.440 1.00 23.43 C ATOM 924 CD GLN A 97 13.471 5.569 23.193 1.00 25.02 C ATOM 925 OE1 GLN A 97 13.503 5.795 24.404 1.00 29.05 O ATOM 926 NE2 GLN A 97 12.376 5.688 22.484 1.00 28.15 N ATOM 0 H GLN A 97 17.938 6.112 23.741 1.00 18.33 H new ATOM 0 HA GLN A 97 17.213 5.501 21.203 1.00 18.08 H new ATOM 0 HB2 GLN A 97 15.487 7.019 22.834 1.00 18.05 H new ATOM 0 HB3 GLN A 97 15.261 6.783 21.309 1.00 18.05 H new ATOM 0 HG2 GLN A 97 14.464 4.702 21.617 1.00 23.43 H new ATOM 0 HG3 GLN A 97 15.218 4.511 22.969 1.00 23.43 H new ATOM 0 HE21 GLN A 97 12.390 5.522 21.640 1.00 28.15 H new ATOM 0 HE22 GLN A 97 11.643 5.932 22.862 1.00 28.15 H new ATOM 927 N LEU A 98 17.811 7.850 20.401 1.00 15.68 N ATOM 928 CA LEU A 98 18.600 9.000 19.915 1.00 16.64 C ATOM 929 C LEU A 98 17.807 9.739 18.862 1.00 16.16 C ATOM 930 O LEU A 98 17.272 9.104 17.938 1.00 16.53 O ATOM 931 CB LEU A 98 19.880 8.451 19.267 1.00 16.67 C ATOM 932 CG LEU A 98 20.924 9.462 18.808 1.00 21.01 C ATOM 933 CD1 LEU A 98 21.337 10.258 20.032 1.00 21.01 C ATOM 934 CD2 LEU A 98 22.135 8.755 18.229 1.00 20.20 C ATOM 0 H LEU A 98 17.384 7.440 19.777 1.00 15.68 H new ATOM 0 HA LEU A 98 18.809 9.600 20.648 1.00 16.64 H new ATOM 0 HB2 LEU A 98 20.303 7.851 19.901 1.00 16.67 H new ATOM 0 HB3 LEU A 98 19.622 7.917 18.499 1.00 16.67 H new ATOM 0 HG LEU A 98 20.558 10.037 18.118 1.00 21.01 H new ATOM 0 HD11 LEU A 98 22.004 10.916 19.781 1.00 21.01 H new ATOM 0 HD12 LEU A 98 20.562 10.709 20.402 1.00 21.01 H new ATOM 0 HD13 LEU A 98 21.709 9.659 20.698 1.00 21.01 H new ATOM 0 HD21 LEU A 98 22.788 9.413 17.943 1.00 20.20 H new ATOM 0 HD22 LEU A 98 22.529 8.182 18.905 1.00 20.20 H new ATOM 0 HD23 LEU A 98 21.863 8.218 17.469 1.00 20.20 H new ATOM 935 N LYS A 99 17.698 11.068 18.999 1.00 14.63 N ATOM 936 CA LYS A 99 17.162 11.919 17.948 1.00 13.68 C ATOM 937 C LYS A 99 18.248 12.920 17.474 1.00 13.97 C ATOM 938 O LYS A 99 18.652 13.799 18.255 1.00 14.11 O ATOM 939 CB LYS A 99 15.937 12.717 18.449 1.00 13.44 C ATOM 940 CG LYS A 99 15.456 13.899 17.476 1.00 11.29 C ATOM 941 CD LYS A 99 14.977 13.388 16.112 1.00 15.39 C ATOM 942 CE LYS A 99 14.483 14.603 15.257 1.00 15.34 C ATOM 943 NZ LYS A 99 14.020 14.048 13.953 1.00 17.70 N ATOM 0 H LYS A 99 17.935 11.494 19.708 1.00 14.63 H new ATOM 0 HA LYS A 99 16.889 11.347 17.214 1.00 13.68 H new ATOM 0 HB2 LYS A 99 15.198 12.102 18.579 1.00 13.44 H new ATOM 0 HB3 LYS A 99 16.147 13.096 19.317 1.00 13.44 H new ATOM 0 HG2 LYS A 99 14.737 14.391 17.903 1.00 11.29 H new ATOM 0 HG3 LYS A 99 16.188 14.522 17.345 1.00 11.29 H new ATOM 0 HD2 LYS A 99 15.698 12.928 15.655 1.00 15.39 H new ATOM 0 HD3 LYS A 99 14.259 12.746 16.228 1.00 15.39 H new ATOM 0 HE2 LYS A 99 13.763 15.071 15.707 1.00 15.34 H new ATOM 0 HE3 LYS A 99 15.199 15.244 15.124 1.00 15.34 H new ATOM 0 HZ1 LYS A 99 13.716 14.709 13.440 1.00 17.70 H new ATOM 0 HZ2 LYS A 99 14.699 13.644 13.544 1.00 17.70 H new ATOM 0 HZ3 LYS A 99 13.368 13.459 14.095 1.00 17.70 H new ATOM 944 N PRO A 100 18.706 12.809 16.207 1.00 14.14 N ATOM 945 CA PRO A 100 19.652 13.828 15.721 1.00 13.38 C ATOM 946 C PRO A 100 18.935 14.940 14.964 1.00 13.68 C ATOM 947 O PRO A 100 17.979 14.674 14.191 1.00 13.16 O ATOM 948 CB PRO A 100 20.561 13.052 14.742 1.00 13.64 C ATOM 949 CG PRO A 100 19.979 11.653 14.602 1.00 15.86 C ATOM 950 CD PRO A 100 18.637 11.626 15.311 1.00 14.03 C ATOM 0 HA PRO A 100 20.130 14.252 16.451 1.00 13.38 H new ATOM 0 HB2 PRO A 100 20.595 13.497 13.881 1.00 13.64 H new ATOM 0 HB3 PRO A 100 21.470 13.013 15.077 1.00 13.64 H new ATOM 0 HG2 PRO A 100 19.872 11.423 13.666 1.00 15.86 H new ATOM 0 HG3 PRO A 100 20.579 10.996 14.988 1.00 15.86 H new ATOM 0 HD2 PRO A 100 17.899 11.693 14.685 1.00 14.03 H new ATOM 0 HD3 PRO A 100 18.512 10.804 15.811 1.00 14.03 H new ATOM 951 N PHE A 101 19.375 16.179 15.159 1.00 12.33 N ATOM 952 CA PHE A 101 18.927 17.247 14.258 1.00 11.66 C ATOM 953 C PHE A 101 20.170 17.777 13.545 1.00 11.98 C ATOM 954 O PHE A 101 21.147 18.129 14.212 1.00 11.25 O ATOM 955 CB PHE A 101 18.394 18.450 15.060 1.00 12.92 C ATOM 956 CG PHE A 101 17.279 18.115 16.024 1.00 11.57 C ATOM 957 CD1 PHE A 101 15.978 18.000 15.572 1.00 13.56 C ATOM 958 CD2 PHE A 101 17.541 17.982 17.392 1.00 13.77 C ATOM 959 CE1 PHE A 101 14.932 17.758 16.458 1.00 14.52 C ATOM 960 CE2 PHE A 101 16.500 17.738 18.308 1.00 14.28 C ATOM 961 CZ PHE A 101 15.190 17.605 17.820 1.00 16.71 C ATOM 0 H PHE A 101 19.915 16.421 15.783 1.00 12.33 H new ATOM 0 HA PHE A 101 18.243 16.894 13.667 1.00 11.66 H new ATOM 0 HB2 PHE A 101 19.128 18.844 15.556 1.00 12.92 H new ATOM 0 HB3 PHE A 101 18.077 19.124 14.438 1.00 12.92 H new ATOM 0 HD1 PHE A 101 15.799 18.085 14.663 1.00 13.56 H new ATOM 0 HD2 PHE A 101 18.415 18.056 17.701 1.00 13.77 H new ATOM 0 HE1 PHE A 101 14.060 17.698 16.141 1.00 14.52 H new ATOM 0 HE2 PHE A 101 16.676 17.666 19.218 1.00 14.28 H new ATOM 0 HZ PHE A 101 14.493 17.415 18.406 1.00 16.71 H new ATOM 962 N VAL A 102 20.111 17.911 12.219 1.00 12.56 N ATOM 963 CA VAL A 102 21.156 18.623 11.508 1.00 12.83 C ATOM 964 C VAL A 102 20.730 20.077 11.481 1.00 11.67 C ATOM 965 O VAL A 102 19.656 20.398 10.957 1.00 12.30 O ATOM 966 CB VAL A 102 21.382 18.087 10.045 1.00 14.01 C ATOM 967 CG1 VAL A 102 22.460 18.958 9.353 1.00 14.66 C ATOM 968 CG2 VAL A 102 21.835 16.578 10.074 1.00 13.41 C ATOM 0 H VAL A 102 19.481 17.599 11.724 1.00 12.56 H new ATOM 0 HA VAL A 102 22.005 18.496 11.960 1.00 12.83 H new ATOM 0 HB VAL A 102 20.550 18.141 9.549 1.00 14.01 H new ATOM 0 HG11 VAL A 102 22.606 18.635 8.450 1.00 14.66 H new ATOM 0 HG12 VAL A 102 22.160 19.880 9.322 1.00 14.66 H new ATOM 0 HG13 VAL A 102 23.289 18.905 9.853 1.00 14.66 H new ATOM 0 HG21 VAL A 102 21.970 16.263 9.167 1.00 13.41 H new ATOM 0 HG22 VAL A 102 22.665 16.498 10.570 1.00 13.41 H new ATOM 0 HG23 VAL A 102 21.150 16.042 10.503 1.00 13.41 H new ATOM 969 N THR A 103 21.558 20.959 12.034 1.00 11.41 N ATOM 970 CA THR A 103 21.152 22.366 12.198 1.00 11.15 C ATOM 971 C THR A 103 21.729 23.304 11.103 1.00 12.58 C ATOM 972 O THR A 103 22.691 22.958 10.399 1.00 13.38 O ATOM 973 CB THR A 103 21.470 22.892 13.589 1.00 11.18 C ATOM 974 OG1 THR A 103 22.884 22.948 13.781 1.00 9.38 O ATOM 975 CG2 THR A 103 20.828 21.993 14.690 1.00 9.95 C ATOM 0 H THR A 103 22.348 20.774 12.319 1.00 11.41 H new ATOM 0 HA THR A 103 20.188 22.372 12.087 1.00 11.15 H new ATOM 0 HB THR A 103 21.097 23.784 13.664 1.00 11.18 H new ATOM 0 HG1 THR A 103 23.152 22.220 14.102 1.00 9.38 H new ATOM 0 HG21 THR A 103 21.045 22.349 15.566 1.00 9.95 H new ATOM 0 HG22 THR A 103 19.865 21.980 14.576 1.00 9.95 H new ATOM 0 HG23 THR A 103 21.174 21.090 14.613 1.00 9.95 H new ATOM 976 N GLU A 104 21.116 24.467 10.949 1.00 12.98 N ATOM 977 CA GLU A 104 21.519 25.460 9.967 1.00 15.17 C ATOM 978 C GLU A 104 21.588 26.779 10.679 1.00 15.95 C ATOM 979 O GLU A 104 20.603 27.240 11.268 1.00 14.63 O ATOM 980 CB GLU A 104 20.465 25.592 8.856 1.00 15.63 C ATOM 981 CG GLU A 104 20.861 26.574 7.770 1.00 20.96 C ATOM 982 CD GLU A 104 19.715 26.938 6.818 1.00 27.49 C ATOM 983 OE1 GLU A 104 18.767 26.148 6.656 1.00 29.27 O ATOM 984 OE2 GLU A 104 19.766 28.045 6.250 1.00 31.26 O ATOM 0 H GLU A 104 20.439 24.707 11.423 1.00 12.98 H new ATOM 0 HA GLU A 104 22.366 25.200 9.572 1.00 15.17 H new ATOM 0 HB2 GLU A 104 20.314 24.721 8.457 1.00 15.63 H new ATOM 0 HB3 GLU A 104 19.624 25.874 9.248 1.00 15.63 H new ATOM 0 HG2 GLU A 104 21.196 27.384 8.185 1.00 20.96 H new ATOM 0 HG3 GLU A 104 21.591 26.197 7.255 1.00 20.96 H new ATOM 985 N GLU A 105 22.738 27.414 10.580 1.00 17.14 N ATOM 986 CA AGLU A 105 22.984 28.710 11.237 0.50 18.18 C ATOM 987 CA BGLU A 105 22.952 28.679 11.245 0.50 18.07 C ATOM 988 C GLU A 105 22.272 29.797 10.427 1.00 19.30 C ATOM 989 O GLU A 105 22.179 29.700 9.207 1.00 20.29 O ATOM 990 CB AGLU A 105 24.502 28.972 11.352 0.50 17.88 C ATOM 991 CB BGLU A 105 24.460 28.847 11.486 0.50 17.77 C ATOM 992 CG AGLU A 105 24.965 29.892 12.526 0.50 16.76 C ATOM 993 CG BGLU A 105 24.979 27.955 12.668 0.50 15.93 C ATOM 994 CD AGLU A 105 24.711 29.323 13.930 0.50 15.23 C ATOM 995 CD BGLU A 105 25.294 26.487 12.316 0.50 14.62 C ATOM 996 OE1AGLU A 105 24.794 30.105 14.927 0.50 11.12 O ATOM 997 OE1BGLU A 105 24.650 25.570 12.881 0.50 13.58 O ATOM 998 OE2AGLU A 105 24.385 28.108 14.025 0.50 17.90 O ATOM 999 OE2BGLU A 105 26.181 26.237 11.464 0.50 14.11 O ATOM 0 H AGLU A 105 23.408 27.116 10.132 0.50 17.14 H new ATOM 0 H BGLU A 105 23.412 27.127 10.129 0.50 17.14 H new ATOM 0 HA AGLU A 105 22.632 28.710 12.141 0.50 18.07 H new ATOM 0 HA BGLU A 105 22.539 28.723 12.122 0.50 18.07 H new ATOM 0 HB2AGLU A 105 24.951 28.117 11.441 0.50 17.77 H new ATOM 0 HB2BGLU A 105 24.942 28.619 10.676 0.50 17.77 H new ATOM 0 HB3AGLU A 105 24.806 29.367 10.520 0.50 17.77 H new ATOM 0 HB3BGLU A 105 24.653 29.778 11.678 0.50 17.77 H new ATOM 0 HG2AGLU A 105 25.914 30.066 12.428 0.50 15.93 H new ATOM 0 HG2BGLU A 105 25.782 28.362 13.029 0.50 15.93 H new ATOM 0 HG3AGLU A 105 24.511 30.746 12.450 0.50 15.93 H new ATOM 0 HG3BGLU A 105 24.314 27.965 13.374 0.50 15.93 H new ATOM 1000 N LEU A 106 21.712 30.790 11.101 1.00 20.43 N ATOM 1001 CA LEU A 106 20.934 31.850 10.444 1.00 23.52 C ATOM 1002 C LEU A 106 21.701 33.174 10.323 1.00 24.45 C ATOM 1003 O LEU A 106 21.283 34.073 9.589 1.00 25.66 O ATOM 1004 CB LEU A 106 19.613 32.084 11.191 1.00 22.70 C ATOM 1005 CG LEU A 106 18.822 30.779 11.293 1.00 24.48 C ATOM 1006 CD1 LEU A 106 17.581 30.947 12.170 1.00 24.46 C ATOM 1007 CD2 LEU A 106 18.469 30.289 9.887 1.00 25.03 C ATOM 0 H LEU A 106 21.768 30.875 11.955 1.00 20.43 H new ATOM 0 HA LEU A 106 20.756 31.540 9.542 1.00 23.52 H new ATOM 0 HB2 LEU A 106 19.793 32.430 12.079 1.00 22.70 H new ATOM 0 HB3 LEU A 106 19.086 32.753 10.727 1.00 22.70 H new ATOM 0 HG LEU A 106 19.372 30.106 11.724 1.00 24.48 H new ATOM 0 HD11 LEU A 106 17.101 30.106 12.216 1.00 24.46 H new ATOM 0 HD12 LEU A 106 17.849 31.215 13.063 1.00 24.46 H new ATOM 0 HD13 LEU A 106 17.004 31.627 11.788 1.00 24.46 H new ATOM 0 HD21 LEU A 106 17.967 29.461 9.949 1.00 25.03 H new ATOM 0 HD22 LEU A 106 17.932 30.959 9.436 1.00 25.03 H new ATOM 0 HD23 LEU A 106 19.284 30.136 9.383 1.00 25.03 H new ATOM 1008 N VAL A 107 22.802 33.283 11.045 1.00 26.62 N ATOM 1009 CA VAL A 107 23.639 34.498 11.062 1.00 28.64 C ATOM 1010 C VAL A 107 25.151 34.178 11.141 1.00 29.93 C ATOM 1011 O VAL A 107 25.606 33.013 11.222 1.00 30.22 O ATOM 1012 CB VAL A 107 23.254 35.451 12.242 1.00 28.94 C ATOM 1013 CG1 VAL A 107 21.799 35.909 12.128 1.00 29.39 C ATOM 1014 CG2 VAL A 107 23.534 34.793 13.605 1.00 28.34 C ATOM 1015 OXT VAL A 107 25.992 35.104 11.135 1.00 30.97 O ATOM 0 H VAL A 107 23.098 32.652 11.549 1.00 26.62 H new ATOM 0 HA VAL A 107 23.465 34.945 10.219 1.00 28.64 H new ATOM 0 HB VAL A 107 23.814 36.240 12.181 1.00 28.94 H new ATOM 0 HG11 VAL A 107 21.586 36.497 12.869 1.00 29.39 H new ATOM 0 HG12 VAL A 107 21.674 36.385 11.292 1.00 29.39 H new ATOM 0 HG13 VAL A 107 21.214 35.136 12.150 1.00 29.39 H new ATOM 0 HG21 VAL A 107 23.287 35.404 14.316 1.00 28.34 H new ATOM 0 HG22 VAL A 107 23.014 33.978 13.684 1.00 28.34 H new ATOM 0 HG23 VAL A 107 24.478 34.581 13.675 1.00 28.34 H new TER 1016 VAL A 107 ATOM 1017 N PRO B -8 -35.111 6.895 17.349 1.00 47.43 N ATOM 1018 CA PRO B -8 -35.419 5.775 18.232 1.00 46.65 C ATOM 1019 C PRO B -8 -34.842 5.883 19.654 1.00 45.97 C ATOM 1020 O PRO B -8 -34.335 6.950 20.056 1.00 46.22 O ATOM 1021 CB PRO B -8 -34.840 4.577 17.465 1.00 47.21 C ATOM 1022 CG PRO B -8 -35.043 4.961 15.987 1.00 47.38 C ATOM 1023 CD PRO B -8 -35.220 6.490 15.933 1.00 47.76 C ATOM 0 H2 PRO B -8 -34.316 7.181 17.509 1.00 47.43 H new ATOM 0 H3 PRO B -8 -35.650 7.547 17.507 1.00 47.43 H new ATOM 0 HA PRO B -8 -36.371 5.718 18.410 1.00 46.65 H new ATOM 0 HB2 PRO B -8 -33.902 4.440 17.672 1.00 47.21 H new ATOM 0 HB3 PRO B -8 -35.303 3.754 17.687 1.00 47.21 H new ATOM 0 HG2 PRO B -8 -34.281 4.686 15.454 1.00 47.38 H new ATOM 0 HG3 PRO B -8 -35.822 4.513 15.621 1.00 47.38 H new ATOM 0 HD2 PRO B -8 -34.537 6.910 15.387 1.00 47.76 H new ATOM 0 HD3 PRO B -8 -36.078 6.738 15.555 1.00 47.76 H new ATOM 1024 N GLN B -7 -34.927 4.775 20.393 1.00 44.13 N ATOM 1025 CA GLN B -7 -34.850 4.770 21.869 1.00 42.36 C ATOM 1026 C GLN B -7 -33.412 4.550 22.399 1.00 39.75 C ATOM 1027 O GLN B -7 -33.017 5.122 23.424 1.00 38.87 O ATOM 1028 CB GLN B -7 -35.827 3.722 22.432 1.00 42.86 C ATOM 1029 CG GLN B -7 -37.145 3.555 21.610 1.00 45.06 C ATOM 1030 CD GLN B -7 -37.024 2.573 20.420 1.00 49.77 C ATOM 1031 OE1 GLN B -7 -36.014 2.550 19.702 1.00 51.63 O ATOM 1032 NE2 GLN B -7 -38.078 1.776 20.201 1.00 51.30 N ATOM 0 H GLN B -7 -35.032 3.992 20.052 1.00 44.13 H new ATOM 0 HA GLN B -7 -35.110 5.651 22.181 1.00 42.36 H new ATOM 0 HB2 GLN B -7 -35.375 2.865 22.474 1.00 42.86 H new ATOM 0 HB3 GLN B -7 -36.056 3.967 23.342 1.00 42.86 H new ATOM 0 HG2 GLN B -7 -37.848 3.246 22.203 1.00 45.06 H new ATOM 0 HG3 GLN B -7 -37.418 4.423 21.275 1.00 45.06 H new ATOM 0 HE21 GLN B -7 -38.763 1.817 20.719 1.00 51.30 H new ATOM 0 HE22 GLN B -7 -38.069 1.223 19.543 1.00 51.30 H new ATOM 1033 N PHE B -6 -32.648 3.716 21.684 1.00 36.44 N ATOM 1034 CA PHE B -6 -31.191 3.747 21.775 1.00 33.04 C ATOM 1035 C PHE B -6 -30.693 5.140 21.345 1.00 31.17 C ATOM 1036 O PHE B -6 -29.824 5.711 22.000 1.00 30.00 O ATOM 1037 CB PHE B -6 -30.571 2.654 20.897 1.00 32.52 C ATOM 1038 CG PHE B -6 -29.123 2.405 21.182 1.00 30.33 C ATOM 1039 CD1 PHE B -6 -28.742 1.546 22.202 1.00 28.81 C ATOM 1040 CD2 PHE B -6 -28.138 3.028 20.427 1.00 27.87 C ATOM 1041 CE1 PHE B -6 -27.394 1.315 22.462 1.00 29.78 C ATOM 1042 CE2 PHE B -6 -26.782 2.805 20.675 1.00 27.04 C ATOM 1043 CZ PHE B -6 -26.409 1.957 21.697 1.00 27.55 C ATOM 0 H PHE B -6 -32.958 3.126 21.141 1.00 36.44 H new ATOM 0 HA PHE B -6 -30.920 3.577 22.691 1.00 33.04 H new ATOM 0 HB2 PHE B -6 -31.064 1.829 21.025 1.00 32.52 H new ATOM 0 HB3 PHE B -6 -30.671 2.903 19.965 1.00 32.52 H new ATOM 0 HD1 PHE B -6 -29.391 1.122 22.715 1.00 28.81 H new ATOM 0 HD2 PHE B -6 -28.387 3.606 19.742 1.00 27.87 H new ATOM 0 HE1 PHE B -6 -27.146 0.734 23.144 1.00 29.78 H new ATOM 0 HE2 PHE B -6 -26.135 3.225 20.155 1.00 27.04 H new ATOM 0 HZ PHE B -6 -25.508 1.812 21.878 1.00 27.55 H new ATOM 1044 N GLU B -5 -31.254 5.689 20.261 1.00 29.11 N ATOM 1045 CA GLU B -5 -30.782 7.001 19.747 1.00 28.69 C ATOM 1046 C GLU B -5 -30.928 8.119 20.767 1.00 26.80 C ATOM 1047 O GLU B -5 -30.095 9.044 20.846 1.00 25.84 O ATOM 1048 CB GLU B -5 -31.489 7.367 18.448 1.00 29.06 C ATOM 1049 CG GLU B -5 -31.155 6.383 17.313 1.00 35.07 C ATOM 1050 CD GLU B -5 -31.366 6.965 15.932 1.00 41.81 C ATOM 1051 OE1 GLU B -5 -31.060 8.171 15.720 1.00 45.31 O ATOM 1052 OE2 GLU B -5 -31.833 6.203 15.046 1.00 45.78 O ATOM 0 H GLU B -5 -31.896 5.334 19.812 1.00 29.11 H new ATOM 0 HA GLU B -5 -29.834 6.901 19.570 1.00 28.69 H new ATOM 0 HB2 GLU B -5 -32.448 7.377 18.594 1.00 29.06 H new ATOM 0 HB3 GLU B -5 -31.233 8.264 18.183 1.00 29.06 H new ATOM 0 HG2 GLU B -5 -30.231 6.101 17.400 1.00 35.07 H new ATOM 0 HG3 GLU B -5 -31.704 5.589 17.410 1.00 35.07 H new ATOM 1053 N LYS B -4 -31.984 8.008 21.568 1.00 25.35 N ATOM 1054 CA LYS B -4 -32.283 8.959 22.629 1.00 24.45 C ATOM 1055 C LYS B -4 -31.219 8.909 23.724 1.00 22.75 C ATOM 1056 O LYS B -4 -30.725 9.959 24.207 1.00 21.36 O ATOM 1057 CB LYS B -4 -33.673 8.652 23.241 1.00 25.88 C ATOM 1058 CG LYS B -4 -34.045 9.531 24.475 1.00 29.29 C ATOM 1059 CD LYS B -4 -35.463 9.274 24.959 1.00 37.03 C ATOM 1060 CE LYS B -4 -35.556 8.043 25.894 1.00 40.09 C ATOM 1061 NZ LYS B -4 -35.735 8.430 27.339 1.00 43.25 N ATOM 0 H LYS B -4 -32.555 7.367 21.508 1.00 25.35 H new ATOM 0 HA LYS B -4 -32.288 9.849 22.243 1.00 24.45 H new ATOM 0 HB2 LYS B -4 -34.349 8.773 22.556 1.00 25.88 H new ATOM 0 HB3 LYS B -4 -33.699 7.719 23.503 1.00 25.88 H new ATOM 0 HG2 LYS B -4 -33.422 9.352 25.196 1.00 29.29 H new ATOM 0 HG3 LYS B -4 -33.949 10.468 24.243 1.00 29.29 H new ATOM 0 HD2 LYS B -4 -35.789 10.058 25.428 1.00 37.03 H new ATOM 0 HD3 LYS B -4 -36.044 9.140 24.194 1.00 37.03 H new ATOM 0 HE2 LYS B -4 -36.300 7.485 25.617 1.00 40.09 H new ATOM 0 HE3 LYS B -4 -34.751 7.509 25.802 1.00 40.09 H new ATOM 0 HZ1 LYS B -4 -35.512 7.744 27.860 1.00 43.25 H new ATOM 0 HZ2 LYS B -4 -35.214 9.127 27.527 1.00 43.25 H new ATOM 0 HZ3 LYS B -4 -36.585 8.648 27.485 1.00 43.25 H new ATOM 1062 N ILE B -3 -30.875 7.696 24.140 1.00 20.71 N ATOM 1063 CA ILE B -3 -29.897 7.536 25.216 1.00 21.02 C ATOM 1064 C ILE B -3 -28.500 7.930 24.714 1.00 19.01 C ATOM 1065 O ILE B -3 -27.772 8.677 25.384 1.00 18.25 O ATOM 1066 CB ILE B -3 -29.901 6.083 25.810 1.00 21.54 C ATOM 1067 CG1 ILE B -3 -31.279 5.728 26.426 1.00 24.49 C ATOM 1068 CG2 ILE B -3 -28.823 5.956 26.868 1.00 23.99 C ATOM 1069 CD1 ILE B -3 -31.717 6.603 27.629 1.00 25.50 C ATOM 0 H ILE B -3 -31.189 6.962 23.820 1.00 20.71 H new ATOM 0 HA ILE B -3 -30.150 8.129 25.941 1.00 21.02 H new ATOM 0 HB ILE B -3 -29.724 5.463 25.085 1.00 21.54 H new ATOM 0 HG12 ILE B -3 -31.954 5.798 25.733 1.00 24.49 H new ATOM 0 HG13 ILE B -3 -31.260 4.801 26.710 1.00 24.49 H new ATOM 0 HG21 ILE B -3 -28.830 5.057 27.231 1.00 23.99 H new ATOM 0 HG22 ILE B -3 -27.957 6.137 26.471 1.00 23.99 H new ATOM 0 HG23 ILE B -3 -28.991 6.593 27.580 1.00 23.99 H new ATOM 0 HD11 ILE B -3 -32.586 6.308 27.945 1.00 25.50 H new ATOM 0 HD12 ILE B -3 -31.068 6.518 28.344 1.00 25.50 H new ATOM 0 HD13 ILE B -3 -31.772 7.531 27.351 1.00 25.50 H new ATOM 1070 N GLU B -2 -28.178 7.454 23.505 1.00 18.28 N ATOM 1071 CA GLU B -2 -26.948 7.831 22.819 1.00 18.72 C ATOM 1072 C GLU B -2 -26.792 9.355 22.772 1.00 17.62 C ATOM 1073 O GLU B -2 -25.730 9.885 23.073 1.00 16.86 O ATOM 1074 CB GLU B -2 -26.973 7.260 21.423 1.00 18.34 C ATOM 1075 CG GLU B -2 -25.702 7.249 20.751 1.00 21.23 C ATOM 1076 CD GLU B -2 -25.812 6.481 19.469 1.00 23.48 C ATOM 1077 OE1 GLU B -2 -26.616 6.911 18.628 1.00 22.93 O ATOM 1078 OE2 GLU B -2 -25.139 5.434 19.326 1.00 20.76 O ATOM 0 H GLU B -2 -28.670 6.904 23.064 1.00 18.28 H new ATOM 0 HA GLU B -2 -26.189 7.473 23.305 1.00 18.72 H new ATOM 0 HB2 GLU B -2 -27.310 6.351 21.465 1.00 18.34 H new ATOM 0 HB3 GLU B -2 -27.602 7.771 20.890 1.00 18.34 H new ATOM 0 HG2 GLU B -2 -25.415 8.158 20.570 1.00 21.23 H new ATOM 0 HG3 GLU B -2 -25.028 6.847 21.322 1.00 21.23 H new ATOM 1079 N GLY B -1 -27.871 10.067 22.440 1.00 17.99 N ATOM 1080 CA GLY B -1 -27.872 11.531 22.488 1.00 16.06 C ATOM 1081 C GLY B -1 -27.458 12.169 23.799 1.00 16.69 C ATOM 1082 O GLY B -1 -26.848 13.263 23.817 1.00 14.79 O ATOM 0 H GLY B -1 -28.615 9.720 22.183 1.00 17.99 H new ATOM 0 HA2 GLY B -1 -27.280 11.857 21.792 1.00 16.06 H new ATOM 0 HA3 GLY B -1 -28.765 11.841 22.269 1.00 16.06 H new ATOM 1083 N ARG B 0 -27.750 11.488 24.920 1.00 16.24 N ATOM 1084 CA ARG B 0 -27.453 12.056 26.225 1.00 17.42 C ATOM 1085 C ARG B 0 -26.101 11.662 26.762 1.00 16.56 C ATOM 1086 O ARG B 0 -25.759 12.019 27.907 1.00 15.77 O ATOM 1087 CB ARG B 0 -28.532 11.644 27.242 1.00 18.80 C ATOM 1088 CG ARG B 0 -29.832 12.423 27.052 1.00 23.73 C ATOM 1089 CD ARG B 0 -30.893 11.808 27.927 1.00 31.32 C ATOM 1090 NE ARG B 0 -32.210 12.349 27.631 1.00 36.74 N ATOM 1091 CZ ARG B 0 -33.335 11.746 27.978 1.00 38.61 C ATOM 1092 NH1 ARG B 0 -33.279 10.587 28.625 1.00 39.42 N ATOM 1093 NH2 ARG B 0 -34.498 12.300 27.684 1.00 38.40 N ATOM 0 H ARG B 0 -28.114 10.709 24.937 1.00 16.24 H new ATOM 0 HA ARG B 0 -27.444 13.018 26.100 1.00 17.42 H new ATOM 0 HB2 ARG B 0 -28.710 10.694 27.155 1.00 18.80 H new ATOM 0 HB3 ARG B 0 -28.199 11.789 28.141 1.00 18.80 H new ATOM 0 HG2 ARG B 0 -29.703 13.356 27.285 1.00 23.73 H new ATOM 0 HG3 ARG B 0 -30.107 12.398 26.122 1.00 23.73 H new ATOM 0 HD2 ARG B 0 -30.901 10.846 27.800 1.00 31.32 H new ATOM 0 HD3 ARG B 0 -30.678 11.969 28.859 1.00 31.32 H new ATOM 0 HE ARG B 0 -32.260 13.097 27.210 1.00 36.74 H new ATOM 0 HH11 ARG B 0 -32.517 10.236 28.814 1.00 39.42 H new ATOM 0 HH12 ARG B 0 -34.005 10.187 28.855 1.00 39.42 H new ATOM 0 HH21 ARG B 0 -34.523 13.052 27.267 1.00 38.40 H new ATOM 0 HH22 ARG B 0 -35.230 11.909 27.909 1.00 38.40 H new ATOM 1094 N MET B 1 -25.314 10.955 25.934 1.00 14.63 N ATOM 1095 CA MET B 1 -23.979 10.546 26.358 1.00 13.61 C ATOM 1096 C MET B 1 -23.052 11.735 26.578 1.00 13.40 C ATOM 1097 O MET B 1 -23.397 12.866 26.239 1.00 13.03 O ATOM 1098 CB MET B 1 -23.371 9.574 25.322 1.00 12.39 C ATOM 1099 CG MET B 1 -24.053 8.247 25.347 1.00 12.97 C ATOM 1100 SD MET B 1 -23.226 7.086 24.329 1.00 12.09 S ATOM 1101 CE MET B 1 -24.104 5.525 24.669 1.00 13.01 C ATOM 0 H MET B 1 -25.535 10.710 25.140 1.00 14.63 H new ATOM 0 HA MET B 1 -24.070 10.095 27.212 1.00 13.61 H new ATOM 0 HB2 MET B 1 -23.443 9.959 24.435 1.00 12.39 H new ATOM 0 HB3 MET B 1 -22.426 9.456 25.504 1.00 12.39 H new ATOM 0 HG2 MET B 1 -24.086 7.915 26.258 1.00 12.97 H new ATOM 0 HG3 MET B 1 -24.970 8.347 25.048 1.00 12.97 H new ATOM 0 HE1 MET B 1 -23.711 4.811 24.142 1.00 13.01 H new ATOM 0 HE2 MET B 1 -24.029 5.310 25.612 1.00 13.01 H new ATOM 0 HE3 MET B 1 -25.040 5.622 24.434 1.00 13.01 H new ATOM 1102 N ILE B 2 -21.862 11.471 27.078 1.00 13.00 N ATOM 1103 CA ILE B 2 -20.840 12.503 27.214 1.00 12.76 C ATOM 1104 C ILE B 2 -20.319 12.715 25.807 1.00 11.76 C ATOM 1105 O ILE B 2 -19.804 11.800 25.206 1.00 11.69 O ATOM 1106 CB ILE B 2 -19.717 12.065 28.108 1.00 12.70 C ATOM 1107 CG1 ILE B 2 -20.254 11.866 29.537 1.00 14.63 C ATOM 1108 CG2 ILE B 2 -18.527 13.088 28.104 1.00 12.58 C ATOM 1109 CD1 ILE B 2 -19.323 11.021 30.394 1.00 16.24 C ATOM 0 H ILE B 2 -21.618 10.692 27.349 1.00 13.00 H new ATOM 0 HA ILE B 2 -21.207 13.308 27.613 1.00 12.76 H new ATOM 0 HB ILE B 2 -19.368 11.226 27.768 1.00 12.70 H new ATOM 0 HG12 ILE B 2 -20.379 12.732 29.956 1.00 14.63 H new ATOM 0 HG13 ILE B 2 -21.126 11.442 29.496 1.00 14.63 H new ATOM 0 HG21 ILE B 2 -17.824 12.770 28.692 1.00 12.58 H new ATOM 0 HG22 ILE B 2 -18.179 13.176 27.203 1.00 12.58 H new ATOM 0 HG23 ILE B 2 -18.841 13.951 28.415 1.00 12.58 H new ATOM 0 HD11 ILE B 2 -19.701 10.923 31.282 1.00 16.24 H new ATOM 0 HD12 ILE B 2 -19.216 10.146 29.990 1.00 16.24 H new ATOM 0 HD13 ILE B 2 -18.458 11.455 30.457 1.00 16.24 H new ATOM 1110 N ARG B 3 -20.507 13.909 25.274 1.00 10.36 N ATOM 1111 CA ARG B 3 -20.089 14.149 23.890 1.00 10.42 C ATOM 1112 C ARG B 3 -19.143 15.309 23.778 1.00 9.67 C ATOM 1113 O ARG B 3 -19.403 16.400 24.292 1.00 12.38 O ATOM 1114 CB ARG B 3 -21.318 14.394 22.998 1.00 10.62 C ATOM 1115 CG ARG B 3 -22.156 13.154 22.807 1.00 8.21 C ATOM 1116 CD ARG B 3 -23.601 13.439 22.402 1.00 10.46 C ATOM 1117 NE ARG B 3 -23.671 13.962 21.037 1.00 11.49 N ATOM 1118 CZ ARG B 3 -24.766 14.500 20.516 1.00 10.24 C ATOM 1119 NH1 ARG B 3 -25.876 14.535 21.238 1.00 8.93 N ATOM 1120 NH2 ARG B 3 -24.742 14.990 19.276 1.00 9.72 N ATOM 0 H ARG B 3 -20.863 14.581 25.676 1.00 10.36 H new ATOM 0 HA ARG B 3 -19.620 13.355 23.590 1.00 10.42 H new ATOM 0 HB2 ARG B 3 -21.865 15.092 23.392 1.00 10.62 H new ATOM 0 HB3 ARG B 3 -21.025 14.718 22.132 1.00 10.62 H new ATOM 0 HG2 ARG B 3 -21.743 12.597 22.129 1.00 8.21 H new ATOM 0 HG3 ARG B 3 -22.155 12.644 23.632 1.00 8.21 H new ATOM 0 HD2 ARG B 3 -24.125 12.625 22.467 1.00 10.46 H new ATOM 0 HD3 ARG B 3 -23.993 14.079 23.017 1.00 10.46 H new ATOM 0 HE ARG B 3 -22.966 13.918 20.547 1.00 11.49 H new ATOM 0 HH11 ARG B 3 -25.881 14.211 22.035 1.00 8.93 H new ATOM 0 HH12 ARG B 3 -26.592 14.881 20.910 1.00 8.93 H new ATOM 0 HH21 ARG B 3 -24.017 14.957 18.815 1.00 9.72 H new ATOM 0 HH22 ARG B 3 -25.452 15.339 18.938 1.00 9.72 H new ATOM 1121 N ILE B 4 -18.048 15.103 23.059 1.00 9.05 N ATOM 1122 CA AILE B 4 -17.102 16.166 22.792 0.50 8.08 C ATOM 1123 CA BILE B 4 -17.105 16.189 22.789 0.50 7.43 C ATOM 1124 C ILE B 4 -17.089 16.422 21.283 1.00 7.45 C ATOM 1125 O ILE B 4 -16.888 15.492 20.514 1.00 7.01 O ATOM 1126 CB AILE B 4 -15.700 15.764 23.281 0.50 8.76 C ATOM 1127 CB BILE B 4 -15.661 15.866 23.257 0.50 7.64 C ATOM 1128 CG1AILE B 4 -15.794 15.020 24.629 0.50 8.39 C ATOM 1129 CG1BILE B 4 -15.596 15.570 24.763 0.50 4.61 C ATOM 1130 CG2AILE B 4 -14.800 16.971 23.407 0.50 8.91 C ATOM 1131 CG2BILE B 4 -14.739 17.023 22.976 0.50 7.77 C ATOM 1132 CD1AILE B 4 -16.438 15.816 25.709 0.50 13.83 C ATOM 1133 CD1BILE B 4 -14.253 14.916 25.209 0.50 4.45 C ATOM 0 H AILE B 4 -17.836 14.344 22.714 0.50 9.05 H new ATOM 0 H BILE B 4 -17.829 14.345 22.717 0.50 9.05 H new ATOM 0 HA AILE B 4 -17.362 16.973 23.263 0.50 7.43 H new ATOM 0 HA BILE B 4 -17.396 16.972 23.282 0.50 7.43 H new ATOM 0 HB AILE B 4 -15.312 15.168 22.622 0.50 7.64 H new ATOM 0 HB BILE B 4 -15.384 15.079 22.763 0.50 7.64 H new ATOM 0 HG12AILE B 4 -16.294 14.199 24.502 0.50 4.61 H new ATOM 0 HG12BILE B 4 -15.724 16.397 25.254 0.50 4.61 H new ATOM 0 HG13AILE B 4 -14.901 14.768 24.913 0.50 4.61 H new ATOM 0 HG13BILE B 4 -16.329 14.982 25.002 0.50 4.61 H new ATOM 0 HG21AILE B 4 -13.924 16.691 23.716 0.50 7.77 H new ATOM 0 HG21BILE B 4 -13.843 16.803 23.275 0.50 7.77 H new ATOM 0 HG22AILE B 4 -14.714 17.403 22.543 0.50 7.77 H new ATOM 0 HG22BILE B 4 -14.726 17.203 22.023 0.50 7.77 H new ATOM 0 HG23AILE B 4 -15.183 17.595 24.043 0.50 7.77 H new ATOM 0 HG23BILE B 4 -15.053 17.810 23.449 0.50 7.77 H new ATOM 0 HD11AILE B 4 -16.465 15.292 26.525 0.50 4.45 H new ATOM 0 HD11BILE B 4 -14.273 14.754 26.165 0.50 4.45 H new ATOM 0 HD12AILE B 4 -15.928 16.627 25.862 0.50 4.45 H new ATOM 0 HD12BILE B 4 -14.132 14.075 24.742 0.50 4.45 H new ATOM 0 HD13AILE B 4 -17.342 16.049 25.445 0.50 4.45 H new ATOM 0 HD13BILE B 4 -13.517 15.512 24.998 0.50 4.45 H new ATOM 1134 N ALEU B 5 -17.254 17.694 20.911 0.50 7.57 N ATOM 1135 N BLEU B 5 -17.326 17.661 20.875 0.50 7.82 N ATOM 1136 CA ALEU B 5 -17.277 18.147 19.519 0.50 7.80 C ATOM 1137 CA BLEU B 5 -17.240 17.997 19.465 0.50 8.14 C ATOM 1138 C ALEU B 5 -16.024 18.960 19.199 0.50 7.85 C ATOM 1139 C BLEU B 5 -15.935 18.764 19.275 0.50 8.40 C ATOM 1140 O ALEU B 5 -15.673 19.880 19.947 0.50 7.03 O ATOM 1141 O BLEU B 5 -15.424 19.405 20.202 0.50 8.04 O ATOM 1142 CB ALEU B 5 -18.488 19.058 19.314 0.50 7.43 C ATOM 1143 CB BLEU B 5 -18.477 18.801 19.030 0.50 8.29 C ATOM 1144 CG ALEU B 5 -18.519 19.601 17.892 0.50 8.46 C ATOM 1145 CG BLEU B 5 -18.588 19.067 17.525 0.50 8.69 C ATOM 1146 CD1ALEU B 5 -19.107 18.511 17.040 0.50 9.38 C ATOM 1147 CD1BLEU B 5 -20.033 19.044 17.075 0.50 10.17 C ATOM 1148 CD2ALEU B 5 -19.336 20.859 17.854 0.50 6.88 C ATOM 1149 CD2BLEU B 5 -17.958 20.406 17.225 0.50 8.23 C ATOM 0 H ALEU B 5 -17.358 18.333 21.477 0.50 7.82 H new ATOM 0 H BLEU B 5 -17.536 18.315 21.393 0.50 7.82 H new ATOM 0 HA ALEU B 5 -17.319 17.369 18.942 0.50 8.14 H new ATOM 0 HA BLEU B 5 -17.232 17.206 18.904 0.50 8.14 H new ATOM 0 HB2ALEU B 5 -19.304 18.565 19.495 0.50 8.29 H new ATOM 0 HB2BLEU B 5 -19.272 18.326 19.319 0.50 8.29 H new ATOM 0 HB3ALEU B 5 -18.456 19.794 19.945 0.50 8.29 H new ATOM 0 HB3BLEU B 5 -18.471 19.652 19.495 0.50 8.29 H new ATOM 0 HG ALEU B 5 -17.637 19.835 17.563 0.50 8.69 H new ATOM 0 HG BLEU B 5 -18.123 18.369 17.039 0.50 8.69 H new ATOM 0 HD11ALEU B 5 -19.149 18.808 16.118 0.50 10.17 H new ATOM 0 HD11BLEU B 5 -20.078 19.214 16.121 0.50 10.17 H new ATOM 0 HD12ALEU B 5 -18.551 17.718 17.099 0.50 10.17 H new ATOM 0 HD12BLEU B 5 -20.418 18.174 17.266 0.50 10.17 H new ATOM 0 HD13ALEU B 5 -20.001 18.302 17.353 0.50 10.17 H new ATOM 0 HD13BLEU B 5 -20.531 19.728 17.549 0.50 10.17 H new ATOM 0 HD21ALEU B 5 -19.356 21.205 16.948 0.50 8.23 H new ATOM 0 HD21BLEU B 5 -18.021 20.588 16.274 0.50 8.23 H new ATOM 0 HD22ALEU B 5 -20.241 20.666 18.146 0.50 8.23 H new ATOM 0 HD22BLEU B 5 -18.423 21.100 17.718 0.50 8.23 H new ATOM 0 HD23ALEU B 5 -18.940 21.520 18.443 0.50 8.23 H new ATOM 0 HD23BLEU B 5 -17.025 20.391 17.490 0.50 8.23 H new ATOM 1150 N TYR B 6 -15.354 18.633 18.092 1.00 8.16 N ATOM 1151 CA TYR B 6 -14.077 19.228 17.827 1.00 8.93 C ATOM 1152 C TYR B 6 -14.079 19.938 16.488 1.00 8.47 C ATOM 1153 O TYR B 6 -14.512 19.370 15.495 1.00 9.37 O ATOM 1154 CB TYR B 6 -12.995 18.141 17.754 1.00 9.34 C ATOM 1155 CG TYR B 6 -12.903 17.175 18.898 1.00 12.35 C ATOM 1156 CD1 TYR B 6 -11.905 17.322 19.888 1.00 15.88 C ATOM 1157 CD2 TYR B 6 -13.761 16.040 18.963 1.00 12.03 C ATOM 1158 CE1 TYR B 6 -11.787 16.360 20.947 1.00 16.19 C ATOM 1159 CE2 TYR B 6 -13.632 15.081 20.005 1.00 15.56 C ATOM 1160 CZ TYR B 6 -12.651 15.263 20.979 1.00 17.48 C ATOM 1161 OH TYR B 6 -12.577 14.325 21.988 1.00 18.04 O ATOM 0 H ATYR B 6 -15.629 18.075 17.498 0.50 8.16 H new ATOM 0 H BTYR B 6 -15.693 18.199 17.431 0.50 8.16 H new ATOM 0 HA TYR B 6 -13.897 19.857 18.544 1.00 8.93 H new ATOM 0 HB2 TYR B 6 -13.139 17.630 16.942 1.00 9.34 H new ATOM 0 HB3 TYR B 6 -12.135 18.581 17.664 1.00 9.34 H new ATOM 0 HD1 TYR B 6 -11.322 18.046 19.853 1.00 15.88 H new ATOM 0 HD2 TYR B 6 -14.416 15.924 18.313 1.00 12.03 H new ATOM 0 HE1 TYR B 6 -11.140 16.466 21.607 1.00 16.19 H new ATOM 0 HE2 TYR B 6 -14.195 14.341 20.036 1.00 15.56 H new ATOM 0 HH TYR B 6 -11.771 14.169 22.167 1.00 18.04 H new ATOM 1162 N LEU B 7 -13.523 21.142 16.444 1.00 8.27 N ATOM 1163 CA LEU B 7 -13.162 21.787 15.178 1.00 8.75 C ATOM 1164 C LEU B 7 -11.693 21.470 14.842 1.00 9.99 C ATOM 1165 O LEU B 7 -10.816 21.641 15.719 1.00 10.97 O ATOM 1166 CB LEU B 7 -13.336 23.315 15.320 1.00 8.20 C ATOM 1167 CG LEU B 7 -14.637 23.783 15.986 1.00 7.97 C ATOM 1168 CD1 LEU B 7 -14.639 25.336 16.065 1.00 11.39 C ATOM 1169 CD2 LEU B 7 -15.871 23.291 15.209 1.00 10.04 C ATOM 0 H LEU B 7 -13.343 21.611 17.142 1.00 8.27 H new ATOM 0 HA LEU B 7 -13.735 21.456 14.468 1.00 8.75 H new ATOM 0 HB2 LEU B 7 -12.588 23.662 15.831 1.00 8.20 H new ATOM 0 HB3 LEU B 7 -13.284 23.712 14.437 1.00 8.20 H new ATOM 0 HG LEU B 7 -14.682 23.407 16.879 1.00 7.97 H new ATOM 0 HD11 LEU B 7 -15.459 25.638 16.485 1.00 11.39 H new ATOM 0 HD12 LEU B 7 -13.879 25.635 16.589 1.00 11.39 H new ATOM 0 HD13 LEU B 7 -14.580 25.706 15.170 1.00 11.39 H new ATOM 0 HD21 LEU B 7 -16.677 23.601 15.651 1.00 10.04 H new ATOM 0 HD22 LEU B 7 -15.845 23.640 14.304 1.00 10.04 H new ATOM 0 HD23 LEU B 7 -15.870 22.321 15.181 1.00 10.04 H new ATOM 1170 N LEU B 8 -11.439 20.992 13.615 1.00 9.67 N ATOM 1171 CA LEU B 8 -10.090 20.620 13.116 1.00 9.92 C ATOM 1172 C LEU B 8 -9.638 21.572 12.009 1.00 10.96 C ATOM 1173 O LEU B 8 -10.404 21.871 11.051 1.00 10.23 O ATOM 1174 CB LEU B 8 -10.069 19.184 12.523 1.00 10.26 C ATOM 1175 CG LEU B 8 -10.811 17.936 13.099 1.00 14.83 C ATOM 1176 CD1 LEU B 8 -10.102 16.581 12.737 1.00 11.82 C ATOM 1177 CD2 LEU B 8 -11.139 18.018 14.555 1.00 13.53 C ATOM 0 H LEU B 8 -12.058 20.870 13.031 1.00 9.67 H new ATOM 0 HA LEU B 8 -9.495 20.671 13.881 1.00 9.92 H new ATOM 0 HB2 LEU B 8 -10.382 19.275 11.609 1.00 10.26 H new ATOM 0 HB3 LEU B 8 -9.133 18.934 12.479 1.00 10.26 H new ATOM 0 HG LEU B 8 -11.668 17.946 12.644 1.00 14.83 H new ATOM 0 HD11 LEU B 8 -10.602 15.842 13.118 1.00 11.82 H new ATOM 0 HD12 LEU B 8 -10.064 16.483 11.773 1.00 11.82 H new ATOM 0 HD13 LEU B 8 -9.201 16.581 13.097 1.00 11.82 H new ATOM 0 HD21 LEU B 8 -11.596 17.208 14.830 1.00 13.53 H new ATOM 0 HD22 LEU B 8 -10.321 18.117 15.066 1.00 13.53 H new ATOM 0 HD23 LEU B 8 -11.714 18.783 14.715 1.00 13.53 H new ATOM 1178 N VAL B 9 -8.399 22.048 12.136 1.00 10.87 N ATOM 1179 CA VAL B 9 -7.782 22.823 11.065 1.00 11.54 C ATOM 1180 C VAL B 9 -6.632 21.992 10.584 1.00 10.48 C ATOM 1181 O VAL B 9 -5.861 21.493 11.394 1.00 12.67 O ATOM 1182 CB VAL B 9 -7.259 24.204 11.521 1.00 10.74 C ATOM 1183 CG1 VAL B 9 -6.721 24.986 10.277 1.00 12.69 C ATOM 1184 CG2 VAL B 9 -8.349 25.019 12.268 1.00 12.41 C ATOM 0 H VAL B 9 -7.904 21.933 12.830 1.00 10.87 H new ATOM 0 HA VAL B 9 -8.443 23.009 10.380 1.00 11.54 H new ATOM 0 HB VAL B 9 -6.536 24.068 12.153 1.00 10.74 H new ATOM 0 HG11 VAL B 9 -6.391 25.854 10.558 1.00 12.69 H new ATOM 0 HG12 VAL B 9 -6.000 24.484 9.866 1.00 12.69 H new ATOM 0 HG13 VAL B 9 -7.438 25.105 9.635 1.00 12.69 H new ATOM 0 HG21 VAL B 9 -7.984 25.876 12.538 1.00 12.41 H new ATOM 0 HG22 VAL B 9 -9.107 25.161 11.680 1.00 12.41 H new ATOM 0 HG23 VAL B 9 -8.638 24.529 13.054 1.00 12.41 H new ATOM 1185 N LYS B 10 -6.527 21.788 9.270 1.00 11.50 N ATOM 1186 CA LYS B 10 -5.427 20.997 8.720 1.00 12.37 C ATOM 1187 C LYS B 10 -4.065 21.695 8.950 1.00 11.60 C ATOM 1188 O LYS B 10 -3.992 22.925 9.066 1.00 12.83 O ATOM 1189 CB LYS B 10 -5.640 20.732 7.200 1.00 12.26 C ATOM 1190 CG LYS B 10 -5.150 21.897 6.335 1.00 14.42 C ATOM 1191 CD LYS B 10 -5.304 21.655 4.786 1.00 11.47 C ATOM 1192 CE LYS B 10 -5.016 23.010 4.088 1.00 11.60 C ATOM 1193 NZ LYS B 10 -3.680 23.543 4.374 1.00 11.09 N ATOM 0 H LYS B 10 -7.077 22.096 8.685 1.00 11.50 H new ATOM 0 HA LYS B 10 -5.418 20.147 9.187 1.00 12.37 H new ATOM 0 HB2 LYS B 10 -5.170 19.922 6.946 1.00 12.26 H new ATOM 0 HB3 LYS B 10 -6.582 20.579 7.029 1.00 12.26 H new ATOM 0 HG2 LYS B 10 -5.641 22.697 6.578 1.00 14.42 H new ATOM 0 HG3 LYS B 10 -4.216 22.066 6.535 1.00 14.42 H new ATOM 0 HD2 LYS B 10 -4.685 20.973 4.481 1.00 11.47 H new ATOM 0 HD3 LYS B 10 -6.197 21.342 4.574 1.00 11.47 H new ATOM 0 HE2 LYS B 10 -5.114 22.899 3.129 1.00 11.60 H new ATOM 0 HE3 LYS B 10 -5.682 23.658 4.368 1.00 11.60 H new ATOM 0 HZ1 LYS B 10 -3.493 24.199 3.802 1.00 11.09 H new ATOM 0 HZ2 LYS B 10 -3.658 23.860 5.206 1.00 11.09 H new ATOM 0 HZ3 LYS B 10 -3.077 22.894 4.288 1.00 11.09 H new ATOM 1194 N PRO B 11 -2.980 20.916 8.964 1.00 13.13 N ATOM 1195 CA PRO B 11 -1.662 21.533 9.087 1.00 14.20 C ATOM 1196 C PRO B 11 -1.392 22.490 7.927 1.00 14.24 C ATOM 1197 O PRO B 11 -1.800 22.257 6.777 1.00 13.85 O ATOM 1198 CB PRO B 11 -0.697 20.331 9.063 1.00 14.19 C ATOM 1199 CG PRO B 11 -1.557 19.147 9.463 1.00 14.48 C ATOM 1200 CD PRO B 11 -2.886 19.448 8.820 1.00 12.46 C ATOM 0 HA PRO B 11 -1.569 22.071 9.889 1.00 14.20 H new ATOM 0 HB2 PRO B 11 -0.311 20.206 8.182 1.00 14.19 H new ATOM 0 HB3 PRO B 11 0.040 20.457 9.681 1.00 14.19 H new ATOM 0 HG2 PRO B 11 -1.186 18.310 9.142 1.00 14.48 H new ATOM 0 HG3 PRO B 11 -1.635 19.071 10.427 1.00 14.48 H new ATOM 0 HD2 PRO B 11 -2.909 19.173 7.890 1.00 12.46 H new ATOM 0 HD3 PRO B 11 -3.616 18.993 9.268 1.00 12.46 H new ATOM 1201 N GLU B 12 -0.733 23.578 8.268 1.00 14.67 N ATOM 1202 CA GLU B 12 -0.314 24.639 7.365 1.00 16.24 C ATOM 1203 C GLU B 12 0.355 24.084 6.090 1.00 15.38 C ATOM 1204 O GLU B 12 0.171 24.597 4.966 1.00 15.06 O ATOM 1205 CB GLU B 12 0.716 25.443 8.193 1.00 16.66 C ATOM 1206 CG GLU B 12 1.079 26.765 7.726 1.00 18.76 C ATOM 1207 CD GLU B 12 2.267 26.714 6.802 1.00 15.49 C ATOM 1208 OE1 GLU B 12 3.232 25.964 7.072 1.00 14.77 O ATOM 1209 OE2 GLU B 12 2.201 27.436 5.805 1.00 17.29 O ATOM 0 H GLU B 12 -0.502 23.731 9.082 1.00 14.67 H new ATOM 0 HA GLU B 12 -1.068 25.168 7.059 1.00 16.24 H new ATOM 0 HB2 GLU B 12 0.369 25.531 9.095 1.00 16.66 H new ATOM 0 HB3 GLU B 12 1.528 24.915 8.252 1.00 16.66 H new ATOM 0 HG2 GLU B 12 0.325 27.165 7.265 1.00 18.76 H new ATOM 0 HG3 GLU B 12 1.282 27.334 8.485 1.00 18.76 H new ATOM 1210 N SER B 13 1.139 23.036 6.287 1.00 14.47 N ATOM 1211 CA SER B 13 1.953 22.444 5.235 1.00 14.99 C ATOM 1212 C SER B 13 1.307 21.299 4.438 1.00 15.31 C ATOM 1213 O SER B 13 1.893 20.846 3.431 1.00 15.75 O ATOM 1214 CB SER B 13 3.301 22.015 5.830 1.00 15.83 C ATOM 1215 OG SER B 13 3.215 20.794 6.525 1.00 19.36 O ATOM 0 H SER B 13 1.215 22.641 7.047 1.00 14.47 H new ATOM 0 HA SER B 13 2.067 23.140 4.569 1.00 14.99 H new ATOM 0 HB2 SER B 13 3.955 21.934 5.118 1.00 15.83 H new ATOM 0 HB3 SER B 13 3.621 22.705 6.432 1.00 15.83 H new ATOM 0 HG SER B 13 2.997 20.940 7.323 1.00 19.36 H new ATOM 1216 N MET B 14 0.096 20.878 4.846 1.00 13.49 N ATOM 1217 CA MET B 14 -0.649 19.785 4.208 1.00 12.69 C ATOM 1218 C MET B 14 -1.699 20.270 3.206 1.00 12.27 C ATOM 1219 O MET B 14 -2.410 21.273 3.436 1.00 11.22 O ATOM 1220 CB MET B 14 -1.371 18.943 5.284 1.00 13.83 C ATOM 1221 CG MET B 14 -2.124 17.712 4.724 1.00 12.83 C ATOM 1222 SD MET B 14 -2.637 16.551 6.026 1.00 14.08 S ATOM 1223 CE MET B 14 -1.074 15.907 6.543 1.00 13.11 C ATOM 0 H MET B 14 -0.318 21.229 5.513 1.00 13.49 H new ATOM 0 HA MET B 14 0.008 19.260 3.724 1.00 12.69 H new ATOM 0 HB2 MET B 14 -0.719 18.642 5.936 1.00 13.83 H new ATOM 0 HB3 MET B 14 -2.002 19.510 5.754 1.00 13.83 H new ATOM 0 HG2 MET B 14 -2.907 18.011 4.236 1.00 12.83 H new ATOM 0 HG3 MET B 14 -1.554 17.250 4.090 1.00 12.83 H new ATOM 0 HE1 MET B 14 -1.209 15.071 7.016 1.00 13.11 H new ATOM 0 HE2 MET B 14 -0.515 15.751 5.766 1.00 13.11 H new ATOM 0 HE3 MET B 14 -0.640 16.545 7.131 1.00 13.11 H new ATOM 1224 N SER B 15 -1.860 19.514 2.123 1.00 11.67 N ATOM 1225 CA SER B 15 -2.896 19.853 1.111 1.00 11.21 C ATOM 1226 C SER B 15 -4.271 19.424 1.605 1.00 12.18 C ATOM 1227 O SER B 15 -4.388 18.484 2.390 1.00 12.40 O ATOM 1228 CB SER B 15 -2.608 19.128 -0.195 1.00 10.69 C ATOM 1229 OG SER B 15 -2.612 17.690 0.010 1.00 9.41 O ATOM 0 H SER B 15 -1.396 18.812 1.946 1.00 11.67 H new ATOM 0 HA SER B 15 -2.879 20.812 0.969 1.00 11.21 H new ATOM 0 HB2 SER B 15 -3.274 19.368 -0.858 1.00 10.69 H new ATOM 0 HB3 SER B 15 -1.747 19.408 -0.544 1.00 10.69 H new ATOM 0 HG SER B 15 -2.453 17.303 -0.718 1.00 9.41 H new ATOM 1230 N AHIS B 16 -5.302 20.108 1.134 0.50 11.57 N ATOM 1231 N BHIS B 16 -5.304 20.132 1.159 0.50 11.67 N ATOM 1232 CA AHIS B 16 -6.673 19.738 1.417 0.50 11.90 C ATOM 1233 CA BHIS B 16 -6.677 19.735 1.408 0.50 12.07 C ATOM 1234 C AHIS B 16 -6.991 18.316 0.934 0.50 12.04 C ATOM 1235 C BHIS B 16 -6.829 18.255 1.042 0.50 12.05 C ATOM 1236 O AHIS B 16 -7.801 17.624 1.533 0.50 11.13 O ATOM 1237 O BHIS B 16 -7.353 17.468 1.822 0.50 10.90 O ATOM 1238 CB AHIS B 16 -7.618 20.756 0.786 0.50 12.14 C ATOM 1239 CB BHIS B 16 -7.645 20.568 0.561 0.50 12.49 C ATOM 1240 CG AHIS B 16 -7.849 21.950 1.654 0.50 12.87 C ATOM 1241 CG BHIS B 16 -9.080 20.156 0.713 0.50 13.69 C ATOM 1242 ND1AHIS B 16 -7.329 23.196 1.370 0.50 13.40 N ATOM 1243 ND1BHIS B 16 -9.825 20.464 1.833 0.50 16.43 N ATOM 1244 CD2AHIS B 16 -8.502 22.071 2.834 0.50 10.15 C ATOM 1245 CD2BHIS B 16 -9.906 19.466 -0.113 0.50 16.41 C ATOM 1246 CE1AHIS B 16 -7.663 24.034 2.331 0.50 8.39 C ATOM 1247 CE1BHIS B 16 -11.044 19.970 1.697 0.50 18.05 C ATOM 1248 NE2AHIS B 16 -8.369 23.373 3.236 0.50 11.76 N ATOM 1249 NE2BHIS B 16 -11.120 19.353 0.529 0.50 16.98 N ATOM 0 H AHIS B 16 -5.223 20.805 0.637 0.50 11.67 H new ATOM 0 H BHIS B 16 -5.224 20.857 0.703 0.50 11.67 H new ATOM 0 HA AHIS B 16 -6.798 19.742 2.379 0.50 12.07 H new ATOM 0 HA BHIS B 16 -6.886 19.880 2.344 0.50 12.07 H new ATOM 0 HB2AHIS B 16 -7.253 21.046 -0.065 0.50 12.49 H new ATOM 0 HB2BHIS B 16 -7.556 21.502 0.806 0.50 12.49 H new ATOM 0 HB3AHIS B 16 -8.468 20.329 0.599 0.50 12.49 H new ATOM 0 HB3BHIS B 16 -7.392 20.495 -0.373 0.50 12.49 H new ATOM 0 HD2AHIS B 16 -8.955 21.397 3.286 0.50 16.41 H new ATOM 0 HD2BHIS B 16 -9.693 19.132 -0.954 0.50 16.41 H new ATOM 0 HE1AHIS B 16 -7.441 24.936 2.367 0.50 18.05 H new ATOM 0 HE1BHIS B 16 -11.732 20.044 2.318 0.50 18.05 H new ATOM 0 HE2AHIS B 16 -8.692 23.708 3.959 0.50 16.98 H new ATOM 0 HE2BHIS B 16 -11.813 18.948 0.221 0.50 16.98 H new ATOM 1250 N GLU B 17 -6.328 17.890 -0.140 1.00 11.84 N ATOM 1251 CA GLU B 17 -6.512 16.532 -0.672 1.00 11.91 C ATOM 1252 C GLU B 17 -6.010 15.474 0.318 1.00 12.30 C ATOM 1253 O GLU B 17 -6.700 14.486 0.550 1.00 11.76 O ATOM 1254 CB GLU B 17 -5.854 16.383 -2.064 1.00 13.15 C ATOM 1255 CG GLU B 17 -6.086 15.047 -2.746 1.00 14.68 C ATOM 1256 CD GLU B 17 -5.222 14.927 -4.032 1.00 17.74 C ATOM 1257 OE1 GLU B 17 -5.534 15.571 -5.041 1.00 18.52 O ATOM 1258 OE2 GLU B 17 -4.234 14.210 -4.009 1.00 14.95 O ATOM 0 H AGLU B 17 -5.765 18.370 -0.578 0.50 11.84 H new ATOM 0 H BGLU B 17 -5.877 18.414 -0.652 0.50 11.84 H new ATOM 0 HA GLU B 17 -7.463 16.383 -0.789 1.00 11.91 H new ATOM 0 HB2 GLU B 17 -6.188 17.087 -2.641 1.00 13.15 H new ATOM 0 HB3 GLU B 17 -4.898 16.521 -1.971 1.00 13.15 H new ATOM 0 HG2 GLU B 17 -5.867 14.325 -2.136 1.00 14.68 H new ATOM 0 HG3 GLU B 17 -7.025 14.953 -2.972 1.00 14.68 H new ATOM 1259 N GLN B 18 -4.843 15.691 0.919 1.00 10.67 N ATOM 1260 CA GLN B 18 -4.280 14.668 1.803 1.00 11.90 C ATOM 1261 C GLN B 18 -4.999 14.716 3.143 1.00 11.85 C ATOM 1262 O GLN B 18 -5.172 13.686 3.796 1.00 13.41 O ATOM 1263 CB GLN B 18 -2.795 14.925 2.077 1.00 11.72 C ATOM 1264 CG GLN B 18 -2.098 13.735 2.808 1.00 12.69 C ATOM 1265 CD GLN B 18 -1.991 12.491 1.921 1.00 13.93 C ATOM 1266 OE1 GLN B 18 -1.718 12.594 0.734 1.00 17.10 O ATOM 1267 NE2 GLN B 18 -2.239 11.313 2.496 1.00 16.21 N ATOM 0 H GLN B 18 -4.370 16.404 0.833 1.00 10.67 H new ATOM 0 HA GLN B 18 -4.388 13.809 1.366 1.00 11.90 H new ATOM 0 HB2 GLN B 18 -2.340 15.094 1.237 1.00 11.72 H new ATOM 0 HB3 GLN B 18 -2.704 15.727 2.615 1.00 11.72 H new ATOM 0 HG2 GLN B 18 -1.210 14.006 3.090 1.00 12.69 H new ATOM 0 HG3 GLN B 18 -2.596 13.515 3.611 1.00 12.69 H new ATOM 0 HE21 GLN B 18 -2.428 11.275 3.334 1.00 16.21 H new ATOM 0 HE22 GLN B 18 -2.210 10.592 2.029 1.00 16.21 H new ATOM 1268 N PHE B 19 -5.415 15.911 3.540 1.00 11.44 N ATOM 1269 CA PHE B 19 -6.197 16.052 4.774 1.00 12.35 C ATOM 1270 C PHE B 19 -7.482 15.204 4.736 1.00 11.45 C ATOM 1271 O PHE B 19 -7.815 14.507 5.707 1.00 12.07 O ATOM 1272 CB PHE B 19 -6.475 17.517 5.071 1.00 11.38 C ATOM 1273 CG PHE B 19 -7.376 17.733 6.281 1.00 10.28 C ATOM 1274 CD1 PHE B 19 -6.856 17.662 7.579 1.00 10.00 C ATOM 1275 CD2 PHE B 19 -8.727 18.024 6.109 1.00 12.60 C ATOM 1276 CE1 PHE B 19 -7.717 17.868 8.722 1.00 8.79 C ATOM 1277 CE2 PHE B 19 -9.592 18.253 7.239 1.00 9.23 C ATOM 1278 CZ PHE B 19 -9.057 18.182 8.525 1.00 7.78 C ATOM 0 H PHE B 19 -5.261 16.646 3.121 1.00 11.44 H new ATOM 0 HA PHE B 19 -5.666 15.705 5.508 1.00 12.35 H new ATOM 0 HB2 PHE B 19 -5.633 17.975 5.218 1.00 11.38 H new ATOM 0 HB3 PHE B 19 -6.887 17.925 4.293 1.00 11.38 H new ATOM 0 HD1 PHE B 19 -5.953 17.482 7.707 1.00 10.00 H new ATOM 0 HD2 PHE B 19 -9.078 18.071 5.249 1.00 12.60 H new ATOM 0 HE1 PHE B 19 -7.377 17.791 9.584 1.00 8.79 H new ATOM 0 HE2 PHE B 19 -10.493 18.445 7.112 1.00 9.23 H new ATOM 0 HZ PHE B 19 -9.603 18.347 9.260 1.00 7.78 H new ATOM 1279 N ARG B 20 -8.186 15.238 3.618 1.00 11.44 N ATOM 1280 CA AARG B 20 -9.405 14.434 3.458 0.50 11.00 C ATOM 1281 CA BARG B 20 -9.395 14.437 3.425 0.50 11.26 C ATOM 1282 C ARG B 20 -9.109 12.927 3.606 1.00 11.91 C ATOM 1283 O ARG B 20 -9.817 12.215 4.354 1.00 10.95 O ATOM 1284 CB AARG B 20 -10.114 14.738 2.122 0.50 10.39 C ATOM 1285 CB BARG B 20 -9.993 14.745 2.039 0.50 10.81 C ATOM 1286 CG AARG B 20 -11.484 14.045 1.939 0.50 12.28 C ATOM 1287 CG BARG B 20 -11.095 13.814 1.567 0.50 13.76 C ATOM 1288 CD AARG B 20 -12.062 14.361 0.540 0.50 13.42 C ATOM 1289 CD BARG B 20 -11.710 14.323 0.251 0.50 16.08 C ATOM 1290 NE AARG B 20 -13.465 13.989 0.399 0.50 15.61 N ATOM 1291 NE BARG B 20 -13.072 13.843 0.137 0.50 20.15 N ATOM 1292 CZ AARG B 20 -13.920 12.744 0.469 0.50 12.97 C ATOM 1293 CZ BARG B 20 -14.137 14.596 -0.129 0.50 20.50 C ATOM 1294 NH1AARG B 20 -13.093 11.744 0.722 0.50 16.02 N ATOM 1295 NH1BARG B 20 -14.044 15.904 -0.362 0.50 19.21 N ATOM 1296 NH2AARG B 20 -15.205 12.507 0.302 0.50 12.97 N ATOM 1297 NH2BARG B 20 -15.307 14.011 -0.187 0.50 21.54 N ATOM 0 H AARG B 20 -7.982 15.718 2.934 0.50 11.44 H new ATOM 0 H BARG B 20 -7.979 15.728 2.942 0.50 11.44 H new ATOM 0 HA AARG B 20 -10.012 14.685 4.172 0.50 11.26 H new ATOM 0 HA BARG B 20 -10.045 14.675 4.104 0.50 11.26 H new ATOM 0 HB2AARG B 20 -10.239 15.697 2.048 0.50 10.81 H new ATOM 0 HB2BARG B 20 -10.342 15.650 2.051 0.50 10.81 H new ATOM 0 HB3AARG B 20 -9.531 14.471 1.394 0.50 10.81 H new ATOM 0 HB3BARG B 20 -9.276 14.726 1.386 0.50 10.81 H new ATOM 0 HG2AARG B 20 -11.385 13.086 2.046 0.50 13.76 H new ATOM 0 HG2BARG B 20 -10.738 12.921 1.439 0.50 13.76 H new ATOM 0 HG3AARG B 20 -12.100 14.345 2.626 0.50 13.76 H new ATOM 0 HG3BARG B 20 -11.783 13.749 2.247 0.50 13.76 H new ATOM 0 HD2AARG B 20 -11.966 15.310 0.364 0.50 16.08 H new ATOM 0 HD2BARG B 20 -11.696 15.293 0.230 0.50 16.08 H new ATOM 0 HD3AARG B 20 -11.541 13.894 -0.132 0.50 16.08 H new ATOM 0 HD3BARG B 20 -11.184 14.015 -0.504 0.50 16.08 H new ATOM 0 HE AARG B 20 -14.035 14.618 0.261 0.50 20.15 H new ATOM 0 HE BARG B 20 -13.204 13.001 0.251 0.50 20.15 H new ATOM 0 HH11AARG B 20 -12.256 11.898 0.842 0.50 19.21 H new ATOM 0 HH11BARG B 20 -13.276 16.291 -0.344 0.50 19.21 H new ATOM 0 HH12AARG B 20 -13.392 10.939 0.766 0.50 19.21 H new ATOM 0 HH12BARG B 20 -14.752 16.362 -0.531 0.50 19.21 H new ATOM 0 HH21AARG B 20 -15.746 13.158 0.148 0.50 21.54 H new ATOM 0 HH21BARG B 20 -15.371 13.164 -0.055 0.50 21.54 H new ATOM 0 HH22AARG B 20 -15.503 11.702 0.347 0.50 21.54 H new ATOM 0 HH22BARG B 20 -16.011 14.474 -0.357 0.50 21.54 H new ATOM 1298 N LYS B 21 -8.067 12.432 2.927 1.00 11.53 N ATOM 1299 CA LYS B 21 -7.630 11.027 3.104 1.00 12.36 C ATOM 1300 C LYS B 21 -7.335 10.700 4.581 1.00 12.52 C ATOM 1301 O LYS B 21 -7.745 9.638 5.100 1.00 13.81 O ATOM 1302 CB LYS B 21 -6.344 10.765 2.311 1.00 12.84 C ATOM 1303 CG LYS B 21 -6.587 10.712 0.813 1.00 12.57 C ATOM 1304 CD LYS B 21 -5.211 10.453 0.112 1.00 11.92 C ATOM 1305 CE LYS B 21 -5.279 10.166 -1.386 1.00 18.23 C ATOM 1306 NZ LYS B 21 -5.517 11.366 -2.167 1.00 19.65 N ATOM 0 H LYS B 21 -7.600 12.883 2.363 1.00 11.53 H new ATOM 0 HA LYS B 21 -8.357 10.469 2.786 1.00 12.36 H new ATOM 0 HB2 LYS B 21 -5.699 11.462 2.507 1.00 12.84 H new ATOM 0 HB3 LYS B 21 -5.953 9.927 2.602 1.00 12.84 H new ATOM 0 HG2 LYS B 21 -7.217 10.007 0.596 1.00 12.57 H new ATOM 0 HG3 LYS B 21 -6.975 11.545 0.502 1.00 12.57 H new ATOM 0 HD2 LYS B 21 -4.644 11.228 0.251 1.00 11.92 H new ATOM 0 HD3 LYS B 21 -4.779 9.703 0.550 1.00 11.92 H new ATOM 0 HE2 LYS B 21 -4.448 9.756 -1.673 1.00 18.23 H new ATOM 0 HE3 LYS B 21 -5.986 9.525 -1.559 1.00 18.23 H new ATOM 0 HZ1 LYS B 21 -5.406 11.185 -3.031 1.00 19.65 H new ATOM 0 HZ2 LYS B 21 -6.349 11.651 -2.028 1.00 19.65 H new ATOM 0 HZ3 LYS B 21 -4.942 11.999 -1.921 1.00 19.65 H new ATOM 1307 N GLU B 22 -6.684 11.626 5.268 1.00 11.22 N ATOM 1308 CA GLU B 22 -6.284 11.345 6.656 1.00 12.17 C ATOM 1309 C GLU B 22 -7.489 11.348 7.620 1.00 11.55 C ATOM 1310 O GLU B 22 -7.461 10.644 8.662 1.00 11.68 O ATOM 1311 CB GLU B 22 -5.180 12.310 7.143 1.00 11.59 C ATOM 1312 CG GLU B 22 -3.789 12.201 6.383 1.00 13.51 C ATOM 1313 CD GLU B 22 -3.340 10.765 6.212 1.00 16.83 C ATOM 1314 OE1 GLU B 22 -3.342 10.006 7.206 1.00 16.47 O ATOM 1315 OE2 GLU B 22 -3.009 10.361 5.082 1.00 17.58 O ATOM 0 H GLU B 22 -6.466 12.402 4.969 1.00 11.22 H new ATOM 0 HA GLU B 22 -5.913 10.449 6.660 1.00 12.17 H new ATOM 0 HB2 GLU B 22 -5.507 13.219 7.057 1.00 11.59 H new ATOM 0 HB3 GLU B 22 -5.028 12.151 8.088 1.00 11.59 H new ATOM 0 HG2 GLU B 22 -3.865 12.620 5.512 1.00 13.51 H new ATOM 0 HG3 GLU B 22 -3.114 12.693 6.876 1.00 13.51 H new ATOM 1316 N CYS B 23 -8.523 12.139 7.296 1.00 10.99 N ATOM 1317 CA CYS B 23 -9.789 12.108 8.089 1.00 11.98 C ATOM 1318 C CYS B 23 -10.379 10.709 7.987 1.00 12.09 C ATOM 1319 O CYS B 23 -10.853 10.143 8.977 1.00 12.29 O ATOM 1320 CB CYS B 23 -10.834 13.126 7.587 1.00 12.00 C ATOM 1321 SG CYS B 23 -10.437 14.849 7.959 1.00 12.44 S ATOM 0 H CYS B 23 -8.523 12.692 6.638 1.00 10.99 H new ATOM 0 HA CYS B 23 -9.573 12.345 9.005 1.00 11.98 H new ATOM 0 HB2 CYS B 23 -10.930 13.028 6.627 1.00 12.00 H new ATOM 0 HB3 CYS B 23 -11.694 12.911 7.981 1.00 12.00 H new ATOM 0 HG CYS B 23 -9.489 15.191 7.308 1.00 12.44 H new ATOM 1322 N VAL B 24 -10.375 10.140 6.782 1.00 11.40 N ATOM 1323 CA VAL B 24 -10.850 8.749 6.616 1.00 12.27 C ATOM 1324 C VAL B 24 -9.999 7.761 7.406 1.00 12.66 C ATOM 1325 O VAL B 24 -10.546 6.868 8.060 1.00 13.87 O ATOM 1326 CB VAL B 24 -10.929 8.365 5.123 1.00 12.86 C ATOM 1327 CG1 VAL B 24 -11.287 6.862 4.916 1.00 12.77 C ATOM 1328 CG2 VAL B 24 -11.884 9.299 4.426 1.00 13.80 C ATOM 0 H VAL B 24 -10.110 10.524 6.060 1.00 11.40 H new ATOM 0 HA VAL B 24 -11.747 8.702 6.981 1.00 12.27 H new ATOM 0 HB VAL B 24 -10.052 8.468 4.722 1.00 12.86 H new ATOM 0 HG11 VAL B 24 -11.326 6.666 3.967 1.00 12.77 H new ATOM 0 HG12 VAL B 24 -10.609 6.307 5.333 1.00 12.77 H new ATOM 0 HG13 VAL B 24 -12.149 6.676 5.319 1.00 12.77 H new ATOM 0 HG21 VAL B 24 -11.939 9.064 3.487 1.00 13.80 H new ATOM 0 HG22 VAL B 24 -12.763 9.224 4.830 1.00 13.80 H new ATOM 0 HG23 VAL B 24 -11.566 10.211 4.512 1.00 13.80 H new ATOM 1329 N VAL B 25 -8.672 7.871 7.301 1.00 11.63 N ATOM 1330 CA VAL B 25 -7.757 7.017 8.076 1.00 12.56 C ATOM 1331 C VAL B 25 -8.053 7.138 9.577 1.00 12.07 C ATOM 1332 O VAL B 25 -8.130 6.145 10.301 1.00 12.43 O ATOM 1333 CB VAL B 25 -6.243 7.361 7.776 1.00 12.64 C ATOM 1334 CG1 VAL B 25 -5.287 6.694 8.825 1.00 15.18 C ATOM 1335 CG2 VAL B 25 -5.915 6.935 6.330 1.00 11.53 C ATOM 0 H VAL B 25 -8.278 8.435 6.785 1.00 11.63 H new ATOM 0 HA VAL B 25 -7.907 6.099 7.802 1.00 12.56 H new ATOM 0 HB VAL B 25 -6.102 8.317 7.858 1.00 12.64 H new ATOM 0 HG11 VAL B 25 -4.368 6.922 8.616 1.00 15.18 H new ATOM 0 HG12 VAL B 25 -5.506 7.016 9.713 1.00 15.18 H new ATOM 0 HG13 VAL B 25 -5.395 5.731 8.795 1.00 15.18 H new ATOM 0 HG21 VAL B 25 -4.988 7.141 6.134 1.00 11.53 H new ATOM 0 HG22 VAL B 25 -6.061 5.981 6.232 1.00 11.53 H new ATOM 0 HG23 VAL B 25 -6.490 7.414 5.713 1.00 11.53 H new ATOM 1336 N HIS B 26 -8.239 8.361 10.039 1.00 11.44 N ATOM 1337 CA HIS B 26 -8.537 8.588 11.453 1.00 11.81 C ATOM 1338 C HIS B 26 -9.831 7.892 11.895 1.00 12.15 C ATOM 1339 O HIS B 26 -9.912 7.320 13.011 1.00 11.75 O ATOM 1340 CB HIS B 26 -8.597 10.092 11.742 1.00 11.05 C ATOM 1341 CG HIS B 26 -8.209 10.449 13.140 1.00 11.89 C ATOM 1342 ND1 HIS B 26 -6.983 10.113 13.676 1.00 13.11 N ATOM 1343 CD2 HIS B 26 -8.880 11.108 14.109 1.00 10.19 C ATOM 1344 CE1 HIS B 26 -6.917 10.564 14.917 1.00 15.19 C ATOM 1345 NE2 HIS B 26 -8.060 11.175 15.199 1.00 13.89 N ATOM 0 H HIS B 26 -8.199 9.074 9.559 1.00 11.44 H new ATOM 0 HA HIS B 26 -7.818 8.194 11.972 1.00 11.81 H new ATOM 0 HB2 HIS B 26 -8.011 10.556 11.123 1.00 11.05 H new ATOM 0 HB3 HIS B 26 -9.498 10.410 11.573 1.00 11.05 H new ATOM 0 HD2 HIS B 26 -9.741 11.453 14.046 1.00 10.19 H new ATOM 0 HE1 HIS B 26 -6.193 10.469 15.493 1.00 15.19 H new ATOM 0 HE2 HIS B 26 -8.253 11.552 15.947 1.00 13.89 H new ATOM 1346 N PHE B 27 -10.837 7.930 11.029 1.00 11.87 N ATOM 1347 CA PHE B 27 -12.063 7.228 11.296 1.00 13.19 C ATOM 1348 C PHE B 27 -11.807 5.720 11.408 1.00 14.60 C ATOM 1349 O PHE B 27 -12.316 5.046 12.336 1.00 13.48 O ATOM 1350 CB PHE B 27 -13.145 7.471 10.230 1.00 13.05 C ATOM 1351 CG PHE B 27 -14.421 6.732 10.546 1.00 12.79 C ATOM 1352 CD1 PHE B 27 -15.366 7.291 11.416 1.00 13.85 C ATOM 1353 CD2 PHE B 27 -14.634 5.446 10.045 1.00 13.95 C ATOM 1354 CE1 PHE B 27 -16.523 6.582 11.746 1.00 14.75 C ATOM 1355 CE2 PHE B 27 -15.784 4.703 10.389 1.00 16.73 C ATOM 1356 CZ PHE B 27 -16.745 5.290 11.240 1.00 16.90 C ATOM 0 H PHE B 27 -10.821 8.359 10.284 1.00 11.87 H new ATOM 0 HA PHE B 27 -12.393 7.580 12.137 1.00 13.19 H new ATOM 0 HB2 PHE B 27 -13.329 8.421 10.167 1.00 13.05 H new ATOM 0 HB3 PHE B 27 -12.814 7.188 9.363 1.00 13.05 H new ATOM 0 HD1 PHE B 27 -15.222 8.137 11.775 1.00 13.85 H new ATOM 0 HD2 PHE B 27 -14.005 5.071 9.472 1.00 13.95 H new ATOM 0 HE1 PHE B 27 -17.155 6.970 12.308 1.00 14.75 H new ATOM 0 HE2 PHE B 27 -15.906 3.842 10.061 1.00 16.73 H new ATOM 0 HZ PHE B 27 -17.519 4.825 11.464 1.00 16.90 H new ATOM 1357 N GLN B 28 -11.068 5.172 10.446 1.00 13.94 N ATOM 1358 CA GLN B 28 -10.756 3.722 10.501 1.00 15.43 C ATOM 1359 C GLN B 28 -10.026 3.384 11.807 1.00 15.27 C ATOM 1360 O GLN B 28 -10.288 2.367 12.409 1.00 14.95 O ATOM 1361 CB GLN B 28 -9.931 3.286 9.283 1.00 16.09 C ATOM 1362 CG GLN B 28 -10.681 3.533 8.005 1.00 19.22 C ATOM 1363 CD GLN B 28 -9.873 3.347 6.718 1.00 24.40 C ATOM 1364 OE1 GLN B 28 -8.663 3.636 6.654 1.00 27.11 O ATOM 1365 NE2 GLN B 28 -10.569 2.888 5.663 1.00 27.99 N ATOM 0 H GLN B 28 -10.743 5.595 9.771 1.00 13.94 H new ATOM 0 HA GLN B 28 -11.592 3.230 10.480 1.00 15.43 H new ATOM 0 HB2 GLN B 28 -9.091 3.771 9.267 1.00 16.09 H new ATOM 0 HB3 GLN B 28 -9.713 2.344 9.357 1.00 16.09 H new ATOM 0 HG2 GLN B 28 -11.446 2.937 7.977 1.00 19.22 H new ATOM 0 HG3 GLN B 28 -11.028 4.439 8.022 1.00 19.22 H new ATOM 0 HE21 GLN B 28 -11.404 2.699 5.748 1.00 27.99 H new ATOM 0 HE22 GLN B 28 -10.179 2.783 4.904 1.00 27.99 H new ATOM 1366 N MET B 29 -9.162 4.280 12.276 1.00 15.01 N ATOM 1367 CA MET B 29 -8.403 4.025 13.508 1.00 15.77 C ATOM 1368 C MET B 29 -9.287 4.073 14.765 1.00 16.21 C ATOM 1369 O MET B 29 -8.870 3.636 15.878 1.00 17.07 O ATOM 1370 CB MET B 29 -7.266 5.028 13.646 1.00 15.32 C ATOM 1371 CG MET B 29 -6.125 4.812 12.641 1.00 16.55 C ATOM 1372 SD MET B 29 -4.827 5.974 13.039 1.00 21.80 S ATOM 1373 CE MET B 29 -4.174 5.144 14.488 1.00 20.79 C ATOM 0 H MET B 29 -8.998 5.037 11.903 1.00 15.01 H new ATOM 0 HA MET B 29 -8.044 3.127 13.435 1.00 15.77 H new ATOM 0 HB2 MET B 29 -7.620 5.924 13.533 1.00 15.32 H new ATOM 0 HB3 MET B 29 -6.908 4.976 14.546 1.00 15.32 H new ATOM 0 HG2 MET B 29 -5.794 3.901 12.691 1.00 16.55 H new ATOM 0 HG3 MET B 29 -6.439 4.950 11.734 1.00 16.55 H new ATOM 0 HE1 MET B 29 -3.267 5.445 14.652 1.00 20.79 H new ATOM 0 HE2 MET B 29 -4.727 5.352 15.257 1.00 20.79 H new ATOM 0 HE3 MET B 29 -4.175 4.185 14.340 1.00 20.79 H new ATOM 1374 N SER B 30 -10.480 4.623 14.620 1.00 14.97 N ATOM 1375 CA SER B 30 -11.381 4.730 15.790 1.00 15.20 C ATOM 1376 C SER B 30 -12.060 3.413 16.145 1.00 15.49 C ATOM 1377 O SER B 30 -12.475 3.230 17.288 1.00 15.62 O ATOM 1378 CB SER B 30 -12.439 5.820 15.583 1.00 13.72 C ATOM 1379 OG SER B 30 -13.463 5.402 14.679 1.00 13.23 O ATOM 0 H SER B 30 -10.793 4.936 13.883 1.00 14.97 H new ATOM 0 HA SER B 30 -10.812 4.973 16.537 1.00 15.20 H new ATOM 0 HB2 SER B 30 -12.836 6.051 16.437 1.00 13.72 H new ATOM 0 HB3 SER B 30 -12.014 6.622 15.242 1.00 13.72 H new ATOM 0 HG SER B 30 -13.161 5.398 13.895 1.00 13.23 H new ATOM 1380 N ALA B 31 -12.183 2.503 15.180 1.00 16.34 N ATOM 1381 CA ALA B 31 -12.779 1.184 15.444 1.00 17.49 C ATOM 1382 C ALA B 31 -12.064 0.461 16.600 1.00 18.63 C ATOM 1383 O ALA B 31 -10.826 0.316 16.619 1.00 18.54 O ATOM 1384 CB ALA B 31 -12.821 0.321 14.148 1.00 17.52 C ATOM 0 H ALA B 31 -11.930 2.625 14.367 1.00 16.34 H new ATOM 0 HA ALA B 31 -13.696 1.322 15.728 1.00 17.49 H new ATOM 0 HB1 ALA B 31 -13.217 -0.542 14.346 1.00 17.52 H new ATOM 0 HB2 ALA B 31 -13.353 0.773 13.475 1.00 17.52 H new ATOM 0 HB3 ALA B 31 -11.919 0.193 13.815 1.00 17.52 H new ATOM 1385 N GLY B 32 -12.847 0.058 17.588 1.00 19.30 N ATOM 1386 CA GLY B 32 -12.322 -0.578 18.766 1.00 19.33 C ATOM 1387 C GLY B 32 -11.590 0.295 19.772 1.00 19.69 C ATOM 1388 O GLY B 32 -10.942 -0.240 20.662 1.00 20.70 O ATOM 0 H GLY B 32 -13.702 0.149 17.588 1.00 19.30 H new ATOM 0 HA2 GLY B 32 -13.059 -1.010 19.226 1.00 19.33 H new ATOM 0 HA3 GLY B 32 -11.715 -1.279 18.482 1.00 19.33 H new ATOM 1389 N MET B 33 -11.661 1.625 19.646 1.00 17.90 N ATOM 1390 CA MET B 33 -10.987 2.525 20.592 1.00 17.17 C ATOM 1391 C MET B 33 -11.533 2.280 21.995 1.00 17.70 C ATOM 1392 O MET B 33 -12.746 2.381 22.207 1.00 14.90 O ATOM 1393 CB MET B 33 -11.243 3.972 20.183 1.00 16.96 C ATOM 1394 CG MET B 33 -10.614 5.029 21.082 1.00 17.42 C ATOM 1395 SD MET B 33 -8.819 4.985 20.940 1.00 21.78 S ATOM 1396 CE MET B 33 -8.585 4.825 19.132 1.00 18.62 C ATOM 0 H MET B 33 -12.094 2.026 19.020 1.00 17.90 H new ATOM 0 HA MET B 33 -10.032 2.355 20.584 1.00 17.17 H new ATOM 0 HB2 MET B 33 -10.913 4.100 19.280 1.00 16.96 H new ATOM 0 HB3 MET B 33 -12.201 4.120 20.158 1.00 16.96 H new ATOM 0 HG2 MET B 33 -10.942 5.908 20.836 1.00 17.42 H new ATOM 0 HG3 MET B 33 -10.875 4.876 22.003 1.00 17.42 H new ATOM 0 HE1 MET B 33 -7.650 4.965 18.913 1.00 18.62 H new ATOM 0 HE2 MET B 33 -8.854 3.937 18.848 1.00 18.62 H new ATOM 0 HE3 MET B 33 -9.126 5.488 18.676 1.00 18.62 H new ATOM 1397 N PRO B 34 -10.651 1.939 22.958 1.00 18.70 N ATOM 1398 CA PRO B 34 -11.162 1.571 24.286 1.00 17.75 C ATOM 1399 C PRO B 34 -11.948 2.756 24.886 1.00 16.50 C ATOM 1400 O PRO B 34 -11.496 3.915 24.807 1.00 18.02 O ATOM 1401 CB PRO B 34 -9.873 1.340 25.109 1.00 17.15 C ATOM 1402 CG PRO B 34 -8.804 1.084 24.066 1.00 19.54 C ATOM 1403 CD PRO B 34 -9.178 2.043 22.969 1.00 19.07 C ATOM 0 HA PRO B 34 -11.755 0.804 24.271 1.00 17.75 H new ATOM 0 HB2 PRO B 34 -9.658 2.113 25.654 1.00 17.15 H new ATOM 0 HB3 PRO B 34 -9.968 0.586 25.711 1.00 17.15 H new ATOM 0 HG2 PRO B 34 -7.915 1.260 24.411 1.00 19.54 H new ATOM 0 HG3 PRO B 34 -8.813 0.164 23.759 1.00 19.54 H new ATOM 0 HD2 PRO B 34 -8.879 2.946 23.159 1.00 19.07 H new ATOM 0 HD3 PRO B 34 -8.790 1.789 22.117 1.00 19.07 H new ATOM 1404 N GLY B 35 -13.123 2.467 25.437 1.00 15.21 N ATOM 1405 CA GLY B 35 -13.919 3.479 26.137 1.00 13.34 C ATOM 1406 C GLY B 35 -14.841 4.260 25.203 1.00 12.05 C ATOM 1407 O GLY B 35 -15.775 4.918 25.666 1.00 12.48 O ATOM 0 H GLY B 35 -13.482 1.686 25.418 1.00 15.21 H new ATOM 0 HA2 GLY B 35 -14.452 3.047 26.823 1.00 13.34 H new ATOM 0 HA3 GLY B 35 -13.323 4.098 26.588 1.00 13.34 H new ATOM 1408 N LEU B 36 -14.606 4.173 23.887 1.00 10.18 N ATOM 1409 CA LEU B 36 -15.317 5.028 22.907 1.00 11.10 C ATOM 1410 C LEU B 36 -16.634 4.401 22.423 1.00 10.58 C ATOM 1411 O LEU B 36 -16.624 3.254 21.919 1.00 11.27 O ATOM 1412 CB LEU B 36 -14.379 5.274 21.709 1.00 9.28 C ATOM 1413 CG LEU B 36 -14.902 6.226 20.604 1.00 13.19 C ATOM 1414 CD1 LEU B 36 -15.092 7.638 21.139 1.00 9.60 C ATOM 1415 CD2 LEU B 36 -13.936 6.256 19.429 1.00 14.11 C ATOM 0 H LEU B 36 -14.041 3.628 23.537 1.00 10.18 H new ATOM 0 HA LEU B 36 -15.551 5.862 23.343 1.00 11.10 H new ATOM 0 HB2 LEU B 36 -13.543 5.632 22.047 1.00 9.28 H new ATOM 0 HB3 LEU B 36 -14.177 4.418 21.301 1.00 9.28 H new ATOM 0 HG LEU B 36 -15.762 5.888 20.308 1.00 13.19 H new ATOM 0 HD11 LEU B 36 -15.419 8.212 20.429 1.00 9.60 H new ATOM 0 HD12 LEU B 36 -15.734 7.625 21.866 1.00 9.60 H new ATOM 0 HD13 LEU B 36 -14.244 7.978 21.464 1.00 9.60 H new ATOM 0 HD21 LEU B 36 -14.276 6.855 18.746 1.00 14.11 H new ATOM 0 HD22 LEU B 36 -13.069 6.569 19.731 1.00 14.11 H new ATOM 0 HD23 LEU B 36 -13.847 5.363 19.060 1.00 14.11 H new ATOM 1416 N HIS B 37 -17.754 5.107 22.543 1.00 9.48 N ATOM 1417 CA HIS B 37 -18.997 4.560 21.998 1.00 8.48 C ATOM 1418 C HIS B 37 -19.157 4.836 20.515 1.00 8.29 C ATOM 1419 O HIS B 37 -19.673 3.989 19.780 1.00 10.09 O ATOM 1420 CB HIS B 37 -20.243 5.109 22.712 1.00 7.66 C ATOM 1421 CG HIS B 37 -21.510 4.650 22.073 1.00 7.89 C ATOM 1422 ND1 HIS B 37 -21.853 3.309 21.983 1.00 11.41 N ATOM 1423 CD2 HIS B 37 -22.479 5.329 21.414 1.00 6.55 C ATOM 1424 CE1 HIS B 37 -23.025 3.198 21.371 1.00 10.76 C ATOM 1425 NE2 HIS B 37 -23.414 4.409 20.998 1.00 10.01 N ATOM 0 H HIS B 37 -17.819 5.877 22.921 1.00 9.48 H new ATOM 0 HA HIS B 37 -18.927 3.604 22.145 1.00 8.48 H new ATOM 0 HB2 HIS B 37 -20.231 4.828 23.640 1.00 7.66 H new ATOM 0 HB3 HIS B 37 -20.214 6.079 22.709 1.00 7.66 H new ATOM 0 HD2 HIS B 37 -22.507 6.247 21.269 1.00 6.55 H new ATOM 0 HE1 HIS B 37 -23.493 2.407 21.228 1.00 10.76 H new ATOM 0 HE2 HIS B 37 -24.135 4.591 20.566 1.00 10.01 H new ATOM 1426 N LYS B 38 -18.768 6.027 20.073 1.00 7.99 N ATOM 1427 CA LYS B 38 -19.001 6.426 18.657 1.00 8.92 C ATOM 1428 C LYS B 38 -18.027 7.541 18.293 1.00 8.77 C ATOM 1429 O LYS B 38 -17.728 8.386 19.105 1.00 8.38 O ATOM 1430 CB LYS B 38 -20.465 6.908 18.473 1.00 8.60 C ATOM 1431 CG LYS B 38 -20.853 7.304 17.024 1.00 12.13 C ATOM 1432 CD LYS B 38 -22.321 7.829 16.981 1.00 13.47 C ATOM 1433 CE LYS B 38 -22.653 8.095 15.488 1.00 18.61 C ATOM 1434 NZ LYS B 38 -23.985 8.625 15.307 1.00 22.63 N ATOM 0 H LYS B 38 -18.373 6.620 20.555 1.00 7.99 H new ATOM 0 HA LYS B 38 -18.856 5.665 18.073 1.00 8.92 H new ATOM 0 HB2 LYS B 38 -21.062 6.204 18.771 1.00 8.60 H new ATOM 0 HB3 LYS B 38 -20.614 7.671 19.053 1.00 8.60 H new ATOM 0 HG2 LYS B 38 -20.249 7.988 16.696 1.00 12.13 H new ATOM 0 HG3 LYS B 38 -20.760 6.538 16.437 1.00 12.13 H new ATOM 0 HD2 LYS B 38 -22.932 7.177 17.359 1.00 13.47 H new ATOM 0 HD3 LYS B 38 -22.413 8.640 17.505 1.00 13.47 H new ATOM 0 HE2 LYS B 38 -22.007 8.719 15.122 1.00 18.61 H new ATOM 0 HE3 LYS B 38 -22.565 7.269 14.987 1.00 18.61 H new ATOM 0 HZ1 LYS B 38 -24.510 7.997 14.958 1.00 22.63 H new ATOM 0 HZ2 LYS B 38 -24.312 8.881 16.094 1.00 22.63 H new ATOM 0 HZ3 LYS B 38 -23.954 9.324 14.757 1.00 22.63 H new ATOM 1435 N TYR B 39 -17.560 7.556 17.044 1.00 9.54 N ATOM 1436 CA TYR B 39 -16.758 8.674 16.565 1.00 10.08 C ATOM 1437 C TYR B 39 -17.302 9.082 15.233 1.00 10.00 C ATOM 1438 O TYR B 39 -17.740 8.204 14.484 1.00 10.14 O ATOM 1439 CB TYR B 39 -15.300 8.243 16.400 1.00 9.63 C ATOM 1440 CG TYR B 39 -14.442 9.288 15.725 1.00 10.12 C ATOM 1441 CD1 TYR B 39 -14.135 10.490 16.370 1.00 7.50 C ATOM 1442 CD2 TYR B 39 -13.924 9.081 14.413 1.00 10.27 C ATOM 1443 CE1 TYR B 39 -13.337 11.436 15.782 1.00 6.77 C ATOM 1444 CE2 TYR B 39 -13.116 10.060 13.811 1.00 7.34 C ATOM 1445 CZ TYR B 39 -12.830 11.221 14.488 1.00 8.86 C ATOM 1446 OH TYR B 39 -12.041 12.160 13.875 1.00 9.01 O ATOM 0 H TYR B 39 -17.696 6.934 16.466 1.00 9.54 H new ATOM 0 HA TYR B 39 -16.795 9.408 17.198 1.00 10.08 H new ATOM 0 HB2 TYR B 39 -14.928 8.042 17.273 1.00 9.63 H new ATOM 0 HB3 TYR B 39 -15.268 7.423 15.882 1.00 9.63 H new ATOM 0 HD1 TYR B 39 -14.481 10.651 17.218 1.00 7.50 H new ATOM 0 HD2 TYR B 39 -14.121 8.296 13.955 1.00 10.27 H new ATOM 0 HE1 TYR B 39 -13.131 12.220 16.238 1.00 6.77 H new ATOM 0 HE2 TYR B 39 -12.776 9.923 12.957 1.00 7.34 H new ATOM 0 HH TYR B 39 -11.763 12.709 14.447 1.00 9.01 H new ATOM 1447 N AGLU B 40 -17.335 10.387 14.941 0.50 9.49 N ATOM 1448 N BGLU B 40 -17.260 10.376 14.919 0.50 9.77 N ATOM 1449 CA AGLU B 40 -17.698 10.866 13.588 0.50 9.22 C ATOM 1450 CA BGLU B 40 -17.689 10.832 13.592 0.50 9.72 C ATOM 1451 C AGLU B 40 -16.654 11.883 13.138 0.50 9.70 C ATOM 1452 C BGLU B 40 -16.749 11.940 13.122 0.50 10.02 C ATOM 1453 O AGLU B 40 -16.115 12.635 13.951 0.50 8.86 O ATOM 1454 O BGLU B 40 -16.348 12.795 13.923 0.50 9.18 O ATOM 1455 CB AGLU B 40 -19.077 11.553 13.567 0.50 9.80 C ATOM 1456 CB BGLU B 40 -19.135 11.327 13.666 0.50 10.51 C ATOM 1457 CG AGLU B 40 -20.305 10.636 13.590 0.50 8.83 C ATOM 1458 CG BGLU B 40 -19.660 11.952 12.407 0.50 10.86 C ATOM 1459 CD AGLU B 40 -21.626 11.409 13.542 0.50 11.25 C ATOM 1460 CD BGLU B 40 -21.178 11.985 12.356 0.50 12.64 C ATOM 1461 OE1AGLU B 40 -22.676 10.772 13.354 0.50 13.03 O ATOM 1462 OE1BGLU B 40 -21.812 12.623 13.229 0.50 12.39 O ATOM 1463 OE2AGLU B 40 -21.631 12.651 13.680 0.50 12.26 O ATOM 1464 OE2BGLU B 40 -21.737 11.365 11.420 0.50 10.38 O ATOM 0 H AGLU B 40 -17.153 11.011 15.504 0.50 9.77 H new ATOM 0 H BGLU B 40 -16.992 10.998 15.448 0.50 9.77 H new ATOM 0 HA AGLU B 40 -17.732 10.097 12.998 0.50 9.72 H new ATOM 0 HA BGLU B 40 -17.652 10.102 12.954 0.50 9.72 H new ATOM 0 HB2AGLU B 40 -19.130 12.149 14.331 0.50 10.51 H new ATOM 0 HB2BGLU B 40 -19.706 10.579 13.902 0.50 10.51 H new ATOM 0 HB3AGLU B 40 -19.127 12.106 12.772 0.50 10.51 H new ATOM 0 HB3BGLU B 40 -19.204 11.974 14.385 0.50 10.51 H new ATOM 0 HG2AGLU B 40 -20.263 10.028 12.835 0.50 10.86 H new ATOM 0 HG2BGLU B 40 -19.318 12.857 12.333 0.50 10.86 H new ATOM 0 HG3AGLU B 40 -20.282 10.093 14.393 0.50 10.86 H new ATOM 0 HG3BGLU B 40 -19.325 11.459 11.642 0.50 10.86 H new ATOM 1465 N VAL B 41 -16.379 11.909 11.839 1.00 9.38 N ATOM 1466 CA VAL B 41 -15.584 12.982 11.267 1.00 9.79 C ATOM 1467 C VAL B 41 -16.218 13.386 9.934 1.00 10.27 C ATOM 1468 O VAL B 41 -16.659 12.529 9.165 1.00 9.40 O ATOM 1469 CB VAL B 41 -14.120 12.554 11.105 1.00 8.36 C ATOM 1470 CG1 VAL B 41 -14.015 11.403 10.100 1.00 9.05 C ATOM 1471 CG2 VAL B 41 -13.270 13.730 10.731 1.00 9.55 C ATOM 0 H AVAL B 41 -16.643 11.316 11.275 0.50 9.38 H new ATOM 0 H BVAL B 41 -16.580 11.277 11.291 0.50 9.38 H new ATOM 0 HA VAL B 41 -15.577 13.749 11.860 1.00 9.79 H new ATOM 0 HB VAL B 41 -13.783 12.223 11.952 1.00 8.36 H new ATOM 0 HG11 VAL B 41 -13.086 11.140 10.005 1.00 9.05 H new ATOM 0 HG12 VAL B 41 -14.534 10.647 10.418 1.00 9.05 H new ATOM 0 HG13 VAL B 41 -14.359 11.692 9.240 1.00 9.05 H new ATOM 0 HG21 VAL B 41 -12.348 13.445 10.632 1.00 9.55 H new ATOM 0 HG22 VAL B 41 -13.584 14.103 9.893 1.00 9.55 H new ATOM 0 HG23 VAL B 41 -13.327 14.404 11.426 1.00 9.55 H new ATOM 1472 N ARG B 42 -16.302 14.698 9.700 1.00 9.66 N ATOM 1473 CA ARG B 42 -16.953 15.223 8.485 1.00 10.73 C ATOM 1474 C ARG B 42 -16.142 16.389 7.975 1.00 10.11 C ATOM 1475 O ARG B 42 -15.655 17.175 8.797 1.00 10.97 O ATOM 1476 CB ARG B 42 -18.354 15.789 8.795 1.00 10.49 C ATOM 1477 CG ARG B 42 -19.424 14.748 9.092 1.00 12.29 C ATOM 1478 CD ARG B 42 -20.731 15.488 9.497 1.00 13.34 C ATOM 1479 NE ARG B 42 -20.726 15.902 10.913 1.00 13.92 N ATOM 1480 CZ ARG B 42 -21.656 16.689 11.469 1.00 16.50 C ATOM 1481 NH1 ARG B 42 -22.603 17.259 10.700 1.00 15.91 N ATOM 1482 NH2 ARG B 42 -21.632 16.934 12.781 1.00 10.87 N ATOM 0 H ARG B 42 -15.991 15.302 10.227 1.00 9.66 H new ATOM 0 HA ARG B 42 -17.018 14.495 7.847 1.00 10.73 H new ATOM 0 HB2 ARG B 42 -18.284 16.386 9.556 1.00 10.49 H new ATOM 0 HB3 ARG B 42 -18.645 16.324 8.040 1.00 10.49 H new ATOM 0 HG2 ARG B 42 -19.579 14.192 8.313 1.00 12.29 H new ATOM 0 HG3 ARG B 42 -19.134 14.160 9.807 1.00 12.29 H new ATOM 0 HD2 ARG B 42 -20.845 16.270 8.934 1.00 13.34 H new ATOM 0 HD3 ARG B 42 -21.492 14.908 9.335 1.00 13.34 H new ATOM 0 HE ARG B 42 -20.085 15.620 11.413 1.00 13.92 H new ATOM 0 HH11 ARG B 42 -22.611 17.118 9.852 1.00 15.91 H new ATOM 0 HH12 ARG B 42 -23.200 17.764 11.057 1.00 15.91 H new ATOM 0 HH21 ARG B 42 -21.018 16.586 13.272 1.00 10.87 H new ATOM 0 HH22 ARG B 42 -22.231 17.440 13.135 1.00 10.87 H new ATOM 1483 N LEU B 43 -16.072 16.593 6.647 1.00 10.35 N ATOM 1484 CA LEU B 43 -15.433 17.811 6.142 1.00 10.65 C ATOM 1485 C LEU B 43 -16.387 18.993 6.231 1.00 10.41 C ATOM 1486 O LEU B 43 -17.589 18.804 6.158 1.00 10.34 O ATOM 1487 CB LEU B 43 -15.021 17.677 4.645 1.00 10.96 C ATOM 1488 CG LEU B 43 -13.778 16.868 4.310 1.00 14.07 C ATOM 1489 CD1 LEU B 43 -13.350 17.132 2.831 1.00 20.37 C ATOM 1490 CD2 LEU B 43 -12.595 17.104 5.267 1.00 14.00 C ATOM 0 H LEU B 43 -16.377 16.058 6.047 1.00 10.35 H new ATOM 0 HA LEU B 43 -14.646 17.949 6.691 1.00 10.65 H new ATOM 0 HB2 LEU B 43 -15.768 17.284 4.167 1.00 10.96 H new ATOM 0 HB3 LEU B 43 -14.896 18.571 4.291 1.00 10.96 H new ATOM 0 HG LEU B 43 -14.023 15.936 4.424 1.00 14.07 H new ATOM 0 HD11 LEU B 43 -12.557 16.613 2.626 1.00 20.37 H new ATOM 0 HD12 LEU B 43 -14.069 16.872 2.234 1.00 20.37 H new ATOM 0 HD13 LEU B 43 -13.157 18.075 2.713 1.00 20.37 H new ATOM 0 HD21 LEU B 43 -11.842 16.557 4.992 1.00 14.00 H new ATOM 0 HD22 LEU B 43 -12.341 18.040 5.243 1.00 14.00 H new ATOM 0 HD23 LEU B 43 -12.856 16.864 6.170 1.00 14.00 H new ATOM 1491 N VAL B 44 -15.845 20.204 6.354 1.00 10.18 N ATOM 1492 CA VAL B 44 -16.613 21.433 6.122 1.00 10.18 C ATOM 1493 C VAL B 44 -16.594 21.653 4.623 1.00 11.94 C ATOM 1494 O VAL B 44 -15.530 21.865 4.060 1.00 13.27 O ATOM 1495 CB VAL B 44 -15.991 22.622 6.890 1.00 10.05 C ATOM 1496 CG1 VAL B 44 -16.669 23.941 6.534 1.00 7.46 C ATOM 1497 CG2 VAL B 44 -16.044 22.379 8.408 1.00 10.26 C ATOM 0 H VAL B 44 -15.024 20.339 6.574 1.00 10.18 H new ATOM 0 HA VAL B 44 -17.524 21.358 6.447 1.00 10.18 H new ATOM 0 HB VAL B 44 -15.062 22.688 6.619 1.00 10.05 H new ATOM 0 HG11 VAL B 44 -16.255 24.663 7.032 1.00 7.46 H new ATOM 0 HG12 VAL B 44 -16.573 24.108 5.583 1.00 7.46 H new ATOM 0 HG13 VAL B 44 -17.611 23.892 6.759 1.00 7.46 H new ATOM 0 HG21 VAL B 44 -15.650 23.135 8.871 1.00 10.26 H new ATOM 0 HG22 VAL B 44 -16.967 22.275 8.687 1.00 10.26 H new ATOM 0 HG23 VAL B 44 -15.549 21.574 8.624 1.00 10.26 H new ATOM 1498 N ALA B 45 -17.750 21.551 3.976 1.00 12.87 N ATOM 1499 CA ALA B 45 -17.882 21.728 2.518 1.00 15.14 C ATOM 1500 C ALA B 45 -18.423 23.085 2.105 1.00 17.23 C ATOM 1501 O ALA B 45 -18.244 23.523 0.953 1.00 18.75 O ATOM 1502 CB ALA B 45 -18.781 20.607 1.941 1.00 15.01 C ATOM 0 H ALA B 45 -18.494 21.375 4.370 1.00 12.87 H new ATOM 0 HA ALA B 45 -16.985 21.675 2.154 1.00 15.14 H new ATOM 0 HB1 ALA B 45 -18.868 20.723 0.982 1.00 15.01 H new ATOM 0 HB2 ALA B 45 -18.381 19.743 2.127 1.00 15.01 H new ATOM 0 HB3 ALA B 45 -19.658 20.651 2.353 1.00 15.01 H new ATOM 1503 N GLY B 46 -19.131 23.738 3.016 1.00 17.53 N ATOM 1504 CA GLY B 46 -19.710 25.046 2.723 1.00 18.05 C ATOM 1505 C GLY B 46 -19.618 25.990 3.897 1.00 18.26 C ATOM 1506 O GLY B 46 -19.734 25.566 5.051 1.00 17.26 O ATOM 0 H GLY B 46 -19.289 23.444 3.809 1.00 17.53 H new ATOM 0 HA2 GLY B 46 -19.254 25.436 1.961 1.00 18.05 H new ATOM 0 HA3 GLY B 46 -20.640 24.936 2.471 1.00 18.05 H new ATOM 1507 N ASN B 47 -19.417 27.285 3.606 1.00 17.13 N ATOM 1508 CA ASN B 47 -19.272 28.292 4.650 1.00 18.07 C ATOM 1509 C ASN B 47 -20.197 29.454 4.299 1.00 20.03 C ATOM 1510 O ASN B 47 -19.744 30.532 3.914 1.00 19.93 O ATOM 1511 CB ASN B 47 -17.817 28.779 4.769 1.00 17.97 C ATOM 1512 CG ASN B 47 -16.935 27.787 5.480 1.00 18.89 C ATOM 1513 OD1 ASN B 47 -16.890 27.761 6.717 1.00 19.63 O ATOM 1514 ND2 ASN B 47 -16.205 26.958 4.710 1.00 16.21 N ATOM 0 H ASN B 47 -19.363 27.594 2.805 1.00 17.13 H new ATOM 0 HA ASN B 47 -19.509 27.909 5.509 1.00 18.07 H new ATOM 0 HB2 ASN B 47 -17.461 28.947 3.882 1.00 17.97 H new ATOM 0 HB3 ASN B 47 -17.799 29.623 5.246 1.00 17.97 H new ATOM 0 HD21 ASN B 47 -15.682 26.381 5.075 1.00 16.21 H new ATOM 0 HD22 ASN B 47 -16.262 27.005 3.853 1.00 16.21 H new ATOM 1515 N PRO B 48 -21.508 29.231 4.392 1.00 21.41 N ATOM 1516 CA PRO B 48 -22.391 30.335 3.994 1.00 22.75 C ATOM 1517 C PRO B 48 -22.278 31.562 4.924 1.00 24.50 C ATOM 1518 O PRO B 48 -22.251 31.421 6.158 1.00 24.21 O ATOM 1519 CB PRO B 48 -23.793 29.718 4.081 1.00 22.40 C ATOM 1520 CG PRO B 48 -23.672 28.495 4.909 1.00 21.52 C ATOM 1521 CD PRO B 48 -22.243 28.004 4.755 1.00 21.32 C ATOM 0 HA PRO B 48 -22.165 30.675 3.114 1.00 22.75 H new ATOM 0 HB2 PRO B 48 -24.420 30.342 4.479 1.00 22.40 H new ATOM 0 HB3 PRO B 48 -24.130 29.503 3.197 1.00 22.40 H new ATOM 0 HG2 PRO B 48 -23.872 28.687 5.839 1.00 21.52 H new ATOM 0 HG3 PRO B 48 -24.302 27.818 4.617 1.00 21.52 H new ATOM 0 HD2 PRO B 48 -21.907 27.614 5.577 1.00 21.32 H new ATOM 0 HD3 PRO B 48 -22.169 27.324 4.067 1.00 21.32 H new ATOM 1522 N THR B 49 -22.220 32.761 4.351 1.00 26.07 N ATOM 1523 CA THR B 49 -22.152 33.957 5.201 1.00 28.69 C ATOM 1524 C THR B 49 -23.425 34.808 5.212 1.00 29.84 C ATOM 1525 O THR B 49 -23.478 35.819 5.913 1.00 29.95 O ATOM 1526 CB THR B 49 -20.954 34.850 4.836 1.00 29.29 C ATOM 1527 OG1 THR B 49 -21.194 35.423 3.552 1.00 30.05 O ATOM 1528 CG2 THR B 49 -19.649 34.009 4.795 1.00 28.63 C ATOM 0 H THR B 49 -22.219 32.907 3.503 1.00 26.07 H new ATOM 0 HA THR B 49 -22.043 33.600 6.096 1.00 28.69 H new ATOM 0 HB THR B 49 -20.851 35.547 5.503 1.00 29.29 H new ATOM 0 HG1 THR B 49 -20.548 35.915 3.339 1.00 30.05 H new ATOM 0 HG21 THR B 49 -18.901 34.582 4.564 1.00 28.63 H new ATOM 0 HG22 THR B 49 -19.493 33.610 5.665 1.00 28.63 H new ATOM 0 HG23 THR B 49 -19.736 33.308 4.130 1.00 28.63 H new ATOM 1529 N ASP B 50 -24.432 34.397 4.441 1.00 31.70 N ATOM 1530 CA ASP B 50 -25.715 35.114 4.368 1.00 33.74 C ATOM 1531 C ASP B 50 -26.654 34.691 5.521 1.00 33.97 C ATOM 1532 O ASP B 50 -27.761 34.168 5.311 1.00 33.79 O ATOM 1533 CB ASP B 50 -26.367 34.924 2.974 1.00 34.51 C ATOM 1534 CG ASP B 50 -26.703 33.455 2.647 1.00 38.84 C ATOM 1535 OD1 ASP B 50 -27.681 33.227 1.881 1.00 42.08 O ATOM 1536 OD2 ASP B 50 -26.013 32.524 3.133 1.00 41.53 O ATOM 0 H ASP B 50 -24.394 33.696 3.945 1.00 31.70 H new ATOM 0 HA ASP B 50 -25.547 36.063 4.479 1.00 33.74 H new ATOM 0 HB2 ASP B 50 -27.180 35.452 2.930 1.00 34.51 H new ATOM 0 HB3 ASP B 50 -25.767 35.270 2.295 1.00 34.51 H new ATOM 1537 N THR B 51 -26.190 34.885 6.752 1.00 33.96 N ATOM 1538 CA THR B 51 -26.970 34.450 7.913 1.00 34.29 C ATOM 1539 C THR B 51 -28.037 35.487 8.261 1.00 35.55 C ATOM 1540 O THR B 51 -27.865 36.691 8.006 1.00 35.77 O ATOM 1541 CB THR B 51 -26.081 34.205 9.149 1.00 34.26 C ATOM 1542 OG1 THR B 51 -25.323 35.386 9.434 1.00 32.10 O ATOM 1543 CG2 THR B 51 -25.143 33.023 8.928 1.00 32.88 C ATOM 0 H THR B 51 -25.439 35.260 6.938 1.00 33.96 H new ATOM 0 HA THR B 51 -27.392 33.611 7.670 1.00 34.29 H new ATOM 0 HB THR B 51 -26.654 33.995 9.903 1.00 34.26 H new ATOM 0 HG1 THR B 51 -25.425 35.597 10.241 1.00 32.10 H new ATOM 0 HG21 THR B 51 -24.597 32.891 9.719 1.00 32.88 H new ATOM 0 HG22 THR B 51 -25.665 32.223 8.759 1.00 32.88 H new ATOM 0 HG23 THR B 51 -24.570 33.202 8.166 1.00 32.88 H new ATOM 1544 N ALA B 52 -29.131 35.007 8.844 1.00 36.08 N ATOM 1545 CA ALA B 52 -30.231 35.859 9.265 1.00 36.37 C ATOM 1546 C ALA B 52 -29.887 36.667 10.537 1.00 36.07 C ATOM 1547 O ALA B 52 -30.510 37.693 10.811 1.00 37.05 O ATOM 1548 CB ALA B 52 -31.488 35.012 9.484 1.00 36.87 C ATOM 0 H ALA B 52 -29.254 34.172 9.006 1.00 36.08 H new ATOM 0 HA ALA B 52 -30.397 36.503 8.559 1.00 36.37 H new ATOM 0 HB1 ALA B 52 -32.219 35.584 9.765 1.00 36.87 H new ATOM 0 HB2 ALA B 52 -31.726 34.566 8.656 1.00 36.87 H new ATOM 0 HB3 ALA B 52 -31.316 34.348 10.170 1.00 36.87 H new ATOM 1549 N VAL B 53 -28.910 36.201 11.311 1.00 34.40 N ATOM 1550 CA VAL B 53 -28.411 36.966 12.454 1.00 32.85 C ATOM 1551 C VAL B 53 -26.956 37.338 12.160 1.00 31.51 C ATOM 1552 O VAL B 53 -26.385 36.835 11.189 1.00 31.40 O ATOM 1553 CB VAL B 53 -28.571 36.207 13.803 1.00 32.96 C ATOM 1554 CG1 VAL B 53 -30.026 36.011 14.123 1.00 32.70 C ATOM 1555 CG2 VAL B 53 -27.855 34.852 13.759 1.00 32.05 C ATOM 0 H VAL B 53 -28.521 35.443 11.192 1.00 34.40 H new ATOM 0 HA VAL B 53 -28.942 37.770 12.565 1.00 32.85 H new ATOM 0 HB VAL B 53 -28.164 36.745 14.500 1.00 32.96 H new ATOM 0 HG11 VAL B 53 -30.111 35.537 14.965 1.00 32.70 H new ATOM 0 HG12 VAL B 53 -30.461 36.875 14.193 1.00 32.70 H new ATOM 0 HG13 VAL B 53 -30.446 35.494 13.418 1.00 32.70 H new ATOM 0 HG21 VAL B 53 -27.968 34.398 14.609 1.00 32.05 H new ATOM 0 HG22 VAL B 53 -28.233 34.309 13.050 1.00 32.05 H new ATOM 0 HG23 VAL B 53 -26.910 34.991 13.590 1.00 32.05 H new ATOM 1556 N PRO B 54 -26.348 38.238 12.968 1.00 30.49 N ATOM 1557 CA PRO B 54 -24.936 38.597 12.636 1.00 29.03 C ATOM 1558 C PRO B 54 -24.027 37.364 12.460 1.00 28.08 C ATOM 1559 O PRO B 54 -24.090 36.423 13.272 1.00 26.33 O ATOM 1560 CB PRO B 54 -24.509 39.459 13.820 1.00 29.62 C ATOM 1561 CG PRO B 54 -25.813 40.162 14.226 1.00 29.45 C ATOM 1562 CD PRO B 54 -26.900 39.099 14.038 1.00 30.19 C ATOM 0 HA PRO B 54 -24.863 39.055 11.784 1.00 29.03 H new ATOM 0 HB2 PRO B 54 -24.150 38.922 14.544 1.00 29.62 H new ATOM 0 HB3 PRO B 54 -23.821 40.095 13.571 1.00 29.62 H new ATOM 0 HG2 PRO B 54 -25.776 40.470 15.145 1.00 29.45 H new ATOM 0 HG3 PRO B 54 -25.981 40.940 13.672 1.00 29.45 H new ATOM 0 HD2 PRO B 54 -27.058 38.600 14.854 1.00 30.19 H new ATOM 0 HD3 PRO B 54 -27.747 39.494 13.779 1.00 30.19 H new ATOM 1563 N TYR B 55 -23.219 37.373 11.393 1.00 25.99 N ATOM 1564 CA TYR B 55 -22.381 36.232 11.051 1.00 25.75 C ATOM 1565 C TYR B 55 -21.168 36.165 11.975 1.00 25.18 C ATOM 1566 O TYR B 55 -20.578 37.203 12.286 1.00 25.43 O ATOM 1567 CB TYR B 55 -21.930 36.356 9.599 1.00 25.55 C ATOM 1568 CG TYR B 55 -20.840 35.420 9.224 1.00 26.46 C ATOM 1569 CD1 TYR B 55 -21.077 34.041 9.090 1.00 27.46 C ATOM 1570 CD2 TYR B 55 -19.546 35.901 9.002 1.00 27.76 C ATOM 1571 CE1 TYR B 55 -20.015 33.157 8.728 1.00 26.71 C ATOM 1572 CE2 TYR B 55 -18.511 35.062 8.627 1.00 27.42 C ATOM 1573 CZ TYR B 55 -18.745 33.690 8.497 1.00 28.41 C ATOM 1574 OH TYR B 55 -17.676 32.892 8.149 1.00 27.68 O ATOM 0 H TYR B 55 -23.146 38.039 10.854 1.00 25.99 H new ATOM 0 HA TYR B 55 -22.893 35.416 11.162 1.00 25.75 H new ATOM 0 HB2 TYR B 55 -22.692 36.200 9.019 1.00 25.55 H new ATOM 0 HB3 TYR B 55 -21.633 37.265 9.439 1.00 25.55 H new ATOM 0 HD1 TYR B 55 -21.930 33.702 9.238 1.00 27.46 H new ATOM 0 HD2 TYR B 55 -19.376 36.809 9.109 1.00 27.76 H new ATOM 0 HE1 TYR B 55 -20.167 32.243 8.648 1.00 26.71 H new ATOM 0 HE2 TYR B 55 -17.664 35.409 8.462 1.00 27.42 H new ATOM 0 HH TYR B 55 -16.971 33.209 8.477 1.00 27.68 H new ATOM 1575 N LEU B 56 -20.802 34.968 12.437 1.00 22.60 N ATOM 1576 CA LEU B 56 -19.641 34.835 13.300 1.00 21.30 C ATOM 1577 C LEU B 56 -18.447 34.289 12.510 1.00 21.62 C ATOM 1578 O LEU B 56 -18.516 33.195 11.936 1.00 21.35 O ATOM 1579 CB LEU B 56 -19.942 33.903 14.477 1.00 19.87 C ATOM 1580 CG LEU B 56 -18.770 33.692 15.439 1.00 20.27 C ATOM 1581 CD1 LEU B 56 -18.563 34.895 16.325 1.00 23.76 C ATOM 1582 CD2 LEU B 56 -19.135 32.518 16.308 1.00 19.98 C ATOM 0 H LEU B 56 -21.211 34.232 12.262 1.00 22.60 H new ATOM 0 HA LEU B 56 -19.423 35.715 13.644 1.00 21.30 H new ATOM 0 HB2 LEU B 56 -20.693 34.262 14.975 1.00 19.87 H new ATOM 0 HB3 LEU B 56 -20.219 33.041 14.129 1.00 19.87 H new ATOM 0 HG LEU B 56 -17.953 33.546 14.936 1.00 20.27 H new ATOM 0 HD11 LEU B 56 -17.816 34.733 16.922 1.00 23.76 H new ATOM 0 HD12 LEU B 56 -18.375 35.673 15.776 1.00 23.76 H new ATOM 0 HD13 LEU B 56 -19.365 35.054 16.847 1.00 23.76 H new ATOM 0 HD21 LEU B 56 -18.417 32.346 16.938 1.00 19.98 H new ATOM 0 HD22 LEU B 56 -19.951 32.716 16.794 1.00 19.98 H new ATOM 0 HD23 LEU B 56 -19.272 31.735 15.753 1.00 19.98 H new ATOM 1583 N ASP B 57 -17.357 35.037 12.495 1.00 21.02 N ATOM 1584 CA ASP B 57 -16.180 34.593 11.760 1.00 22.35 C ATOM 1585 C ASP B 57 -15.196 33.947 12.721 1.00 20.92 C ATOM 1586 O ASP B 57 -14.633 34.610 13.591 1.00 21.36 O ATOM 1587 CB ASP B 57 -15.521 35.779 11.045 1.00 23.08 C ATOM 1588 CG ASP B 57 -14.533 35.349 9.959 1.00 27.10 C ATOM 1589 OD1 ASP B 57 -14.024 34.198 9.976 1.00 27.32 O ATOM 1590 OD2 ASP B 57 -14.267 36.206 9.083 1.00 31.18 O ATOM 0 H ASP B 57 -17.275 35.793 12.896 1.00 21.02 H new ATOM 0 HA ASP B 57 -16.448 33.943 11.092 1.00 22.35 H new ATOM 0 HB2 ASP B 57 -16.210 36.334 10.647 1.00 23.08 H new ATOM 0 HB3 ASP B 57 -15.058 36.327 11.698 1.00 23.08 H new ATOM 1591 N VAL B 58 -14.999 32.642 12.571 1.00 19.97 N ATOM 1592 CA VAL B 58 -14.059 31.930 13.397 1.00 18.58 C ATOM 1593 C VAL B 58 -12.849 31.486 12.553 1.00 19.04 C ATOM 1594 O VAL B 58 -12.100 30.619 12.986 1.00 19.53 O ATOM 1595 CB VAL B 58 -14.709 30.685 14.103 1.00 19.30 C ATOM 1596 CG1 VAL B 58 -15.802 31.111 15.096 1.00 18.75 C ATOM 1597 CG2 VAL B 58 -15.228 29.627 13.069 1.00 14.59 C ATOM 0 H VAL B 58 -15.406 32.155 11.991 1.00 19.97 H new ATOM 0 HA VAL B 58 -13.767 32.538 14.095 1.00 18.58 H new ATOM 0 HB VAL B 58 -14.012 30.248 14.616 1.00 19.30 H new ATOM 0 HG11 VAL B 58 -16.184 30.324 15.515 1.00 18.75 H new ATOM 0 HG12 VAL B 58 -15.416 31.684 15.777 1.00 18.75 H new ATOM 0 HG13 VAL B 58 -16.498 31.595 14.624 1.00 18.75 H new ATOM 0 HG21 VAL B 58 -15.621 28.877 13.543 1.00 14.59 H new ATOM 0 HG22 VAL B 58 -15.898 30.034 12.497 1.00 14.59 H new ATOM 0 HG23 VAL B 58 -14.487 29.314 12.526 1.00 14.59 H new ATOM 1598 N GLY B 59 -12.658 32.050 11.357 1.00 17.83 N ATOM 1599 CA GLY B 59 -11.592 31.572 10.489 1.00 17.76 C ATOM 1600 C GLY B 59 -11.959 30.288 9.728 1.00 17.27 C ATOM 1601 O GLY B 59 -13.151 29.879 9.699 1.00 17.61 O ATOM 0 H GLY B 59 -13.127 32.697 11.039 1.00 17.83 H new ATOM 0 HA2 GLY B 59 -11.368 32.266 9.850 1.00 17.76 H new ATOM 0 HA3 GLY B 59 -10.798 31.409 11.022 1.00 17.76 H new ATOM 1602 N ARG B 60 -10.952 29.653 9.107 1.00 16.23 N ATOM 1603 CA ARG B 60 -11.174 28.476 8.259 1.00 15.73 C ATOM 1604 C ARG B 60 -11.121 27.213 9.121 1.00 14.60 C ATOM 1605 O ARG B 60 -10.080 26.898 9.706 1.00 14.49 O ATOM 1606 CB ARG B 60 -10.108 28.355 7.149 1.00 16.61 C ATOM 1607 CG ARG B 60 -10.541 27.455 5.947 1.00 18.39 C ATOM 1608 CD ARG B 60 -9.347 27.116 5.006 1.00 19.62 C ATOM 1609 NE ARG B 60 -8.461 26.145 5.661 1.00 23.18 N ATOM 1610 CZ ARG B 60 -7.219 26.355 6.106 1.00 24.09 C ATOM 1611 NH1 ARG B 60 -6.562 25.349 6.702 1.00 18.26 N ATOM 1612 NH2 ARG B 60 -6.603 27.532 5.937 1.00 22.34 N ATOM 0 H ARG B 60 -10.128 29.893 9.167 1.00 16.23 H new ATOM 0 HA ARG B 60 -12.043 28.577 7.840 1.00 15.73 H new ATOM 0 HB2 ARG B 60 -9.897 29.242 6.818 1.00 16.61 H new ATOM 0 HB3 ARG B 60 -9.293 27.995 7.534 1.00 16.61 H new ATOM 0 HG2 ARG B 60 -10.929 26.632 6.284 1.00 18.39 H new ATOM 0 HG3 ARG B 60 -11.233 27.907 5.439 1.00 18.39 H new ATOM 0 HD2 ARG B 60 -9.676 26.753 4.169 1.00 19.62 H new ATOM 0 HD3 ARG B 60 -8.854 27.923 4.791 1.00 19.62 H new ATOM 0 HE ARG B 60 -8.777 25.353 5.770 1.00 23.18 H new ATOM 0 HH11 ARG B 60 -6.941 24.582 6.793 1.00 18.26 H new ATOM 0 HH12 ARG B 60 -5.762 25.471 6.993 1.00 18.26 H new ATOM 0 HH21 ARG B 60 -7.007 28.175 5.534 1.00 22.34 H new ATOM 0 HH22 ARG B 60 -5.803 27.645 6.232 1.00 22.34 H new ATOM 1613 N ILE B 61 -12.235 26.507 9.187 1.00 12.06 N ATOM 1614 CA ILE B 61 -12.309 25.214 9.869 1.00 10.30 C ATOM 1615 C ILE B 61 -12.411 24.157 8.766 1.00 9.97 C ATOM 1616 O ILE B 61 -13.217 24.300 7.847 1.00 9.47 O ATOM 1617 CB ILE B 61 -13.557 25.098 10.770 1.00 10.14 C ATOM 1618 CG1 ILE B 61 -13.569 26.238 11.816 1.00 9.33 C ATOM 1619 CG2 ILE B 61 -13.579 23.699 11.440 1.00 9.41 C ATOM 1620 CD1 ILE B 61 -12.246 26.450 12.641 1.00 7.43 C ATOM 0 H ILE B 61 -12.979 26.760 8.837 1.00 12.06 H new ATOM 0 HA ILE B 61 -11.531 25.103 10.438 1.00 10.30 H new ATOM 0 HB ILE B 61 -14.361 25.190 10.234 1.00 10.14 H new ATOM 0 HG12 ILE B 61 -13.777 27.067 11.358 1.00 9.33 H new ATOM 0 HG13 ILE B 61 -14.292 26.069 12.440 1.00 9.33 H new ATOM 0 HG21 ILE B 61 -14.363 23.624 12.007 1.00 9.41 H new ATOM 0 HG22 ILE B 61 -13.609 23.013 10.755 1.00 9.41 H new ATOM 0 HG23 ILE B 61 -12.780 23.585 11.977 1.00 9.41 H new ATOM 0 HD11 ILE B 61 -12.366 27.185 13.262 1.00 7.43 H new ATOM 0 HD12 ILE B 61 -12.039 25.641 13.134 1.00 7.43 H new ATOM 0 HD13 ILE B 61 -11.516 26.655 12.036 1.00 7.43 H new ATOM 1621 N ASP B 62 -11.560 23.151 8.805 1.00 9.00 N ATOM 1622 CA ASP B 62 -11.575 22.134 7.734 1.00 10.22 C ATOM 1623 C ASP B 62 -12.440 20.900 8.008 1.00 9.13 C ATOM 1624 O ASP B 62 -12.984 20.316 7.084 1.00 10.76 O ATOM 1625 CB ASP B 62 -10.152 21.734 7.407 1.00 8.48 C ATOM 1626 CG ASP B 62 -9.338 22.911 6.898 1.00 12.47 C ATOM 1627 OD1 ASP B 62 -9.768 23.553 5.885 1.00 11.30 O ATOM 1628 OD2 ASP B 62 -8.310 23.229 7.547 1.00 12.10 O ATOM 0 H ASP B 62 -10.973 23.027 9.421 1.00 9.00 H new ATOM 0 HA ASP B 62 -12.002 22.556 6.972 1.00 10.22 H new ATOM 0 HB2 ASP B 62 -9.729 21.367 8.199 1.00 8.48 H new ATOM 0 HB3 ASP B 62 -10.159 21.032 6.738 1.00 8.48 H new ATOM 1629 N ALA B 63 -12.525 20.456 9.255 1.00 9.04 N ATOM 1630 CA ALA B 63 -13.323 19.282 9.546 1.00 8.30 C ATOM 1631 C ALA B 63 -13.952 19.382 10.941 1.00 9.44 C ATOM 1632 O ALA B 63 -13.502 20.195 11.752 1.00 9.44 O ATOM 1633 CB ALA B 63 -12.504 17.993 9.414 1.00 9.07 C ATOM 0 H ALA B 63 -12.136 20.814 9.933 1.00 9.04 H new ATOM 0 HA ALA B 63 -14.035 19.246 8.889 1.00 8.30 H new ATOM 0 HB1 ALA B 63 -13.067 17.229 9.615 1.00 9.07 H new ATOM 0 HB2 ALA B 63 -12.166 17.915 8.508 1.00 9.07 H new ATOM 0 HB3 ALA B 63 -11.759 18.017 10.035 1.00 9.07 H new ATOM 1634 N ILE B 64 -14.981 18.566 11.159 1.00 8.21 N ATOM 1635 CA AILE B 64 -15.667 18.488 12.445 0.50 9.24 C ATOM 1636 CA BILE B 64 -15.706 18.493 12.425 0.50 9.13 C ATOM 1637 C ILE B 64 -15.602 17.063 12.914 1.00 9.08 C ATOM 1638 O ILE B 64 -16.021 16.173 12.204 1.00 8.92 O ATOM 1639 CB AILE B 64 -17.138 18.924 12.339 0.50 9.49 C ATOM 1640 CB BILE B 64 -17.204 18.839 12.231 0.50 9.04 C ATOM 1641 CG1AILE B 64 -17.216 20.438 12.095 0.50 9.25 C ATOM 1642 CG1BILE B 64 -17.378 20.198 11.519 0.50 8.91 C ATOM 1643 CG2AILE B 64 -17.916 18.538 13.637 0.50 8.67 C ATOM 1644 CG2BILE B 64 -17.968 18.788 13.595 0.50 8.65 C ATOM 1645 CD1AILE B 64 -18.536 20.888 11.503 0.50 8.96 C ATOM 1646 CD1BILE B 64 -16.926 21.405 12.291 0.50 5.64 C ATOM 0 H AILE B 64 -15.302 18.039 10.560 0.50 8.21 H new ATOM 0 H BILE B 64 -15.284 18.027 10.561 0.50 8.21 H new ATOM 0 HA AILE B 64 -15.232 19.088 13.071 0.50 9.13 H new ATOM 0 HA BILE B 64 -15.327 19.125 13.056 0.50 9.13 H new ATOM 0 HB AILE B 64 -17.550 18.464 11.591 0.50 9.04 H new ATOM 0 HB BILE B 64 -17.598 18.166 11.653 0.50 9.04 H new ATOM 0 HG12AILE B 64 -17.072 20.901 12.935 0.50 8.91 H new ATOM 0 HG12BILE B 64 -16.890 20.170 10.681 0.50 8.91 H new ATOM 0 HG13AILE B 64 -16.497 20.700 11.499 0.50 8.91 H new ATOM 0 HG13BILE B 64 -18.316 20.310 11.297 0.50 8.91 H new ATOM 0 HG21AILE B 64 -18.841 18.819 13.556 0.50 8.65 H new ATOM 0 HG21BILE B 64 -18.902 19.007 13.451 0.50 8.65 H new ATOM 0 HG22AILE B 64 -17.880 17.577 13.762 0.50 8.65 H new ATOM 0 HG22BILE B 64 -17.900 17.897 13.971 0.50 8.65 H new ATOM 0 HG23AILE B 64 -17.511 18.978 14.400 0.50 8.65 H new ATOM 0 HG23BILE B 64 -17.577 19.429 14.209 0.50 8.65 H new ATOM 0 HD11AILE B 64 -18.522 21.849 11.374 0.50 5.64 H new ATOM 0 HD11BILE B 64 -17.076 22.203 11.761 0.50 5.64 H new ATOM 0 HD12AILE B 64 -18.674 20.449 10.649 0.50 5.64 H new ATOM 0 HD12BILE B 64 -17.429 21.467 13.118 0.50 5.64 H new ATOM 0 HD13AILE B 64 -19.258 20.654 12.107 0.50 5.64 H new ATOM 0 HD13BILE B 64 -15.981 21.325 12.493 0.50 5.64 H new ATOM 1647 N GLY B 65 -15.022 16.854 14.112 1.00 9.40 N ATOM 1648 CA GLY B 65 -14.980 15.510 14.716 1.00 7.79 C ATOM 1649 C GLY B 65 -15.898 15.488 15.954 1.00 7.70 C ATOM 1650 O GLY B 65 -16.249 16.539 16.508 1.00 6.70 O ATOM 0 H GLY B 65 -14.652 17.471 14.584 1.00 9.40 H new ATOM 0 HA2 GLY B 65 -15.269 14.844 14.073 1.00 7.79 H new ATOM 0 HA3 GLY B 65 -14.071 15.284 14.969 1.00 7.79 H new ATOM 1651 N GLU B 66 -16.306 14.305 16.369 1.00 7.31 N ATOM 1652 CA GLU B 66 -17.172 14.192 17.538 1.00 8.44 C ATOM 1653 C GLU B 66 -16.984 12.798 18.153 1.00 8.09 C ATOM 1654 O GLU B 66 -16.926 11.781 17.415 1.00 8.73 O ATOM 1655 CB GLU B 66 -18.666 14.408 17.182 1.00 7.94 C ATOM 1656 CG GLU B 66 -19.541 14.571 18.484 1.00 8.73 C ATOM 1657 CD GLU B 66 -20.988 15.033 18.209 1.00 13.10 C ATOM 1658 OE1 GLU B 66 -21.765 15.063 19.174 1.00 8.62 O ATOM 1659 OE2 GLU B 66 -21.339 15.391 17.048 1.00 9.84 O ATOM 0 H GLU B 66 -16.099 13.558 15.996 1.00 7.31 H new ATOM 0 HA GLU B 66 -16.924 14.885 18.170 1.00 8.44 H new ATOM 0 HB2 GLU B 66 -18.758 15.197 16.626 1.00 7.94 H new ATOM 0 HB3 GLU B 66 -18.990 13.655 16.663 1.00 7.94 H new ATOM 0 HG2 GLU B 66 -19.565 13.724 18.955 1.00 8.73 H new ATOM 0 HG3 GLU B 66 -19.113 15.211 19.073 1.00 8.73 H new ATOM 1660 N CYS B 67 -16.921 12.749 19.486 1.00 7.50 N ATOM 1661 CA CYS B 67 -16.782 11.476 20.243 1.00 7.01 C ATOM 1662 C CYS B 67 -17.906 11.382 21.259 1.00 6.60 C ATOM 1663 O CYS B 67 -18.248 12.364 21.896 1.00 6.27 O ATOM 1664 CB CYS B 67 -15.474 11.480 21.053 1.00 7.93 C ATOM 1665 SG CYS B 67 -14.014 11.382 20.017 1.00 10.13 S ATOM 0 H CYS B 67 -16.957 13.448 19.986 1.00 7.50 H new ATOM 0 HA CYS B 67 -16.797 10.742 19.610 1.00 7.01 H new ATOM 0 HB2 CYS B 67 -15.432 12.288 21.588 1.00 7.93 H new ATOM 0 HB3 CYS B 67 -15.478 10.732 21.670 1.00 7.93 H new ATOM 0 HG CYS B 67 -13.579 12.485 19.833 1.00 10.13 H new ATOM 1666 N TRP B 68 -18.446 10.167 21.406 1.00 6.63 N ATOM 1667 CA TRP B 68 -19.491 9.836 22.347 1.00 8.53 C ATOM 1668 C TRP B 68 -18.909 8.831 23.344 1.00 9.48 C ATOM 1669 O TRP B 68 -18.270 7.840 22.933 1.00 9.82 O ATOM 1670 CB TRP B 68 -20.623 9.087 21.645 1.00 7.32 C ATOM 1671 CG TRP B 68 -21.618 9.879 20.827 1.00 8.84 C ATOM 1672 CD1 TRP B 68 -22.910 10.093 21.157 1.00 9.02 C ATOM 1673 CD2 TRP B 68 -21.421 10.498 19.522 1.00 6.96 C ATOM 1674 NE1 TRP B 68 -23.536 10.811 20.153 1.00 8.13 N ATOM 1675 CE2 TRP B 68 -22.644 11.066 19.146 1.00 8.10 C ATOM 1676 CE3 TRP B 68 -20.325 10.619 18.654 1.00 6.82 C ATOM 1677 CZ2 TRP B 68 -22.819 11.774 17.923 1.00 10.38 C ATOM 1678 CZ3 TRP B 68 -20.492 11.319 17.443 1.00 9.23 C ATOM 1679 CH2 TRP B 68 -21.721 11.879 17.087 1.00 7.18 C ATOM 0 H TRP B 68 -18.195 9.493 20.935 1.00 6.63 H new ATOM 0 HA TRP B 68 -19.814 10.654 22.756 1.00 8.53 H new ATOM 0 HB2 TRP B 68 -20.220 8.426 21.060 1.00 7.32 H new ATOM 0 HB3 TRP B 68 -21.119 8.601 22.322 1.00 7.32 H new ATOM 0 HD1 TRP B 68 -23.318 9.802 21.941 1.00 9.02 H new ATOM 0 HE1 TRP B 68 -24.359 11.059 20.160 1.00 8.13 H new ATOM 0 HE3 TRP B 68 -19.503 10.244 18.874 1.00 6.82 H new ATOM 0 HZ2 TRP B 68 -23.638 12.151 17.695 1.00 10.38 H new ATOM 0 HZ3 TRP B 68 -19.767 11.410 16.867 1.00 9.23 H new ATOM 0 HH2 TRP B 68 -21.803 12.329 16.277 1.00 7.18 H new ATOM 1680 N PHE B 69 -19.130 9.077 24.654 1.00 9.75 N ATOM 1681 CA PHE B 69 -18.638 8.160 25.709 1.00 10.49 C ATOM 1682 C PHE B 69 -19.849 7.811 26.571 1.00 10.17 C ATOM 1683 O PHE B 69 -20.641 8.712 26.922 1.00 9.16 O ATOM 1684 CB PHE B 69 -17.547 8.846 26.570 1.00 8.93 C ATOM 1685 CG PHE B 69 -16.378 9.336 25.779 1.00 12.79 C ATOM 1686 CD1 PHE B 69 -15.352 8.455 25.373 1.00 10.18 C ATOM 1687 CD2 PHE B 69 -16.315 10.669 25.392 1.00 11.09 C ATOM 1688 CE1 PHE B 69 -14.306 8.917 24.611 1.00 11.93 C ATOM 1689 CE2 PHE B 69 -15.251 11.145 24.620 1.00 11.47 C ATOM 1690 CZ PHE B 69 -14.247 10.273 24.248 1.00 12.51 C ATOM 0 H PHE B 69 -19.558 9.762 24.949 1.00 9.75 H new ATOM 0 HA PHE B 69 -18.237 7.367 25.320 1.00 10.49 H new ATOM 0 HB2 PHE B 69 -17.943 9.594 27.044 1.00 8.93 H new ATOM 0 HB3 PHE B 69 -17.234 8.219 27.241 1.00 8.93 H new ATOM 0 HD1 PHE B 69 -15.384 7.560 25.622 1.00 10.18 H new ATOM 0 HD2 PHE B 69 -16.991 11.253 25.650 1.00 11.09 H new ATOM 0 HE1 PHE B 69 -13.637 8.332 24.336 1.00 11.93 H new ATOM 0 HE2 PHE B 69 -15.220 12.037 24.360 1.00 11.47 H new ATOM 0 HZ PHE B 69 -13.525 10.586 23.753 1.00 12.51 H new ATOM 1691 N ALA B 70 -20.038 6.525 26.883 1.00 9.64 N ATOM 1692 CA ALA B 70 -21.307 6.117 27.470 1.00 9.74 C ATOM 1693 C ALA B 70 -21.419 6.476 28.954 1.00 11.65 C ATOM 1694 O ALA B 70 -22.551 6.550 29.510 1.00 12.23 O ATOM 1695 CB ALA B 70 -21.565 4.632 27.260 1.00 10.41 C ATOM 0 H ALA B 70 -19.463 5.896 26.766 1.00 9.64 H new ATOM 0 HA ALA B 70 -21.992 6.620 27.003 1.00 9.74 H new ATOM 0 HB1 ALA B 70 -22.415 4.391 27.661 1.00 10.41 H new ATOM 0 HB2 ALA B 70 -21.590 4.439 26.310 1.00 10.41 H new ATOM 0 HB3 ALA B 70 -20.855 4.118 27.675 1.00 10.41 H new ATOM 1696 N SER B 71 -20.266 6.713 29.586 1.00 11.96 N ATOM 1697 CA SER B 71 -20.218 6.966 31.025 1.00 12.70 C ATOM 1698 C SER B 71 -18.881 7.590 31.357 1.00 12.33 C ATOM 1699 O SER B 71 -17.958 7.532 30.560 1.00 10.66 O ATOM 1700 CB SER B 71 -20.368 5.643 31.812 1.00 11.75 C ATOM 1701 OG SER B 71 -19.194 4.820 31.726 1.00 14.29 O ATOM 0 H SER B 71 -19.500 6.731 29.196 1.00 11.96 H new ATOM 0 HA SER B 71 -20.945 7.559 31.272 1.00 12.70 H new ATOM 0 HB2 SER B 71 -20.553 5.842 32.743 1.00 11.75 H new ATOM 0 HB3 SER B 71 -21.131 5.151 31.470 1.00 11.75 H new ATOM 0 HG SER B 71 -19.179 4.284 32.373 1.00 14.29 H new ATOM 1702 N GLU B 72 -18.790 8.161 32.562 1.00 11.94 N ATOM 1703 CA AGLU B 72 -17.555 8.747 33.085 0.50 13.29 C ATOM 1704 CA BGLU B 72 -17.550 8.754 33.062 0.50 13.64 C ATOM 1705 C GLU B 72 -16.414 7.727 33.144 1.00 13.33 C ATOM 1706 O GLU B 72 -15.251 8.027 32.786 1.00 13.72 O ATOM 1707 CB AGLU B 72 -17.812 9.333 34.490 0.50 13.27 C ATOM 1708 CB BGLU B 72 -17.811 9.427 34.429 0.50 13.80 C ATOM 1709 CG AGLU B 72 -18.491 10.698 34.512 0.50 15.32 C ATOM 1710 CG BGLU B 72 -16.628 9.431 35.401 0.50 17.79 C ATOM 1711 CD AGLU B 72 -18.758 11.196 35.939 0.50 19.16 C ATOM 1712 CD BGLU B 72 -15.612 10.532 35.122 0.50 21.98 C ATOM 1713 OE1AGLU B 72 -18.009 10.812 36.859 0.50 20.26 O ATOM 1714 OE1BGLU B 72 -15.713 11.209 34.075 0.50 23.20 O ATOM 1715 OE2AGLU B 72 -19.716 11.968 36.137 0.50 23.02 O ATOM 1716 OE2BGLU B 72 -14.708 10.721 35.969 0.50 23.28 O ATOM 0 H AGLU B 72 -19.455 8.219 33.105 0.50 11.94 H new ATOM 0 H BGLU B 72 -19.449 8.214 33.112 0.50 11.94 H new ATOM 0 HA AGLU B 72 -17.282 9.453 32.478 0.50 13.64 H new ATOM 0 HA BGLU B 72 -17.258 9.431 32.432 0.50 13.64 H new ATOM 0 HB2AGLU B 72 -18.360 8.708 34.990 0.50 13.80 H new ATOM 0 HB2BGLU B 72 -18.084 10.345 34.273 0.50 13.80 H new ATOM 0 HB3AGLU B 72 -16.964 9.402 34.955 0.50 13.80 H new ATOM 0 HB3BGLU B 72 -18.558 8.978 34.855 0.50 13.80 H new ATOM 0 HG2AGLU B 72 -17.934 11.341 34.047 0.50 17.79 H new ATOM 0 HG2BGLU B 72 -16.963 9.532 36.306 0.50 17.79 H new ATOM 0 HG3AGLU B 72 -19.330 10.647 34.028 0.50 17.79 H new ATOM 0 HG3BGLU B 72 -16.181 8.571 35.358 0.50 17.79 H new ATOM 1717 N GLU B 73 -16.740 6.520 33.595 1.00 13.72 N ATOM 1718 CA GLU B 73 -15.722 5.467 33.690 1.00 13.51 C ATOM 1719 C GLU B 73 -15.177 5.089 32.284 1.00 13.02 C ATOM 1720 O GLU B 73 -13.974 4.885 32.125 1.00 13.57 O ATOM 1721 CB GLU B 73 -16.275 4.215 34.406 1.00 13.52 C ATOM 1722 CG GLU B 73 -16.574 4.450 35.915 1.00 14.98 C ATOM 1723 CD GLU B 73 -17.980 5.088 36.195 1.00 15.61 C ATOM 1724 OE1 GLU B 73 -18.798 5.279 35.279 1.00 13.42 O ATOM 1725 OE2 GLU B 73 -18.266 5.387 37.368 1.00 16.91 O ATOM 0 H GLU B 73 -17.529 6.289 33.848 1.00 13.72 H new ATOM 0 HA GLU B 73 -14.989 5.819 34.219 1.00 13.51 H new ATOM 0 HB2 GLU B 73 -17.089 3.929 33.962 1.00 13.52 H new ATOM 0 HB3 GLU B 73 -15.635 3.491 34.318 1.00 13.52 H new ATOM 0 HG2 GLU B 73 -16.515 3.602 36.383 1.00 14.98 H new ATOM 0 HG3 GLU B 73 -15.888 5.027 36.285 1.00 14.98 H new ATOM 1726 N GLN B 74 -16.059 4.993 31.296 1.00 12.58 N ATOM 1727 CA GLN B 74 -15.637 4.652 29.924 1.00 12.80 C ATOM 1728 C GLN B 74 -14.770 5.755 29.372 1.00 12.69 C ATOM 1729 O GLN B 74 -13.785 5.472 28.697 1.00 12.92 O ATOM 1730 CB GLN B 74 -16.850 4.336 28.999 1.00 10.73 C ATOM 1731 CG GLN B 74 -17.562 3.003 29.337 1.00 13.09 C ATOM 1732 CD GLN B 74 -16.727 1.759 28.975 1.00 14.34 C ATOM 1733 OE1 GLN B 74 -16.154 1.686 27.892 1.00 15.70 O ATOM 1734 NE2 GLN B 74 -16.663 0.802 29.874 1.00 15.24 N ATOM 0 H GLN B 74 -16.905 5.119 31.390 1.00 12.58 H new ATOM 0 HA GLN B 74 -15.112 3.837 29.956 1.00 12.80 H new ATOM 0 HB2 GLN B 74 -17.492 5.061 29.062 1.00 10.73 H new ATOM 0 HB3 GLN B 74 -16.545 4.306 28.079 1.00 10.73 H new ATOM 0 HG2 GLN B 74 -17.766 2.984 30.285 1.00 13.09 H new ATOM 0 HG3 GLN B 74 -18.408 2.966 28.864 1.00 13.09 H new ATOM 0 HE21 GLN B 74 -17.077 0.887 30.623 1.00 15.24 H new ATOM 0 HE22 GLN B 74 -16.207 0.091 29.713 1.00 15.24 H new ATOM 1735 N TYR B 75 -15.102 7.021 29.658 1.00 13.50 N ATOM 1736 CA TYR B 75 -14.230 8.130 29.288 1.00 14.42 C ATOM 1737 C TYR B 75 -12.828 8.008 29.906 1.00 16.49 C ATOM 1738 O TYR B 75 -11.801 8.338 29.261 1.00 16.16 O ATOM 1739 CB TYR B 75 -14.827 9.482 29.706 1.00 15.28 C ATOM 1740 CG TYR B 75 -13.968 10.677 29.287 1.00 18.48 C ATOM 1741 CD1 TYR B 75 -13.852 11.045 27.949 1.00 20.76 C ATOM 1742 CD2 TYR B 75 -13.265 11.421 30.225 1.00 24.24 C ATOM 1743 CE1 TYR B 75 -13.062 12.153 27.567 1.00 25.76 C ATOM 1744 CE2 TYR B 75 -12.473 12.519 29.851 1.00 26.82 C ATOM 1745 CZ TYR B 75 -12.388 12.873 28.529 1.00 29.08 C ATOM 1746 OH TYR B 75 -11.611 13.956 28.171 1.00 32.98 O ATOM 0 H TYR B 75 -15.824 7.252 30.063 1.00 13.50 H new ATOM 0 HA TYR B 75 -14.153 8.088 28.322 1.00 14.42 H new ATOM 0 HB2 TYR B 75 -15.710 9.573 29.315 1.00 15.28 H new ATOM 0 HB3 TYR B 75 -14.940 9.495 30.669 1.00 15.28 H new ATOM 0 HD1 TYR B 75 -14.300 10.555 27.298 1.00 20.76 H new ATOM 0 HD2 TYR B 75 -13.320 11.187 31.123 1.00 24.24 H new ATOM 0 HE1 TYR B 75 -12.998 12.395 26.671 1.00 25.76 H new ATOM 0 HE2 TYR B 75 -12.009 13.003 30.496 1.00 26.82 H new ATOM 0 HH TYR B 75 -10.831 13.697 27.998 1.00 32.98 H new ATOM 1747 N GLN B 76 -12.787 7.590 31.176 1.00 16.12 N ATOM 1748 CA GLN B 76 -11.516 7.338 31.858 1.00 17.89 C ATOM 1749 C GLN B 76 -10.748 6.161 31.246 1.00 16.95 C ATOM 1750 O GLN B 76 -9.525 6.261 31.076 1.00 18.39 O ATOM 1751 CB GLN B 76 -11.680 7.191 33.385 1.00 17.73 C ATOM 1752 CG GLN B 76 -12.035 8.518 34.132 1.00 24.08 C ATOM 1753 CD GLN B 76 -11.237 9.763 33.713 1.00 30.09 C ATOM 1754 OE1 GLN B 76 -10.058 9.698 33.318 1.00 33.44 O ATOM 1755 NE2 GLN B 76 -11.875 10.919 33.851 1.00 33.63 N ATOM 0 H GLN B 76 -13.485 7.447 31.658 1.00 16.12 H new ATOM 0 HA GLN B 76 -10.974 8.130 31.715 1.00 17.89 H new ATOM 0 HB2 GLN B 76 -12.375 6.538 33.562 1.00 17.73 H new ATOM 0 HB3 GLN B 76 -10.856 6.836 33.754 1.00 17.73 H new ATOM 0 HG2 GLN B 76 -12.978 8.701 33.999 1.00 24.08 H new ATOM 0 HG3 GLN B 76 -11.905 8.377 35.083 1.00 24.08 H new ATOM 0 HE21 GLN B 76 -12.690 10.930 34.126 1.00 33.63 H new ATOM 0 HE22 GLN B 76 -11.474 11.657 33.665 1.00 33.63 H new ATOM 1756 N VAL B 77 -11.448 5.089 30.859 1.00 17.52 N ATOM 1757 CA VAL B 77 -10.810 3.964 30.162 1.00 18.28 C ATOM 1758 C VAL B 77 -10.142 4.518 28.854 1.00 19.75 C ATOM 1759 O VAL B 77 -8.947 4.302 28.601 1.00 19.85 O ATOM 1760 CB VAL B 77 -11.827 2.827 29.834 1.00 18.72 C ATOM 1761 CG1 VAL B 77 -11.330 1.880 28.720 1.00 18.82 C ATOM 1762 CG2 VAL B 77 -12.289 2.053 31.107 1.00 17.03 C ATOM 0 H VAL B 77 -12.293 4.993 30.990 1.00 17.52 H new ATOM 0 HA VAL B 77 -10.139 3.568 30.740 1.00 18.28 H new ATOM 0 HB VAL B 77 -12.614 3.269 29.480 1.00 18.72 H new ATOM 0 HG11 VAL B 77 -11.997 1.195 28.556 1.00 18.82 H new ATOM 0 HG12 VAL B 77 -11.181 2.387 27.907 1.00 18.82 H new ATOM 0 HG13 VAL B 77 -10.499 1.462 28.997 1.00 18.82 H new ATOM 0 HG21 VAL B 77 -12.918 1.359 30.854 1.00 17.03 H new ATOM 0 HG22 VAL B 77 -11.519 1.650 31.538 1.00 17.03 H new ATOM 0 HG23 VAL B 77 -12.718 2.668 31.722 1.00 17.03 H new ATOM 1763 N TYR B 78 -10.922 5.230 28.034 1.00 19.28 N ATOM 1764 CA TYR B 78 -10.365 5.960 26.879 1.00 19.82 C ATOM 1765 C TYR B 78 -9.168 6.846 27.231 1.00 20.94 C ATOM 1766 O TYR B 78 -8.119 6.758 26.605 1.00 22.70 O ATOM 1767 CB TYR B 78 -11.480 6.815 26.259 1.00 18.41 C ATOM 1768 CG TYR B 78 -11.053 7.834 25.228 1.00 15.70 C ATOM 1769 CD1 TYR B 78 -10.714 7.446 23.926 1.00 15.69 C ATOM 1770 CD2 TYR B 78 -11.045 9.184 25.538 1.00 13.28 C ATOM 1771 CE1 TYR B 78 -10.346 8.390 22.966 1.00 15.53 C ATOM 1772 CE2 TYR B 78 -10.711 10.135 24.590 1.00 16.18 C ATOM 1773 CZ TYR B 78 -10.354 9.721 23.302 1.00 17.09 C ATOM 1774 OH TYR B 78 -10.002 10.674 22.365 1.00 17.24 O ATOM 0 H TYR B 78 -11.774 5.305 28.126 1.00 19.28 H new ATOM 0 HA TYR B 78 -10.034 5.299 26.251 1.00 19.82 H new ATOM 0 HB2 TYR B 78 -12.126 6.220 25.848 1.00 18.41 H new ATOM 0 HB3 TYR B 78 -11.939 7.281 26.975 1.00 18.41 H new ATOM 0 HD1 TYR B 78 -10.734 6.545 23.697 1.00 15.69 H new ATOM 0 HD2 TYR B 78 -11.268 9.456 26.399 1.00 13.28 H new ATOM 0 HE1 TYR B 78 -10.099 8.121 22.111 1.00 15.53 H new ATOM 0 HE2 TYR B 78 -10.724 11.039 24.807 1.00 16.18 H new ATOM 0 HH TYR B 78 -10.189 11.438 22.659 1.00 17.24 H new ATOM 1775 N MET B 79 -9.319 7.699 28.232 1.00 22.96 N ATOM 1776 CA MET B 79 -8.258 8.642 28.591 1.00 25.27 C ATOM 1777 C MET B 79 -6.960 7.970 28.991 1.00 26.53 C ATOM 1778 O MET B 79 -5.903 8.513 28.728 1.00 26.29 O ATOM 1779 CB MET B 79 -8.702 9.591 29.693 1.00 25.49 C ATOM 1780 CG MET B 79 -9.639 10.705 29.230 1.00 27.52 C ATOM 1781 SD MET B 79 -9.079 11.684 27.804 1.00 32.25 S ATOM 1782 CE MET B 79 -7.566 12.368 28.491 1.00 32.18 C ATOM 0 H MET B 79 -10.026 7.752 28.719 1.00 22.96 H new ATOM 0 HA MET B 79 -8.084 9.147 27.781 1.00 25.27 H new ATOM 0 HB2 MET B 79 -9.146 9.078 30.387 1.00 25.49 H new ATOM 0 HB3 MET B 79 -7.916 9.992 30.095 1.00 25.49 H new ATOM 0 HG2 MET B 79 -10.497 10.310 29.010 1.00 27.52 H new ATOM 0 HG3 MET B 79 -9.787 11.308 29.975 1.00 27.52 H new ATOM 0 HE1 MET B 79 -7.194 13.017 27.873 1.00 32.18 H new ATOM 0 HE2 MET B 79 -7.761 12.802 29.336 1.00 32.18 H new ATOM 0 HE3 MET B 79 -6.924 11.655 28.635 1.00 32.18 H new ATOM 1783 N GLU B 80 -7.053 6.766 29.564 1.00 28.98 N ATOM 1784 CA GLU B 80 -5.890 6.025 30.076 1.00 31.39 C ATOM 1785 C GLU B 80 -5.266 5.101 29.041 1.00 31.83 C ATOM 1786 O GLU B 80 -4.169 4.566 29.234 1.00 31.99 O ATOM 1787 CB GLU B 80 -6.274 5.223 31.336 1.00 32.35 C ATOM 1788 CG GLU B 80 -6.719 6.099 32.541 1.00 36.19 C ATOM 1789 CD GLU B 80 -7.067 5.263 33.785 1.00 43.64 C ATOM 1790 OE1 GLU B 80 -6.216 4.415 34.203 1.00 47.04 O ATOM 1791 OE2 GLU B 80 -8.177 5.464 34.353 1.00 45.24 O ATOM 0 H GLU B 80 -7.799 6.351 29.668 1.00 28.98 H new ATOM 0 HA GLU B 80 -5.220 6.689 30.301 1.00 31.39 H new ATOM 0 HB2 GLU B 80 -6.993 4.612 31.111 1.00 32.35 H new ATOM 0 HB3 GLU B 80 -5.516 4.682 31.606 1.00 32.35 H new ATOM 0 HG2 GLU B 80 -6.010 6.722 32.763 1.00 36.19 H new ATOM 0 HG3 GLU B 80 -7.491 6.627 32.285 1.00 36.19 H new ATOM 1792 N SER B 81 -5.959 4.919 27.933 1.00 31.00 N ATOM 1793 CA SER B 81 -5.565 3.951 26.940 1.00 31.35 C ATOM 1794 C SER B 81 -4.338 4.395 26.068 1.00 31.40 C ATOM 1795 O SER B 81 -4.253 5.564 25.612 1.00 29.87 O ATOM 1796 CB SER B 81 -6.777 3.631 26.080 1.00 31.65 C ATOM 1797 OG SER B 81 -6.454 2.725 25.059 1.00 34.50 O ATOM 0 H SER B 81 -6.673 5.356 27.737 1.00 31.00 H new ATOM 0 HA SER B 81 -5.256 3.156 27.402 1.00 31.35 H new ATOM 0 HB2 SER B 81 -7.480 3.259 26.635 1.00 31.65 H new ATOM 0 HB3 SER B 81 -7.125 4.449 25.691 1.00 31.65 H new ATOM 0 HG SER B 81 -6.185 2.005 25.398 1.00 34.50 H new ATOM 1798 N ASP B 82 -3.399 3.452 25.880 1.00 30.86 N ATOM 1799 CA ASP B 82 -2.262 3.594 24.938 1.00 30.85 C ATOM 1800 C ASP B 82 -2.725 3.724 23.493 1.00 29.99 C ATOM 1801 O ASP B 82 -2.084 4.430 22.690 1.00 29.79 O ATOM 1802 CB ASP B 82 -1.347 2.360 25.010 1.00 31.53 C ATOM 1803 CG ASP B 82 -0.435 2.384 26.202 1.00 33.71 C ATOM 1804 OD1 ASP B 82 -0.239 3.470 26.775 1.00 36.55 O ATOM 1805 OD2 ASP B 82 0.107 1.316 26.561 1.00 39.29 O ATOM 0 H ASP B 82 -3.402 2.701 26.300 1.00 30.86 H new ATOM 0 HA ASP B 82 -1.791 4.399 25.203 1.00 30.85 H new ATOM 0 HB2 ASP B 82 -1.893 1.559 25.041 1.00 31.53 H new ATOM 0 HB3 ASP B 82 -0.814 2.309 24.201 1.00 31.53 H new ATOM 1806 N ILE B 83 -3.816 3.022 23.166 1.00 29.02 N ATOM 1807 CA ILE B 83 -4.429 3.066 21.826 1.00 27.75 C ATOM 1808 C ILE B 83 -4.941 4.465 21.467 1.00 26.99 C ATOM 1809 O ILE B 83 -4.787 4.918 20.331 1.00 27.99 O ATOM 1810 CB ILE B 83 -5.523 2.001 21.688 1.00 28.00 C ATOM 1811 CG1 ILE B 83 -4.896 0.617 21.844 1.00 27.51 C ATOM 1812 CG2 ILE B 83 -6.261 2.128 20.364 1.00 26.89 C ATOM 1813 CD1 ILE B 83 -5.874 -0.542 21.811 1.00 27.29 C ATOM 0 H ILE B 83 -4.225 2.503 23.717 1.00 29.02 H new ATOM 0 HA ILE B 83 -3.733 2.859 21.182 1.00 27.75 H new ATOM 0 HB ILE B 83 -6.182 2.133 22.387 1.00 28.00 H new ATOM 0 HG12 ILE B 83 -4.244 0.492 21.137 1.00 27.51 H new ATOM 0 HG13 ILE B 83 -4.412 0.590 22.684 1.00 27.51 H new ATOM 0 HG21 ILE B 83 -6.945 1.442 20.307 1.00 26.89 H new ATOM 0 HG22 ILE B 83 -6.676 3.003 20.307 1.00 26.89 H new ATOM 0 HG23 ILE B 83 -5.634 2.020 19.632 1.00 26.89 H new ATOM 0 HD11 ILE B 83 -5.391 -1.376 21.916 1.00 27.29 H new ATOM 0 HD12 ILE B 83 -6.514 -0.446 22.533 1.00 27.29 H new ATOM 0 HD13 ILE B 83 -6.343 -0.546 20.962 1.00 27.29 H new ATOM 1814 N ARG B 84 -5.569 5.136 22.423 1.00 26.00 N ATOM 1815 CA ARG B 84 -5.887 6.550 22.283 1.00 24.57 C ATOM 1816 C ARG B 84 -4.624 7.359 21.994 1.00 24.10 C ATOM 1817 O ARG B 84 -4.628 8.193 21.113 1.00 22.19 O ATOM 1818 CB ARG B 84 -6.625 7.091 23.504 1.00 23.59 C ATOM 1819 CG ARG B 84 -6.762 8.609 23.479 1.00 22.50 C ATOM 1820 CD ARG B 84 -7.148 9.156 24.812 1.00 21.13 C ATOM 1821 NE ARG B 84 -7.134 10.625 24.893 1.00 23.72 N ATOM 1822 CZ ARG B 84 -6.049 11.350 25.157 1.00 28.31 C ATOM 1823 NH1 ARG B 84 -4.883 10.742 25.336 1.00 24.69 N ATOM 1824 NH2 ARG B 84 -6.123 12.682 25.235 1.00 28.30 N ATOM 0 H ARG B 84 -5.822 4.787 23.167 1.00 26.00 H new ATOM 0 HA ARG B 84 -6.487 6.643 21.527 1.00 24.57 H new ATOM 0 HB2 ARG B 84 -7.507 6.690 23.549 1.00 23.59 H new ATOM 0 HB3 ARG B 84 -6.152 6.825 24.308 1.00 23.59 H new ATOM 0 HG2 ARG B 84 -5.922 9.004 23.199 1.00 22.50 H new ATOM 0 HG3 ARG B 84 -7.428 8.862 22.821 1.00 22.50 H new ATOM 0 HD2 ARG B 84 -8.037 8.839 25.034 1.00 21.13 H new ATOM 0 HD3 ARG B 84 -6.544 8.800 25.483 1.00 21.13 H new ATOM 0 HE ARG B 84 -7.874 11.042 24.761 1.00 23.72 H new ATOM 0 HH11 ARG B 84 -4.832 9.885 25.281 1.00 24.69 H new ATOM 0 HH12 ARG B 84 -4.179 11.205 25.507 1.00 24.69 H new ATOM 0 HH21 ARG B 84 -6.876 13.079 25.114 1.00 28.30 H new ATOM 0 HH22 ARG B 84 -5.417 13.143 25.406 1.00 28.30 H new ATOM 1825 N LYS B 85 -3.542 7.116 22.745 1.00 24.29 N ATOM 1826 CA LYS B 85 -2.282 7.822 22.492 1.00 24.82 C ATOM 1827 C LYS B 85 -1.803 7.581 21.069 1.00 23.08 C ATOM 1828 O LYS B 85 -1.439 8.529 20.374 1.00 24.07 O ATOM 1829 CB LYS B 85 -1.191 7.434 23.511 1.00 25.59 C ATOM 1830 CG LYS B 85 -1.252 8.239 24.771 1.00 29.18 C ATOM 1831 CD LYS B 85 -0.392 7.625 25.869 1.00 32.74 C ATOM 1832 CE LYS B 85 -0.550 8.437 27.139 1.00 35.72 C ATOM 1833 NZ LYS B 85 -1.654 7.932 28.005 1.00 37.32 N ATOM 0 H LYS B 85 -3.518 6.554 23.396 1.00 24.29 H new ATOM 0 HA LYS B 85 -2.455 8.770 22.601 1.00 24.82 H new ATOM 0 HB2 LYS B 85 -1.280 6.493 23.730 1.00 25.59 H new ATOM 0 HB3 LYS B 85 -0.319 7.549 23.102 1.00 25.59 H new ATOM 0 HG2 LYS B 85 -0.953 9.144 24.593 1.00 29.18 H new ATOM 0 HG3 LYS B 85 -2.172 8.299 25.074 1.00 29.18 H new ATOM 0 HD2 LYS B 85 -0.657 6.705 26.026 1.00 32.74 H new ATOM 0 HD3 LYS B 85 0.539 7.610 25.596 1.00 32.74 H new ATOM 0 HE2 LYS B 85 0.282 8.418 27.637 1.00 35.72 H new ATOM 0 HE3 LYS B 85 -0.722 9.363 26.908 1.00 35.72 H new ATOM 0 HZ1 LYS B 85 -1.629 8.348 28.791 1.00 37.32 H new ATOM 0 HZ2 LYS B 85 -2.436 8.089 27.611 1.00 37.32 H new ATOM 0 HZ3 LYS B 85 -1.556 7.056 28.130 1.00 37.32 H new ATOM 1834 N ALA B 86 -1.843 6.330 20.632 1.00 22.94 N ATOM 1835 CA ALA B 86 -1.555 5.970 19.237 1.00 22.08 C ATOM 1836 C ALA B 86 -2.475 6.706 18.237 1.00 21.65 C ATOM 1837 O ALA B 86 -2.008 7.235 17.229 1.00 21.24 O ATOM 1838 CB ALA B 86 -1.689 4.496 19.046 1.00 22.08 C ATOM 0 H ALA B 86 -2.038 5.659 21.133 1.00 22.94 H new ATOM 0 HA ALA B 86 -0.643 6.246 19.056 1.00 22.08 H new ATOM 0 HB1 ALA B 86 -1.497 4.270 18.122 1.00 22.08 H new ATOM 0 HB2 ALA B 86 -1.064 4.036 19.628 1.00 22.08 H new ATOM 0 HB3 ALA B 86 -2.594 4.222 19.264 1.00 22.08 H new ATOM 1839 N TRP B 87 -3.773 6.749 18.516 1.00 19.78 N ATOM 1840 CA TRP B 87 -4.718 7.566 17.696 1.00 19.17 C ATOM 1841 C TRP B 87 -4.306 9.030 17.615 1.00 18.59 C ATOM 1842 O TRP B 87 -4.296 9.646 16.522 1.00 18.02 O ATOM 1843 CB TRP B 87 -6.100 7.460 18.317 1.00 18.67 C ATOM 1844 CG TRP B 87 -7.282 7.769 17.428 1.00 17.60 C ATOM 1845 CD1 TRP B 87 -7.388 7.580 16.066 1.00 15.39 C ATOM 1846 CD2 TRP B 87 -8.555 8.270 17.864 1.00 15.48 C ATOM 1847 NE1 TRP B 87 -8.644 7.955 15.635 1.00 13.89 N ATOM 1848 CE2 TRP B 87 -9.378 8.383 16.714 1.00 14.28 C ATOM 1849 CE3 TRP B 87 -9.070 8.674 19.112 1.00 15.10 C ATOM 1850 CZ2 TRP B 87 -10.688 8.859 16.775 1.00 12.29 C ATOM 1851 CZ3 TRP B 87 -10.377 9.127 19.173 1.00 13.88 C ATOM 1852 CH2 TRP B 87 -11.179 9.209 18.001 1.00 14.93 C ATOM 0 H TRP B 87 -4.141 6.323 19.166 1.00 19.78 H new ATOM 0 HA TRP B 87 -4.711 7.221 16.790 1.00 19.17 H new ATOM 0 HB2 TRP B 87 -6.208 6.558 18.658 1.00 18.67 H new ATOM 0 HB3 TRP B 87 -6.133 8.058 19.080 1.00 18.67 H new ATOM 0 HD1 TRP B 87 -6.713 7.249 15.519 1.00 15.39 H new ATOM 0 HE1 TRP B 87 -8.922 7.925 14.822 1.00 13.89 H new ATOM 0 HE3 TRP B 87 -8.544 8.637 19.878 1.00 15.10 H new ATOM 0 HZ2 TRP B 87 -11.209 8.935 16.008 1.00 12.29 H new ATOM 0 HZ3 TRP B 87 -10.736 9.381 19.992 1.00 13.88 H new ATOM 0 HH2 TRP B 87 -12.057 9.507 18.071 1.00 14.93 H new ATOM 1853 N PHE B 88 -3.955 9.611 18.764 1.00 18.70 N ATOM 1854 CA PHE B 88 -3.465 11.010 18.805 1.00 19.90 C ATOM 1855 C PHE B 88 -2.161 11.213 18.074 1.00 20.19 C ATOM 1856 O PHE B 88 -1.898 12.310 17.598 1.00 21.97 O ATOM 1857 CB PHE B 88 -3.332 11.579 20.235 1.00 19.49 C ATOM 1858 CG PHE B 88 -4.538 12.373 20.677 1.00 22.58 C ATOM 1859 CD1 PHE B 88 -4.711 13.700 20.260 1.00 26.77 C ATOM 1860 CD2 PHE B 88 -5.510 11.789 21.487 1.00 23.25 C ATOM 1861 CE1 PHE B 88 -5.827 14.433 20.663 1.00 27.54 C ATOM 1862 CE2 PHE B 88 -6.615 12.497 21.906 1.00 21.40 C ATOM 1863 CZ PHE B 88 -6.789 13.819 21.494 1.00 27.46 C ATOM 0 H PHE B 88 -3.990 9.222 19.530 1.00 18.70 H new ATOM 0 HA PHE B 88 -4.160 11.504 18.342 1.00 19.90 H new ATOM 0 HB2 PHE B 88 -3.189 10.847 20.855 1.00 19.49 H new ATOM 0 HB3 PHE B 88 -2.546 12.145 20.279 1.00 19.49 H new ATOM 0 HD1 PHE B 88 -4.075 14.096 19.709 1.00 26.77 H new ATOM 0 HD2 PHE B 88 -5.411 10.903 21.750 1.00 23.25 H new ATOM 0 HE1 PHE B 88 -5.936 15.315 20.388 1.00 27.54 H new ATOM 0 HE2 PHE B 88 -7.243 12.095 22.462 1.00 21.40 H new ATOM 0 HZ PHE B 88 -7.539 14.296 21.767 1.00 27.46 H new ATOM 1864 N GLU B 89 -1.342 10.172 17.973 1.00 20.18 N ATOM 1865 CA GLU B 89 -0.116 10.288 17.170 1.00 20.23 C ATOM 1866 C GLU B 89 -0.470 10.509 15.706 1.00 19.41 C ATOM 1867 O GLU B 89 0.172 11.329 15.019 1.00 19.93 O ATOM 1868 CB GLU B 89 0.744 9.031 17.295 1.00 21.34 C ATOM 1869 CG GLU B 89 1.560 8.971 18.567 1.00 26.32 C ATOM 1870 CD GLU B 89 2.488 10.179 18.711 1.00 31.10 C ATOM 1871 OE1 GLU B 89 3.323 10.413 17.809 1.00 33.07 O ATOM 1872 OE2 GLU B 89 2.366 10.895 19.719 1.00 35.99 O ATOM 0 H GLU B 89 -1.467 9.408 18.348 1.00 20.18 H new ATOM 0 HA GLU B 89 0.389 11.046 17.504 1.00 20.23 H new ATOM 0 HB2 GLU B 89 0.169 8.251 17.253 1.00 21.34 H new ATOM 0 HB3 GLU B 89 1.344 8.983 16.534 1.00 21.34 H new ATOM 0 HG2 GLU B 89 0.964 8.929 19.331 1.00 26.32 H new ATOM 0 HG3 GLU B 89 2.087 8.157 18.574 1.00 26.32 H new ATOM 1873 N HIS B 90 -1.472 9.786 15.227 1.00 17.58 N ATOM 1874 CA HIS B 90 -2.021 10.065 13.874 1.00 17.13 C ATOM 1875 C HIS B 90 -2.607 11.473 13.774 1.00 16.31 C ATOM 1876 O HIS B 90 -2.385 12.165 12.780 1.00 17.16 O ATOM 1877 CB HIS B 90 -3.023 9.021 13.414 1.00 15.97 C ATOM 1878 CG HIS B 90 -3.605 9.331 12.067 1.00 16.63 C ATOM 1879 ND1 HIS B 90 -4.907 9.735 11.905 1.00 14.91 N ATOM 1880 CD2 HIS B 90 -3.051 9.342 10.828 1.00 17.40 C ATOM 1881 CE1 HIS B 90 -5.149 9.950 10.624 1.00 18.24 C ATOM 1882 NE2 HIS B 90 -4.030 9.749 9.950 1.00 15.86 N ATOM 0 H HIS B 90 -1.852 9.139 15.647 1.00 17.58 H new ATOM 0 HA HIS B 90 -1.266 10.013 13.267 1.00 17.13 H new ATOM 0 HB2 HIS B 90 -2.590 8.154 13.383 1.00 15.97 H new ATOM 0 HB3 HIS B 90 -3.739 8.957 14.065 1.00 15.97 H new ATOM 0 HD1 HIS B 90 -5.478 9.833 12.540 1.00 14.91 H new ATOM 0 HD2 HIS B 90 -2.175 9.117 10.613 1.00 17.40 H new ATOM 0 HE1 HIS B 90 -5.967 10.200 10.259 1.00 18.24 H new ATOM 0 HE2 HIS B 90 -3.930 9.855 9.102 1.00 15.86 H new ATOM 1883 N GLY B 91 -3.348 11.914 14.797 1.00 16.62 N ATOM 1884 CA GLY B 91 -3.808 13.297 14.889 1.00 16.42 C ATOM 1885 C GLY B 91 -2.721 14.358 14.762 1.00 17.92 C ATOM 1886 O GLY B 91 -2.937 15.406 14.163 1.00 17.83 O ATOM 0 H GLY B 91 -3.596 11.417 15.454 1.00 16.62 H new ATOM 0 HA2 GLY B 91 -4.469 13.449 14.196 1.00 16.42 H new ATOM 0 HA3 GLY B 91 -4.257 13.416 15.740 1.00 16.42 H new ATOM 1887 N LYS B 92 -1.537 14.093 15.298 1.00 18.01 N ATOM 1888 CA LYS B 92 -0.422 15.043 15.132 1.00 19.01 C ATOM 1889 C LYS B 92 -0.023 15.249 13.682 1.00 18.39 C ATOM 1890 O LYS B 92 0.370 16.355 13.290 1.00 20.22 O ATOM 1891 CB LYS B 92 0.805 14.621 15.940 1.00 19.35 C ATOM 1892 CG LYS B 92 0.687 14.891 17.414 1.00 22.60 C ATOM 1893 CD LYS B 92 1.901 14.303 18.140 1.00 26.30 C ATOM 1894 CE LYS B 92 1.676 14.343 19.630 1.00 31.78 C ATOM 1895 NZ LYS B 92 2.890 13.956 20.414 1.00 35.24 N ATOM 0 H LYS B 92 -1.352 13.387 15.753 1.00 18.01 H new ATOM 0 HA LYS B 92 -0.755 15.889 15.470 1.00 19.01 H new ATOM 0 HB2 LYS B 92 0.959 13.673 15.805 1.00 19.35 H new ATOM 0 HB3 LYS B 92 1.583 15.087 15.596 1.00 19.35 H new ATOM 0 HG2 LYS B 92 0.633 15.846 17.574 1.00 22.60 H new ATOM 0 HG3 LYS B 92 -0.130 14.499 17.760 1.00 22.60 H new ATOM 0 HD2 LYS B 92 2.049 13.389 17.852 1.00 26.30 H new ATOM 0 HD3 LYS B 92 2.699 14.805 17.912 1.00 26.30 H new ATOM 0 HE2 LYS B 92 1.402 15.237 19.887 1.00 31.78 H new ATOM 0 HE3 LYS B 92 0.946 13.747 19.858 1.00 31.78 H new ATOM 0 HZ1 LYS B 92 2.797 14.225 21.257 1.00 35.24 H new ATOM 0 HZ2 LYS B 92 2.987 13.072 20.394 1.00 35.24 H new ATOM 0 HZ3 LYS B 92 3.609 14.341 20.058 1.00 35.24 H new ATOM 1896 N TYR B 93 -0.116 14.180 12.905 1.00 18.86 N ATOM 1897 CA TYR B 93 0.168 14.212 11.477 1.00 18.51 C ATOM 1898 C TYR B 93 -0.821 15.075 10.654 1.00 18.32 C ATOM 1899 O TYR B 93 -0.397 15.893 9.834 1.00 18.72 O ATOM 1900 CB TYR B 93 0.238 12.781 10.943 1.00 19.37 C ATOM 1901 CG TYR B 93 0.376 12.705 9.453 1.00 20.26 C ATOM 1902 CD1 TYR B 93 1.408 13.405 8.774 1.00 22.23 C ATOM 1903 CD2 TYR B 93 -0.491 11.924 8.707 1.00 18.58 C ATOM 1904 CE1 TYR B 93 1.512 13.346 7.352 1.00 21.06 C ATOM 1905 CE2 TYR B 93 -0.378 11.845 7.307 1.00 20.53 C ATOM 1906 CZ TYR B 93 0.616 12.555 6.644 1.00 21.95 C ATOM 1907 OH TYR B 93 0.695 12.430 5.271 1.00 23.26 O ATOM 0 H TYR B 93 -0.349 13.405 13.195 1.00 18.86 H new ATOM 0 HA TYR B 93 1.027 14.649 11.368 1.00 18.51 H new ATOM 0 HB2 TYR B 93 0.990 12.327 11.354 1.00 19.37 H new ATOM 0 HB3 TYR B 93 -0.563 12.304 11.211 1.00 19.37 H new ATOM 0 HD1 TYR B 93 2.022 13.907 9.260 1.00 22.23 H new ATOM 0 HD2 TYR B 93 -1.160 11.443 9.139 1.00 18.58 H new ATOM 0 HE1 TYR B 93 2.169 13.830 6.906 1.00 21.06 H new ATOM 0 HE2 TYR B 93 -0.970 11.316 6.823 1.00 20.53 H new ATOM 0 HH TYR B 93 1.053 11.695 5.076 1.00 23.26 H new ATOM 1908 N PHE B 94 -2.129 14.908 10.854 1.00 16.11 N ATOM 1909 CA PHE B 94 -3.097 15.601 9.972 1.00 14.38 C ATOM 1910 C PHE B 94 -3.971 16.673 10.644 1.00 13.52 C ATOM 1911 O PHE B 94 -4.795 17.279 9.968 1.00 12.00 O ATOM 1912 CB PHE B 94 -3.998 14.586 9.236 1.00 12.62 C ATOM 1913 CG PHE B 94 -5.222 14.181 10.038 1.00 14.84 C ATOM 1914 CD1 PHE B 94 -6.480 14.666 9.687 1.00 12.02 C ATOM 1915 CD2 PHE B 94 -5.099 13.378 11.177 1.00 11.50 C ATOM 1916 CE1 PHE B 94 -7.618 14.353 10.470 1.00 12.76 C ATOM 1917 CE2 PHE B 94 -6.229 13.049 11.951 1.00 13.26 C ATOM 1918 CZ PHE B 94 -7.482 13.524 11.591 1.00 13.26 C ATOM 0 H PHE B 94 -2.476 14.418 11.470 1.00 16.11 H new ATOM 0 HA PHE B 94 -2.535 16.083 9.346 1.00 14.38 H new ATOM 0 HB2 PHE B 94 -4.284 14.969 8.392 1.00 12.62 H new ATOM 0 HB3 PHE B 94 -3.479 13.794 9.027 1.00 12.62 H new ATOM 0 HD1 PHE B 94 -6.573 15.200 8.932 1.00 12.02 H new ATOM 0 HD2 PHE B 94 -4.262 13.058 11.426 1.00 11.50 H new ATOM 0 HE1 PHE B 94 -8.451 14.696 10.241 1.00 12.76 H new ATOM 0 HE2 PHE B 94 -6.135 12.512 12.705 1.00 13.26 H new ATOM 0 HZ PHE B 94 -8.230 13.293 12.093 1.00 13.26 H new ATOM 1919 N ILE B 95 -3.828 16.900 11.954 1.00 12.27 N ATOM 1920 CA ILE B 95 -4.553 17.999 12.591 1.00 12.42 C ATOM 1921 C ILE B 95 -3.576 19.081 13.067 1.00 11.92 C ATOM 1922 O ILE B 95 -2.845 18.903 14.080 1.00 12.39 O ATOM 1923 CB ILE B 95 -5.404 17.547 13.843 1.00 13.36 C ATOM 1924 CG1 ILE B 95 -6.240 16.281 13.533 1.00 12.39 C ATOM 1925 CG2 ILE B 95 -6.247 18.732 14.345 1.00 14.13 C ATOM 1926 CD1 ILE B 95 -6.995 15.672 14.761 1.00 14.00 C ATOM 0 H ILE B 95 -3.327 16.439 12.480 1.00 12.27 H new ATOM 0 HA ILE B 95 -5.158 18.337 11.912 1.00 12.42 H new ATOM 0 HB ILE B 95 -4.809 17.288 14.564 1.00 13.36 H new ATOM 0 HG12 ILE B 95 -6.889 16.499 12.846 1.00 12.39 H new ATOM 0 HG13 ILE B 95 -5.652 15.604 13.163 1.00 12.39 H new ATOM 0 HG21 ILE B 95 -6.770 18.455 15.114 1.00 14.13 H new ATOM 0 HG22 ILE B 95 -5.661 19.462 14.599 1.00 14.13 H new ATOM 0 HG23 ILE B 95 -6.843 19.028 13.639 1.00 14.13 H new ATOM 0 HD11 ILE B 95 -7.491 14.887 14.480 1.00 14.00 H new ATOM 0 HD12 ILE B 95 -6.353 15.421 15.444 1.00 14.00 H new ATOM 0 HD13 ILE B 95 -7.610 16.330 15.122 1.00 14.00 H new ATOM 1927 N GLY B 96 -3.616 20.217 12.397 1.00 11.46 N ATOM 1928 CA GLY B 96 -2.749 21.349 12.736 1.00 11.58 C ATOM 1929 C GLY B 96 -3.178 22.028 14.025 1.00 12.92 C ATOM 1930 O GLY B 96 -2.336 22.304 14.889 1.00 13.37 O ATOM 0 H GLY B 96 -4.143 20.362 11.733 1.00 11.46 H new ATOM 0 HA2 GLY B 96 -1.834 21.040 12.823 1.00 11.58 H new ATOM 0 HA3 GLY B 96 -2.762 21.994 12.012 1.00 11.58 H new ATOM 1931 N GLN B 97 -4.472 22.343 14.140 1.00 11.64 N ATOM 1932 CA GLN B 97 -5.029 22.986 15.337 1.00 11.64 C ATOM 1933 C GLN B 97 -6.368 22.342 15.682 1.00 11.50 C ATOM 1934 O GLN B 97 -7.109 21.915 14.774 1.00 9.54 O ATOM 1935 CB GLN B 97 -5.229 24.497 15.132 1.00 11.75 C ATOM 1936 CG GLN B 97 -4.039 25.102 14.376 1.00 14.04 C ATOM 1937 CD GLN B 97 -4.311 26.493 13.952 1.00 15.04 C ATOM 1938 OE1 GLN B 97 -4.478 26.779 12.769 1.00 20.23 O ATOM 1939 NE2 GLN B 97 -4.345 27.374 14.894 1.00 11.99 N ATOM 0 H GLN B 97 -5.053 22.190 13.525 1.00 11.64 H new ATOM 0 HA GLN B 97 -4.397 22.863 16.063 1.00 11.64 H new ATOM 0 HB2 GLN B 97 -6.048 24.656 14.637 1.00 11.75 H new ATOM 0 HB3 GLN B 97 -5.329 24.935 15.992 1.00 11.75 H new ATOM 0 HG2 GLN B 97 -3.252 25.084 14.943 1.00 14.04 H new ATOM 0 HG3 GLN B 97 -3.840 24.559 13.597 1.00 14.04 H new ATOM 0 HE21 GLN B 97 -4.223 27.135 15.711 1.00 11.99 H new ATOM 0 HE22 GLN B 97 -4.489 28.200 14.705 1.00 11.99 H new ATOM 1940 N LEU B 98 -6.695 22.367 16.975 1.00 11.98 N ATOM 1941 CA LEU B 98 -7.861 21.644 17.523 1.00 12.35 C ATOM 1942 C LEU B 98 -8.612 22.473 18.565 1.00 11.56 C ATOM 1943 O LEU B 98 -8.003 22.964 19.546 1.00 12.39 O ATOM 1944 CB LEU B 98 -7.390 20.348 18.179 1.00 12.18 C ATOM 1945 CG LEU B 98 -8.493 19.362 18.641 1.00 13.68 C ATOM 1946 CD1 LEU B 98 -9.261 18.781 17.430 1.00 11.17 C ATOM 1947 CD2 LEU B 98 -7.839 18.208 19.357 1.00 14.33 C ATOM 0 H LEU B 98 -6.249 22.804 17.566 1.00 11.98 H new ATOM 0 HA LEU B 98 -8.465 21.462 16.786 1.00 12.35 H new ATOM 0 HB2 LEU B 98 -6.812 19.884 17.553 1.00 12.18 H new ATOM 0 HB3 LEU B 98 -6.847 20.578 18.949 1.00 12.18 H new ATOM 0 HG LEU B 98 -9.109 19.842 19.216 1.00 13.68 H new ATOM 0 HD11 LEU B 98 -9.944 18.168 17.744 1.00 11.17 H new ATOM 0 HD12 LEU B 98 -9.678 19.503 16.934 1.00 11.17 H new ATOM 0 HD13 LEU B 98 -8.643 18.307 16.852 1.00 11.17 H new ATOM 0 HD21 LEU B 98 -8.519 17.583 19.652 1.00 14.33 H new ATOM 0 HD22 LEU B 98 -7.226 17.758 18.754 1.00 14.33 H new ATOM 0 HD23 LEU B 98 -7.350 18.540 20.126 1.00 14.33 H new ATOM 1948 N LYS B 99 -9.921 22.648 18.357 1.00 10.90 N ATOM 1949 CA LYS B 99 -10.795 23.246 19.362 1.00 10.81 C ATOM 1950 C LYS B 99 -11.802 22.224 19.890 1.00 11.37 C ATOM 1951 O LYS B 99 -12.741 21.882 19.158 1.00 11.49 O ATOM 1952 CB LYS B 99 -11.627 24.379 18.747 1.00 9.92 C ATOM 1953 CG LYS B 99 -12.734 24.919 19.737 1.00 10.89 C ATOM 1954 CD LYS B 99 -12.180 25.492 21.061 1.00 12.11 C ATOM 1955 CE LYS B 99 -13.348 25.946 21.961 1.00 11.98 C ATOM 1956 NZ LYS B 99 -12.765 26.535 23.268 1.00 14.96 N ATOM 0 H LYS B 99 -10.323 22.423 17.631 1.00 10.90 H new ATOM 0 HA LYS B 99 -10.220 23.570 20.072 1.00 10.81 H new ATOM 0 HB2 LYS B 99 -11.039 25.108 18.494 1.00 9.92 H new ATOM 0 HB3 LYS B 99 -12.051 24.061 17.934 1.00 9.92 H new ATOM 0 HG2 LYS B 99 -13.246 25.609 19.287 1.00 10.89 H new ATOM 0 HG3 LYS B 99 -13.349 24.198 19.942 1.00 10.89 H new ATOM 0 HD2 LYS B 99 -11.651 24.820 21.518 1.00 12.11 H new ATOM 0 HD3 LYS B 99 -11.591 26.241 20.878 1.00 12.11 H new ATOM 0 HE2 LYS B 99 -13.887 26.610 21.504 1.00 11.98 H new ATOM 0 HE3 LYS B 99 -13.931 25.196 22.160 1.00 11.98 H new ATOM 0 HZ1 LYS B 99 -13.418 26.639 23.864 1.00 14.96 H new ATOM 0 HZ2 LYS B 99 -12.151 25.981 23.596 1.00 14.96 H new ATOM 0 HZ3 LYS B 99 -12.391 27.324 23.097 1.00 14.96 H new ATOM 1957 N PRO B 100 -11.674 21.788 21.175 1.00 12.48 N ATOM 1958 CA PRO B 100 -12.697 20.885 21.759 1.00 11.84 C ATOM 1959 C PRO B 100 -13.832 21.622 22.473 1.00 12.70 C ATOM 1960 O PRO B 100 -13.567 22.570 23.231 1.00 12.95 O ATOM 1961 CB PRO B 100 -11.913 20.127 22.845 1.00 12.79 C ATOM 1962 CG PRO B 100 -10.415 20.382 22.464 1.00 12.96 C ATOM 1963 CD PRO B 100 -10.436 21.788 21.985 1.00 11.13 C ATOM 0 HA PRO B 100 -13.106 20.350 21.061 1.00 11.84 H new ATOM 0 HB2 PRO B 100 -12.117 20.462 23.732 1.00 12.79 H new ATOM 0 HB3 PRO B 100 -12.125 19.181 22.843 1.00 12.79 H new ATOM 0 HG2 PRO B 100 -9.825 20.269 23.226 1.00 12.96 H new ATOM 0 HG3 PRO B 100 -10.109 19.771 21.775 1.00 12.96 H new ATOM 0 HD2 PRO B 100 -10.475 22.425 22.716 1.00 11.13 H new ATOM 0 HD3 PRO B 100 -9.652 22.009 21.458 1.00 11.13 H new ATOM 1964 N PHE B 101 -15.067 21.177 22.239 1.00 11.59 N ATOM 1965 CA PHE B 101 -16.221 21.606 23.049 1.00 11.04 C ATOM 1966 C PHE B 101 -16.810 20.416 23.791 1.00 11.49 C ATOM 1967 O PHE B 101 -17.305 19.462 23.184 1.00 11.27 O ATOM 1968 CB PHE B 101 -17.344 22.167 22.183 1.00 11.11 C ATOM 1969 CG PHE B 101 -16.956 23.328 21.295 1.00 11.41 C ATOM 1970 CD1 PHE B 101 -16.843 24.608 21.820 1.00 13.10 C ATOM 1971 CD2 PHE B 101 -16.785 23.137 19.919 1.00 10.83 C ATOM 1972 CE1 PHE B 101 -16.568 25.702 21.000 1.00 11.17 C ATOM 1973 CE2 PHE B 101 -16.519 24.216 19.069 1.00 10.44 C ATOM 1974 CZ PHE B 101 -16.395 25.510 19.613 1.00 10.65 C ATOM 0 H PHE B 101 -15.263 20.622 21.612 1.00 11.59 H new ATOM 0 HA PHE B 101 -15.892 22.287 23.657 1.00 11.04 H new ATOM 0 HB2 PHE B 101 -17.689 21.453 21.625 1.00 11.11 H new ATOM 0 HB3 PHE B 101 -18.069 22.450 22.762 1.00 11.11 H new ATOM 0 HD1 PHE B 101 -16.953 24.738 22.734 1.00 13.10 H new ATOM 0 HD2 PHE B 101 -16.849 22.280 19.564 1.00 10.83 H new ATOM 0 HE1 PHE B 101 -16.499 26.554 21.366 1.00 11.17 H new ATOM 0 HE2 PHE B 101 -16.425 24.081 18.154 1.00 10.44 H new ATOM 0 HZ PHE B 101 -16.200 26.233 19.061 1.00 10.65 H new ATOM 1975 N VAL B 102 -16.785 20.454 25.115 1.00 12.38 N ATOM 1976 CA VAL B 102 -17.535 19.443 25.851 1.00 11.76 C ATOM 1977 C VAL B 102 -18.980 19.957 25.882 1.00 11.33 C ATOM 1978 O VAL B 102 -19.235 21.068 26.399 1.00 12.34 O ATOM 1979 CB VAL B 102 -16.997 19.309 27.300 1.00 12.01 C ATOM 1980 CG1 VAL B 102 -17.839 18.312 28.073 1.00 14.12 C ATOM 1981 CG2 VAL B 102 -15.439 18.989 27.321 1.00 12.07 C ATOM 0 H VAL B 102 -16.360 21.030 25.592 1.00 12.38 H new ATOM 0 HA VAL B 102 -17.460 18.570 25.435 1.00 11.76 H new ATOM 0 HB VAL B 102 -17.083 20.162 27.754 1.00 12.01 H new ATOM 0 HG11 VAL B 102 -17.498 18.233 28.978 1.00 14.12 H new ATOM 0 HG12 VAL B 102 -18.759 18.618 28.101 1.00 14.12 H new ATOM 0 HG13 VAL B 102 -17.799 17.447 27.636 1.00 14.12 H new ATOM 0 HG21 VAL B 102 -15.137 18.912 28.239 1.00 12.07 H new ATOM 0 HG22 VAL B 102 -15.274 18.154 26.856 1.00 12.07 H new ATOM 0 HG23 VAL B 102 -14.955 19.705 26.881 1.00 12.07 H new ATOM 1982 N THR B 103 -19.936 19.180 25.361 1.00 10.82 N ATOM 1983 CA THR B 103 -21.301 19.683 25.226 1.00 10.86 C ATOM 1984 C THR B 103 -22.194 19.177 26.357 1.00 12.24 C ATOM 1985 O THR B 103 -21.820 18.234 27.080 1.00 12.45 O ATOM 1986 CB THR B 103 -21.937 19.339 23.830 1.00 11.22 C ATOM 1987 OG1 THR B 103 -22.093 17.927 23.685 1.00 10.69 O ATOM 1988 CG2 THR B 103 -21.022 19.846 22.674 1.00 11.44 C ATOM 0 H THR B 103 -19.815 18.374 25.085 1.00 10.82 H new ATOM 0 HA THR B 103 -21.242 20.649 25.285 1.00 10.86 H new ATOM 0 HB THR B 103 -22.802 19.775 23.786 1.00 11.22 H new ATOM 0 HG1 THR B 103 -21.367 17.545 23.864 1.00 10.69 H new ATOM 0 HG21 THR B 103 -21.427 19.627 21.820 1.00 11.44 H new ATOM 0 HG22 THR B 103 -20.916 20.808 22.743 1.00 11.44 H new ATOM 0 HG23 THR B 103 -20.153 19.420 22.738 1.00 11.44 H new ATOM 1989 N GLU B 104 -23.375 19.777 26.509 1.00 11.91 N ATOM 1990 CA GLU B 104 -24.329 19.355 27.516 1.00 13.01 C ATOM 1991 C GLU B 104 -25.664 19.282 26.832 1.00 13.77 C ATOM 1992 O GLU B 104 -26.095 20.271 26.206 1.00 12.48 O ATOM 1993 CB GLU B 104 -24.470 20.365 28.673 1.00 13.28 C ATOM 1994 CG GLU B 104 -25.640 19.992 29.640 1.00 17.82 C ATOM 1995 CD GLU B 104 -25.966 21.087 30.659 1.00 27.61 C ATOM 1996 OE1 GLU B 104 -25.177 22.052 30.794 1.00 28.40 O ATOM 1997 OE2 GLU B 104 -27.028 20.976 31.324 1.00 32.17 O ATOM 0 H GLU B 104 -23.640 20.439 26.028 1.00 11.91 H new ATOM 0 HA GLU B 104 -24.027 18.513 27.891 1.00 13.01 H new ATOM 0 HB2 GLU B 104 -23.639 20.402 29.172 1.00 13.28 H new ATOM 0 HB3 GLU B 104 -24.622 21.252 28.310 1.00 13.28 H new ATOM 0 HG2 GLU B 104 -26.434 19.801 29.116 1.00 17.82 H new ATOM 0 HG3 GLU B 104 -25.410 19.177 30.114 1.00 17.82 H new ATOM 1998 N GLU B 105 -26.324 18.128 26.941 1.00 14.21 N ATOM 1999 CA AGLU B 105 -27.627 17.949 26.292 0.50 15.66 C ATOM 2000 CA BGLU B 105 -27.618 17.953 26.311 0.50 14.97 C ATOM 2001 C GLU B 105 -28.678 18.627 27.160 1.00 16.53 C ATOM 2002 O GLU B 105 -28.507 18.739 28.368 1.00 16.72 O ATOM 2003 CB AGLU B 105 -27.952 16.461 26.057 0.50 15.59 C ATOM 2004 CB BGLU B 105 -27.889 16.469 26.103 0.50 14.63 C ATOM 2005 CG AGLU B 105 -29.053 16.173 24.976 0.50 16.30 C ATOM 2006 CG BGLU B 105 -27.092 15.932 24.912 0.50 11.58 C ATOM 2007 CD AGLU B 105 -28.592 16.339 23.497 0.50 17.22 C ATOM 2008 CD BGLU B 105 -25.653 15.588 25.257 0.50 12.75 C ATOM 2009 OE1AGLU B 105 -29.437 16.182 22.550 0.50 13.19 O ATOM 2010 OE1BGLU B 105 -25.462 14.729 26.165 0.50 9.38 O ATOM 2011 OE2AGLU B 105 -27.401 16.656 23.291 0.50 18.74 O ATOM 2012 OE2BGLU B 105 -24.732 16.171 24.620 0.50 7.25 O ATOM 0 H AGLU B 105 -26.041 17.445 27.379 0.50 14.21 H new ATOM 0 H BGLU B 105 -26.037 17.442 27.374 0.50 14.21 H new ATOM 0 HA AGLU B 105 -27.614 18.356 25.412 0.50 14.97 H new ATOM 0 HA BGLU B 105 -27.634 18.371 25.436 0.50 14.97 H new ATOM 0 HB2AGLU B 105 -27.137 16.005 25.795 0.50 14.63 H new ATOM 0 HB2BGLU B 105 -27.651 15.977 26.905 0.50 14.63 H new ATOM 0 HB3AGLU B 105 -28.237 16.071 26.898 0.50 14.63 H new ATOM 0 HB3BGLU B 105 -28.837 16.327 25.954 0.50 14.63 H new ATOM 0 HG2AGLU B 105 -29.377 15.267 25.099 0.50 11.58 H new ATOM 0 HG2BGLU B 105 -27.533 15.140 24.566 0.50 11.58 H new ATOM 0 HG3AGLU B 105 -29.804 16.766 25.134 0.50 11.58 H new ATOM 0 HG3BGLU B 105 -27.099 16.593 24.202 0.50 11.58 H new ATOM 2013 N LEU B 106 -29.733 19.121 26.522 1.00 18.58 N ATOM 2014 CA LEU B 106 -30.758 19.919 27.192 1.00 21.22 C ATOM 2015 C LEU B 106 -32.125 19.246 27.229 1.00 22.57 C ATOM 2016 O LEU B 106 -33.052 19.775 27.833 1.00 23.76 O ATOM 2017 CB LEU B 106 -30.889 21.286 26.492 1.00 21.51 C ATOM 2018 CG LEU B 106 -29.564 22.047 26.332 1.00 23.05 C ATOM 2019 CD1 LEU B 106 -29.716 23.340 25.526 1.00 22.62 C ATOM 2020 CD2 LEU B 106 -29.024 22.364 27.736 1.00 24.20 C ATOM 0 H LEU B 106 -29.877 19.003 25.682 1.00 18.58 H new ATOM 0 HA LEU B 106 -30.467 20.023 28.112 1.00 21.22 H new ATOM 0 HB2 LEU B 106 -31.280 21.152 25.615 1.00 21.51 H new ATOM 0 HB3 LEU B 106 -31.507 21.838 26.997 1.00 21.51 H new ATOM 0 HG LEU B 106 -28.947 21.486 25.836 1.00 23.05 H new ATOM 0 HD11 LEU B 106 -28.855 23.780 25.455 1.00 22.62 H new ATOM 0 HD12 LEU B 106 -30.047 23.131 24.638 1.00 22.62 H new ATOM 0 HD13 LEU B 106 -30.343 23.929 25.974 1.00 22.62 H new ATOM 0 HD21 LEU B 106 -28.186 22.846 27.659 1.00 24.20 H new ATOM 0 HD22 LEU B 106 -29.667 22.910 28.215 1.00 24.20 H new ATOM 0 HD23 LEU B 106 -28.878 21.537 28.221 1.00 24.20 H new ATOM 2021 N VAL B 107 -32.261 18.106 26.565 1.00 23.95 N ATOM 2022 CA VAL B 107 -33.556 17.405 26.460 1.00 25.15 C ATOM 2023 C VAL B 107 -33.289 15.886 26.404 1.00 26.03 C ATOM 2024 O VAL B 107 -32.128 15.457 26.287 1.00 24.97 O ATOM 2025 CB VAL B 107 -34.380 17.862 25.207 1.00 25.72 C ATOM 2026 CG1 VAL B 107 -34.777 19.334 25.311 1.00 26.33 C ATOM 2027 CG2 VAL B 107 -33.571 17.609 23.903 1.00 23.77 C ATOM 2028 OXT VAL B 107 -34.210 15.044 26.492 1.00 26.45 O ATOM 0 H VAL B 107 -31.613 17.710 26.161 1.00 23.95 H new ATOM 0 HA VAL B 107 -34.090 17.627 27.239 1.00 25.15 H new ATOM 0 HB VAL B 107 -35.194 17.335 25.177 1.00 25.72 H new ATOM 0 HG11 VAL B 107 -35.284 19.589 24.525 1.00 26.33 H new ATOM 0 HG12 VAL B 107 -35.321 19.468 26.103 1.00 26.33 H new ATOM 0 HG13 VAL B 107 -33.978 19.881 25.371 1.00 26.33 H new ATOM 0 HG21 VAL B 107 -34.093 17.896 23.137 1.00 23.77 H new ATOM 0 HG22 VAL B 107 -32.741 18.110 23.934 1.00 23.77 H new ATOM 0 HG23 VAL B 107 -33.374 16.663 23.823 1.00 23.77 H new TER 2029 VAL B 107 ATOM 2030 N GLY C -1 -26.209 8.710 -0.971 1.00 39.47 N ATOM 2031 CA GLY C -1 -27.583 9.288 -0.826 1.00 38.31 C ATOM 2032 C GLY C -1 -27.756 9.701 0.621 1.00 38.01 C ATOM 2033 O GLY C -1 -28.603 9.155 1.343 1.00 38.37 O ATOM 0 H1 GLY C -1 -26.080 8.458 -1.815 1.00 39.47 H new ATOM 0 H2 GLY C -1 -25.604 9.324 -0.749 1.00 39.47 H new ATOM 0 H3 GLY C -1 -26.125 8.004 -0.435 1.00 39.47 H new ATOM 0 HA2 GLY C -1 -27.695 10.051 -1.414 1.00 38.31 H new ATOM 0 HA3 GLY C -1 -28.255 8.635 -1.077 1.00 38.31 H new ATOM 2034 N ARG C 0 -26.915 10.635 1.062 1.00 36.63 N ATOM 2035 CA ARG C 0 -26.836 10.936 2.491 1.00 34.85 C ATOM 2036 C ARG C 0 -27.571 12.199 2.871 1.00 32.06 C ATOM 2037 O ARG C 0 -27.914 13.038 2.033 1.00 32.24 O ATOM 2038 CB ARG C 0 -25.380 10.976 2.981 1.00 36.02 C ATOM 2039 CG ARG C 0 -24.676 9.658 2.817 1.00 38.26 C ATOM 2040 CD ARG C 0 -25.181 8.657 3.826 1.00 41.43 C ATOM 2041 NE ARG C 0 -24.240 8.611 4.928 1.00 45.15 N ATOM 2042 CZ ARG C 0 -23.063 7.992 4.857 1.00 46.79 C ATOM 2043 NH1 ARG C 0 -22.710 7.356 3.740 1.00 47.43 N ATOM 2044 NH2 ARG C 0 -22.251 8.003 5.899 1.00 46.71 N ATOM 0 H ARG C 0 -26.391 11.098 0.562 1.00 36.63 H new ATOM 0 HA ARG C 0 -27.288 10.206 2.943 1.00 34.85 H new ATOM 0 HB2 ARG C 0 -24.897 11.660 2.491 1.00 36.02 H new ATOM 0 HB3 ARG C 0 -25.364 11.233 3.916 1.00 36.02 H new ATOM 0 HG2 ARG C 0 -24.818 9.319 1.919 1.00 38.26 H new ATOM 0 HG3 ARG C 0 -23.720 9.781 2.926 1.00 38.26 H new ATOM 0 HD2 ARG C 0 -26.062 8.911 4.143 1.00 41.43 H new ATOM 0 HD3 ARG C 0 -25.268 7.781 3.419 1.00 41.43 H new ATOM 0 HE ARG C 0 -24.452 9.003 5.664 1.00 45.15 H new ATOM 0 HH11 ARG C 0 -23.242 7.345 3.065 1.00 47.43 H new ATOM 0 HH12 ARG C 0 -21.950 6.956 3.695 1.00 47.43 H new ATOM 0 HH21 ARG C 0 -22.483 8.409 6.621 1.00 46.71 H new ATOM 0 HH22 ARG C 0 -21.490 7.604 5.856 1.00 46.71 H new ATOM 2045 N MET C 1 -27.800 12.313 4.166 1.00 29.21 N ATOM 2046 CA MET C 1 -28.490 13.413 4.736 1.00 24.93 C ATOM 2047 C MET C 1 -27.652 14.698 4.599 1.00 22.06 C ATOM 2048 O MET C 1 -26.440 14.702 4.904 1.00 22.08 O ATOM 2049 CB MET C 1 -28.654 13.061 6.197 1.00 26.05 C ATOM 2050 CG MET C 1 -29.793 13.706 6.865 1.00 28.10 C ATOM 2051 SD MET C 1 -31.237 12.674 7.122 1.00 27.68 S ATOM 2052 CE MET C 1 -30.529 11.396 8.152 1.00 30.01 C ATOM 0 H MET C 1 -27.545 11.728 4.743 1.00 29.21 H new ATOM 0 HA MET C 1 -29.340 13.574 4.298 1.00 24.93 H new ATOM 0 HB2 MET C 1 -28.752 12.099 6.275 1.00 26.05 H new ATOM 0 HB3 MET C 1 -27.841 13.302 6.668 1.00 26.05 H new ATOM 0 HG2 MET C 1 -29.495 14.036 7.727 1.00 28.10 H new ATOM 0 HG3 MET C 1 -30.058 14.478 6.341 1.00 28.10 H new ATOM 0 HE1 MET C 1 -31.214 11.033 8.735 1.00 30.01 H new ATOM 0 HE2 MET C 1 -30.174 10.688 7.592 1.00 30.01 H new ATOM 0 HE3 MET C 1 -29.814 11.772 8.689 1.00 30.01 H new ATOM 2053 N ILE C 2 -28.281 15.788 4.175 1.00 16.62 N ATOM 2054 CA ILE C 2 -27.652 17.102 4.275 1.00 14.57 C ATOM 2055 C ILE C 2 -27.606 17.500 5.757 1.00 13.15 C ATOM 2056 O ILE C 2 -28.628 17.366 6.461 1.00 12.35 O ATOM 2057 CB ILE C 2 -28.447 18.145 3.471 1.00 14.42 C ATOM 2058 CG1 ILE C 2 -28.498 17.682 2.016 1.00 14.56 C ATOM 2059 CG2 ILE C 2 -27.803 19.546 3.586 1.00 12.48 C ATOM 2060 CD1 ILE C 2 -29.591 18.272 1.186 1.00 17.64 C ATOM 0 H ILE C 2 -29.068 15.790 3.828 1.00 16.62 H new ATOM 0 HA ILE C 2 -26.754 17.065 3.909 1.00 14.57 H new ATOM 0 HB ILE C 2 -29.347 18.220 3.826 1.00 14.42 H new ATOM 0 HG12 ILE C 2 -27.648 17.891 1.598 1.00 14.56 H new ATOM 0 HG13 ILE C 2 -28.591 16.717 2.004 1.00 14.56 H new ATOM 0 HG21 ILE C 2 -28.322 20.184 3.072 1.00 12.48 H new ATOM 0 HG22 ILE C 2 -27.786 19.819 4.517 1.00 12.48 H new ATOM 0 HG23 ILE C 2 -26.897 19.515 3.242 1.00 12.48 H new ATOM 0 HD11 ILE C 2 -29.540 17.918 0.284 1.00 17.64 H new ATOM 0 HD12 ILE C 2 -30.451 18.045 1.574 1.00 17.64 H new ATOM 0 HD13 ILE C 2 -29.493 19.237 1.161 1.00 17.64 H new ATOM 2061 N ARG C 3 -26.453 17.946 6.241 1.00 11.66 N ATOM 2062 CA ARG C 3 -26.326 18.344 7.664 1.00 10.73 C ATOM 2063 C ARG C 3 -25.638 19.705 7.730 1.00 10.83 C ATOM 2064 O ARG C 3 -24.677 19.936 7.016 1.00 11.25 O ATOM 2065 CB ARG C 3 -25.539 17.313 8.476 1.00 10.12 C ATOM 2066 CG ARG C 3 -26.293 15.993 8.676 1.00 10.42 C ATOM 2067 CD ARG C 3 -25.343 14.899 9.081 1.00 13.54 C ATOM 2068 NE ARG C 3 -24.939 15.064 10.490 1.00 12.23 N ATOM 2069 CZ ARG C 3 -24.136 14.257 11.177 1.00 13.57 C ATOM 2070 NH1 ARG C 3 -23.564 13.199 10.584 1.00 10.95 N ATOM 2071 NH2 ARG C 3 -23.878 14.544 12.474 1.00 10.63 N ATOM 0 H ARG C 3 -25.733 18.030 5.778 1.00 11.66 H new ATOM 0 HA ARG C 3 -27.213 18.395 8.053 1.00 10.73 H new ATOM 0 HB2 ARG C 3 -24.697 17.133 8.029 1.00 10.12 H new ATOM 0 HB3 ARG C 3 -25.324 17.690 9.344 1.00 10.12 H new ATOM 0 HG2 ARG C 3 -26.976 16.104 9.356 1.00 10.42 H new ATOM 0 HG3 ARG C 3 -26.748 15.746 7.855 1.00 10.42 H new ATOM 0 HD2 ARG C 3 -25.765 14.034 8.959 1.00 13.54 H new ATOM 0 HD3 ARG C 3 -24.559 14.915 8.510 1.00 13.54 H new ATOM 0 HE ARG C 3 -25.253 15.748 10.907 1.00 12.23 H new ATOM 0 HH11 ARG C 3 -23.715 13.038 9.753 1.00 10.95 H new ATOM 0 HH12 ARG C 3 -23.046 12.682 11.035 1.00 10.95 H new ATOM 0 HH21 ARG C 3 -24.231 15.238 12.839 1.00 10.63 H new ATOM 0 HH22 ARG C 3 -23.361 14.033 12.933 1.00 10.63 H new ATOM 2072 N ILE C 4 -26.153 20.601 8.563 1.00 9.84 N ATOM 2073 CA ILE C 4 -25.513 21.897 8.759 1.00 9.60 C ATOM 2074 C ILE C 4 -25.352 22.024 10.267 1.00 10.20 C ATOM 2075 O ILE C 4 -26.346 21.900 10.993 1.00 8.89 O ATOM 2076 CB ILE C 4 -26.443 23.027 8.274 1.00 9.55 C ATOM 2077 CG1 ILE C 4 -26.861 22.758 6.789 1.00 10.41 C ATOM 2078 CG2 ILE C 4 -25.743 24.362 8.390 1.00 11.21 C ATOM 2079 CD1 ILE C 4 -27.748 23.830 6.182 1.00 11.10 C ATOM 0 H ILE C 4 -26.869 20.480 9.023 1.00 9.84 H new ATOM 0 HA ILE C 4 -24.675 21.962 8.274 1.00 9.60 H new ATOM 0 HB ILE C 4 -27.239 23.049 8.828 1.00 9.55 H new ATOM 0 HG12 ILE C 4 -26.059 22.673 6.249 1.00 10.41 H new ATOM 0 HG13 ILE C 4 -27.324 21.907 6.744 1.00 10.41 H new ATOM 0 HG21 ILE C 4 -26.335 25.066 8.083 1.00 11.21 H new ATOM 0 HG22 ILE C 4 -25.504 24.523 9.316 1.00 11.21 H new ATOM 0 HG23 ILE C 4 -24.940 24.355 7.846 1.00 11.21 H new ATOM 0 HD11 ILE C 4 -27.962 23.593 5.266 1.00 11.10 H new ATOM 0 HD12 ILE C 4 -28.567 23.903 6.697 1.00 11.10 H new ATOM 0 HD13 ILE C 4 -27.282 24.681 6.194 1.00 11.10 H new ATOM 2080 N LEU C 5 -24.119 22.271 10.712 1.00 10.10 N ATOM 2081 CA LEU C 5 -23.797 22.440 12.138 1.00 10.53 C ATOM 2082 C LEU C 5 -23.584 23.933 12.419 1.00 10.79 C ATOM 2083 O LEU C 5 -22.988 24.634 11.589 1.00 11.58 O ATOM 2084 CB LEU C 5 -22.494 21.720 12.475 1.00 10.97 C ATOM 2085 CG LEU C 5 -22.271 21.692 14.011 1.00 12.22 C ATOM 2086 CD1 LEU C 5 -22.270 20.316 14.580 1.00 16.39 C ATOM 2087 CD2 LEU C 5 -20.954 22.337 14.283 1.00 18.58 C ATOM 0 H LEU C 5 -23.438 22.346 10.193 1.00 10.10 H new ATOM 0 HA LEU C 5 -24.523 22.077 12.668 1.00 10.53 H new ATOM 0 HB2 LEU C 5 -22.520 20.814 12.130 1.00 10.97 H new ATOM 0 HB3 LEU C 5 -21.750 22.167 12.043 1.00 10.97 H new ATOM 0 HG LEU C 5 -23.006 22.163 14.433 1.00 12.22 H new ATOM 0 HD11 LEU C 5 -22.127 20.362 15.538 1.00 16.39 H new ATOM 0 HD12 LEU C 5 -23.123 19.891 14.401 1.00 16.39 H new ATOM 0 HD13 LEU C 5 -21.559 19.797 14.172 1.00 16.39 H new ATOM 0 HD21 LEU C 5 -20.784 22.336 15.238 1.00 18.58 H new ATOM 0 HD22 LEU C 5 -20.252 21.844 13.829 1.00 18.58 H new ATOM 0 HD23 LEU C 5 -20.968 23.251 13.959 1.00 18.58 H new ATOM 2088 N TYR C 6 -24.029 24.420 13.582 1.00 9.82 N ATOM 2089 CA TYR C 6 -23.938 25.851 13.846 1.00 9.99 C ATOM 2090 C TYR C 6 -23.253 26.140 15.158 1.00 10.06 C ATOM 2091 O TYR C 6 -23.547 25.483 16.157 1.00 10.22 O ATOM 2092 CB TYR C 6 -25.341 26.456 13.953 1.00 9.84 C ATOM 2093 CG TYR C 6 -26.199 26.284 12.730 1.00 12.04 C ATOM 2094 CD1 TYR C 6 -26.278 27.287 11.780 1.00 17.71 C ATOM 2095 CD2 TYR C 6 -26.926 25.107 12.531 1.00 13.23 C ATOM 2096 CE1 TYR C 6 -27.104 27.138 10.638 1.00 17.47 C ATOM 2097 CE2 TYR C 6 -27.729 24.929 11.391 1.00 14.46 C ATOM 2098 CZ TYR C 6 -27.815 25.969 10.467 1.00 17.39 C ATOM 2099 OH TYR C 6 -28.619 25.808 9.364 1.00 17.07 O ATOM 0 H TYR C 6 -24.377 23.950 14.213 1.00 9.82 H new ATOM 0 HA TYR C 6 -23.431 26.233 13.112 1.00 9.99 H new ATOM 0 HB2 TYR C 6 -25.795 26.054 14.710 1.00 9.84 H new ATOM 0 HB3 TYR C 6 -25.257 27.404 14.143 1.00 9.84 H new ATOM 0 HD1 TYR C 6 -25.784 28.067 11.892 1.00 17.71 H new ATOM 0 HD2 TYR C 6 -26.878 24.428 13.165 1.00 13.23 H new ATOM 0 HE1 TYR C 6 -27.166 27.822 10.010 1.00 17.47 H new ATOM 0 HE2 TYR C 6 -28.193 24.134 11.256 1.00 14.46 H new ATOM 0 HH TYR C 6 -28.600 25.005 9.118 1.00 17.07 H new ATOM 2100 N LEU C 7 -22.363 27.125 15.177 1.00 9.70 N ATOM 2101 CA LEU C 7 -21.927 27.669 16.471 1.00 9.92 C ATOM 2102 C LEU C 7 -22.802 28.854 16.794 1.00 9.30 C ATOM 2103 O LEU C 7 -22.964 29.763 15.930 1.00 10.26 O ATOM 2104 CB LEU C 7 -20.465 28.133 16.401 1.00 9.40 C ATOM 2105 CG LEU C 7 -19.469 27.223 15.675 1.00 9.61 C ATOM 2106 CD1 LEU C 7 -18.089 27.813 15.573 1.00 9.04 C ATOM 2107 CD2 LEU C 7 -19.398 25.853 16.427 1.00 13.45 C ATOM 0 H LEU C 7 -22.007 27.486 14.482 1.00 9.70 H new ATOM 0 HA LEU C 7 -21.999 26.982 17.152 1.00 9.92 H new ATOM 0 HB2 LEU C 7 -20.447 29.001 15.969 1.00 9.40 H new ATOM 0 HB3 LEU C 7 -20.148 28.261 17.309 1.00 9.40 H new ATOM 0 HG LEU C 7 -19.789 27.110 14.766 1.00 9.61 H new ATOM 0 HD11 LEU C 7 -17.506 27.194 15.106 1.00 9.04 H new ATOM 0 HD12 LEU C 7 -18.130 28.650 15.084 1.00 9.04 H new ATOM 0 HD13 LEU C 7 -17.740 27.976 16.463 1.00 9.04 H new ATOM 0 HD21 LEU C 7 -18.770 25.268 15.976 1.00 13.45 H new ATOM 0 HD22 LEU C 7 -19.104 26.000 17.340 1.00 13.45 H new ATOM 0 HD23 LEU C 7 -20.276 25.441 16.433 1.00 13.45 H new ATOM 2108 N LEU C 8 -23.284 28.895 18.039 1.00 9.77 N ATOM 2109 CA LEU C 8 -24.239 29.917 18.528 1.00 10.47 C ATOM 2110 C LEU C 8 -23.590 30.761 19.602 1.00 10.22 C ATOM 2111 O LEU C 8 -22.988 30.218 20.526 1.00 10.53 O ATOM 2112 CB LEU C 8 -25.474 29.285 19.184 1.00 10.33 C ATOM 2113 CG LEU C 8 -26.598 28.832 18.243 1.00 14.90 C ATOM 2114 CD1 LEU C 8 -26.074 27.846 17.307 1.00 16.72 C ATOM 2115 CD2 LEU C 8 -27.818 28.213 18.969 1.00 17.44 C ATOM 0 H LEU C 8 -23.065 28.321 18.640 1.00 9.77 H new ATOM 0 HA LEU C 8 -24.497 30.439 17.752 1.00 10.47 H new ATOM 0 HB2 LEU C 8 -25.183 28.517 19.700 1.00 10.33 H new ATOM 0 HB3 LEU C 8 -25.844 29.925 19.812 1.00 10.33 H new ATOM 0 HG LEU C 8 -26.910 29.632 17.793 1.00 14.90 H new ATOM 0 HD11 LEU C 8 -26.782 27.557 16.710 1.00 16.72 H new ATOM 0 HD12 LEU C 8 -25.356 28.241 16.788 1.00 16.72 H new ATOM 0 HD13 LEU C 8 -25.734 27.082 17.798 1.00 16.72 H new ATOM 0 HD21 LEU C 8 -28.485 27.951 18.315 1.00 17.44 H new ATOM 0 HD22 LEU C 8 -27.534 27.433 19.471 1.00 17.44 H new ATOM 0 HD23 LEU C 8 -28.200 28.867 19.576 1.00 17.44 H new ATOM 2116 N VAL C 9 -23.713 32.077 19.486 1.00 10.10 N ATOM 2117 CA VAL C 9 -23.247 32.955 20.582 1.00 10.14 C ATOM 2118 C VAL C 9 -24.467 33.733 21.035 1.00 9.93 C ATOM 2119 O VAL C 9 -25.191 34.270 20.179 1.00 9.34 O ATOM 2120 CB VAL C 9 -22.112 33.924 20.108 1.00 9.83 C ATOM 2121 CG1 VAL C 9 -21.619 34.804 21.311 1.00 12.56 C ATOM 2122 CG2 VAL C 9 -20.933 33.143 19.517 1.00 8.35 C ATOM 0 H VAL C 9 -24.051 32.483 18.807 1.00 10.10 H new ATOM 0 HA VAL C 9 -22.864 32.433 21.304 1.00 10.14 H new ATOM 0 HB VAL C 9 -22.475 34.499 19.416 1.00 9.83 H new ATOM 0 HG11 VAL C 9 -20.917 35.401 21.009 1.00 12.56 H new ATOM 0 HG12 VAL C 9 -22.360 35.326 21.656 1.00 12.56 H new ATOM 0 HG13 VAL C 9 -21.275 34.230 22.013 1.00 12.56 H new ATOM 0 HG21 VAL C 9 -20.244 33.763 19.231 1.00 8.35 H new ATOM 0 HG22 VAL C 9 -20.570 32.546 20.190 1.00 8.35 H new ATOM 0 HG23 VAL C 9 -21.237 32.625 18.755 1.00 8.35 H new ATOM 2123 N LYS C 10 -24.741 33.769 22.352 1.00 9.47 N ATOM 2124 CA LYS C 10 -25.958 34.413 22.809 1.00 9.85 C ATOM 2125 C LYS C 10 -25.851 35.941 22.661 1.00 10.63 C ATOM 2126 O LYS C 10 -24.753 36.476 22.531 1.00 11.26 O ATOM 2127 CB LYS C 10 -26.248 34.033 24.261 1.00 10.18 C ATOM 2128 CG LYS C 10 -25.442 34.836 25.249 1.00 13.88 C ATOM 2129 CD LYS C 10 -25.799 34.442 26.699 1.00 13.03 C ATOM 2130 CE LYS C 10 -24.855 35.212 27.679 1.00 18.03 C ATOM 2131 NZ LYS C 10 -24.743 36.696 27.464 1.00 18.73 N ATOM 0 H LYS C 10 -24.245 33.434 22.970 1.00 9.47 H new ATOM 0 HA LYS C 10 -26.694 34.105 22.257 1.00 9.85 H new ATOM 0 HB2 LYS C 10 -27.192 34.160 24.441 1.00 10.18 H new ATOM 0 HB3 LYS C 10 -26.060 33.090 24.388 1.00 10.18 H new ATOM 0 HG2 LYS C 10 -24.496 34.691 25.094 1.00 13.88 H new ATOM 0 HG3 LYS C 10 -25.610 35.782 25.116 1.00 13.88 H new ATOM 0 HD2 LYS C 10 -26.726 34.658 26.887 1.00 13.03 H new ATOM 0 HD3 LYS C 10 -25.700 33.485 26.821 1.00 13.03 H new ATOM 0 HE2 LYS C 10 -25.165 35.058 28.585 1.00 18.03 H new ATOM 0 HE3 LYS C 10 -23.967 34.827 27.613 1.00 18.03 H new ATOM 0 HZ1 LYS C 10 -24.372 37.073 28.180 1.00 18.73 H new ATOM 0 HZ2 LYS C 10 -24.237 36.855 26.750 1.00 18.73 H new ATOM 0 HZ3 LYS C 10 -25.554 37.040 27.335 1.00 18.73 H new ATOM 2132 N PRO C 11 -26.984 36.649 22.663 1.00 12.29 N ATOM 2133 CA PRO C 11 -26.890 38.122 22.623 1.00 14.05 C ATOM 2134 C PRO C 11 -26.313 38.620 23.950 1.00 16.33 C ATOM 2135 O PRO C 11 -26.612 38.047 25.016 1.00 16.33 O ATOM 2136 CB PRO C 11 -28.361 38.572 22.467 1.00 13.33 C ATOM 2137 CG PRO C 11 -29.103 37.314 22.005 1.00 11.61 C ATOM 2138 CD PRO C 11 -28.388 36.198 22.691 1.00 12.98 C ATOM 0 HA PRO C 11 -26.321 38.462 21.915 1.00 14.05 H new ATOM 0 HB2 PRO C 11 -28.719 38.905 23.305 1.00 13.33 H new ATOM 0 HB3 PRO C 11 -28.444 39.289 21.819 1.00 13.33 H new ATOM 0 HG2 PRO C 11 -30.040 37.342 22.255 1.00 11.61 H new ATOM 0 HG3 PRO C 11 -29.070 37.217 21.040 1.00 11.61 H new ATOM 0 HD2 PRO C 11 -28.707 36.069 23.598 1.00 12.98 H new ATOM 0 HD3 PRO C 11 -28.505 35.355 22.226 1.00 12.98 H new ATOM 2139 N GLU C 12 -25.508 39.667 23.912 1.00 18.45 N ATOM 2140 CA GLU C 12 -24.899 40.143 25.161 1.00 21.28 C ATOM 2141 C GLU C 12 -25.946 40.518 26.245 1.00 21.58 C ATOM 2142 O GLU C 12 -25.715 40.329 27.463 1.00 22.64 O ATOM 2143 CB GLU C 12 -23.928 41.292 24.874 1.00 22.55 C ATOM 2144 CG GLU C 12 -24.552 42.549 24.258 1.00 25.53 C ATOM 2145 CD GLU C 12 -25.291 43.493 25.268 1.00 32.24 C ATOM 2146 OE1 GLU C 12 -25.058 43.434 26.501 1.00 33.24 O ATOM 2147 OE2 GLU C 12 -26.134 44.296 24.796 1.00 35.55 O ATOM 0 H GLU C 12 -25.301 40.109 23.204 1.00 18.45 H new ATOM 0 HA GLU C 12 -24.396 39.404 25.537 1.00 21.28 H new ATOM 0 HB2 GLU C 12 -23.492 41.541 25.704 1.00 22.55 H new ATOM 0 HB3 GLU C 12 -23.236 40.968 24.276 1.00 22.55 H new ATOM 0 HG2 GLU C 12 -23.853 43.056 23.816 1.00 25.53 H new ATOM 0 HG3 GLU C 12 -25.182 42.277 23.572 1.00 25.53 H new ATOM 2148 N SER C 13 -27.116 40.958 25.804 1.00 21.40 N ATOM 2149 CA SER C 13 -28.207 41.379 26.679 1.00 22.29 C ATOM 2150 C SER C 13 -29.009 40.234 27.317 1.00 22.11 C ATOM 2151 O SER C 13 -29.765 40.466 28.248 1.00 22.23 O ATOM 2152 CB SER C 13 -29.152 42.291 25.880 1.00 23.39 C ATOM 2153 OG SER C 13 -29.931 41.503 24.948 1.00 26.23 O ATOM 0 H SER C 13 -27.305 41.023 24.967 1.00 21.40 H new ATOM 0 HA SER C 13 -27.795 41.845 27.423 1.00 22.29 H new ATOM 0 HB2 SER C 13 -29.742 42.767 26.485 1.00 23.39 H new ATOM 0 HB3 SER C 13 -28.639 42.960 25.400 1.00 23.39 H new ATOM 0 HG SER C 13 -29.731 41.720 24.162 1.00 26.23 H new ATOM 2154 N MET C 14 -28.853 38.999 26.830 1.00 19.94 N ATOM 2155 CA MET C 14 -29.546 37.859 27.385 1.00 18.78 C ATOM 2156 C MET C 14 -28.650 37.109 28.382 1.00 18.17 C ATOM 2157 O MET C 14 -27.471 36.854 28.114 1.00 19.35 O ATOM 2158 CB MET C 14 -29.948 36.901 26.248 1.00 17.67 C ATOM 2159 CG MET C 14 -30.757 35.706 26.689 1.00 17.83 C ATOM 2160 SD MET C 14 -31.499 34.832 25.263 1.00 15.78 S ATOM 2161 CE MET C 14 -32.607 36.158 24.682 1.00 17.14 C ATOM 0 H MET C 14 -28.339 38.810 26.167 1.00 19.94 H new ATOM 0 HA MET C 14 -30.336 38.175 27.851 1.00 18.78 H new ATOM 0 HB2 MET C 14 -30.458 37.397 25.589 1.00 17.67 H new ATOM 0 HB3 MET C 14 -29.144 36.587 25.806 1.00 17.67 H new ATOM 0 HG2 MET C 14 -30.189 35.095 27.184 1.00 17.83 H new ATOM 0 HG3 MET C 14 -31.459 35.994 27.293 1.00 17.83 H new ATOM 0 HE1 MET C 14 -33.449 35.773 24.393 1.00 17.14 H new ATOM 0 HE2 MET C 14 -32.769 36.784 25.405 1.00 17.14 H new ATOM 0 HE3 MET C 14 -32.193 36.623 23.938 1.00 17.14 H new ATOM 2162 N SER C 15 -29.203 36.756 29.530 1.00 18.08 N ATOM 2163 CA SER C 15 -28.426 36.000 30.539 1.00 17.06 C ATOM 2164 C SER C 15 -28.136 34.578 30.030 1.00 17.54 C ATOM 2165 O SER C 15 -28.885 34.041 29.193 1.00 15.60 O ATOM 2166 CB SER C 15 -29.214 35.933 31.854 1.00 16.89 C ATOM 2167 OG SER C 15 -30.368 35.089 31.760 1.00 14.40 O ATOM 0 H SER C 15 -30.013 36.934 29.756 1.00 18.08 H new ATOM 0 HA SER C 15 -27.583 36.454 30.693 1.00 17.06 H new ATOM 0 HB2 SER C 15 -28.634 35.605 32.559 1.00 16.89 H new ATOM 0 HB3 SER C 15 -29.491 36.827 32.108 1.00 16.89 H new ATOM 0 HG SER C 15 -30.769 35.079 32.498 1.00 14.40 H new ATOM 2168 N HIS C 16 -27.106 33.937 30.573 1.00 16.88 N ATOM 2169 CA HIS C 16 -26.841 32.559 30.225 1.00 17.29 C ATOM 2170 C HIS C 16 -28.035 31.671 30.533 1.00 17.54 C ATOM 2171 O HIS C 16 -28.368 30.775 29.716 1.00 17.54 O ATOM 2172 CB HIS C 16 -25.553 32.025 30.892 1.00 17.83 C ATOM 2173 CG HIS C 16 -24.295 32.407 30.165 1.00 19.86 C ATOM 2174 ND1 HIS C 16 -23.764 31.956 28.998 1.00 24.39 N flip ATOM 2175 CD2 HIS C 16 -23.429 33.381 30.628 1.00 20.59 C flip ATOM 2176 CE1 HIS C 16 -22.608 32.667 28.775 1.00 23.79 C flip ATOM 2177 NE2 HIS C 16 -22.414 33.504 29.783 1.00 25.94 N flip ATOM 0 H HIS C 16 -26.558 34.282 31.138 1.00 16.88 H new ATOM 0 HA HIS C 16 -26.692 32.534 29.267 1.00 17.29 H new ATOM 0 HB2 HIS C 16 -25.506 32.360 31.801 1.00 17.83 H new ATOM 0 HB3 HIS C 16 -25.604 31.058 30.948 1.00 17.83 H new ATOM 0 HD1 HIS C 16 -24.090 31.341 28.493 1.00 24.39 H new ATOM 0 HD2 HIS C 16 -23.541 33.873 31.409 1.00 20.59 H new ATOM 0 HE1 HIS C 16 -22.052 32.575 28.035 1.00 23.79 H new ATOM 2178 N GLU C 17 -28.701 31.901 31.670 1.00 16.70 N ATOM 2179 CA GLU C 17 -29.867 31.076 32.026 1.00 16.93 C ATOM 2180 C GLU C 17 -31.011 31.289 31.036 1.00 16.20 C ATOM 2181 O GLU C 17 -31.680 30.311 30.638 1.00 15.89 O ATOM 2182 CB GLU C 17 -30.382 31.326 33.456 1.00 18.13 C ATOM 2183 CG GLU C 17 -31.607 30.455 33.912 1.00 23.18 C ATOM 2184 CD GLU C 17 -31.458 28.904 33.678 1.00 31.89 C ATOM 2185 OE1 GLU C 17 -30.330 28.334 33.708 1.00 33.99 O ATOM 2186 OE2 GLU C 17 -32.505 28.239 33.460 1.00 35.96 O ATOM 0 H GLU C 17 -28.501 32.515 32.238 1.00 16.70 H new ATOM 0 HA GLU C 17 -29.557 30.158 31.985 1.00 16.93 H new ATOM 0 HB2 GLU C 17 -29.651 31.172 34.075 1.00 18.13 H new ATOM 0 HB3 GLU C 17 -30.627 32.261 33.533 1.00 18.13 H new ATOM 0 HG2 GLU C 17 -31.761 30.611 34.857 1.00 23.18 H new ATOM 0 HG3 GLU C 17 -32.397 30.763 33.441 1.00 23.18 H new ATOM 2187 N GLN C 18 -31.238 32.535 30.645 1.00 14.57 N ATOM 2188 CA GLN C 18 -32.336 32.813 29.728 1.00 15.67 C ATOM 2189 C GLN C 18 -32.015 32.169 28.359 1.00 14.76 C ATOM 2190 O GLN C 18 -32.912 31.613 27.689 1.00 14.95 O ATOM 2191 CB GLN C 18 -32.597 34.318 29.597 1.00 14.91 C ATOM 2192 CG GLN C 18 -33.867 34.634 28.798 1.00 19.81 C ATOM 2193 CD GLN C 18 -35.130 34.056 29.461 1.00 26.20 C ATOM 2194 OE1 GLN C 18 -35.338 34.206 30.683 1.00 28.74 O ATOM 2195 NE2 GLN C 18 -35.965 33.371 28.668 1.00 24.73 N ATOM 0 H GLN C 18 -30.781 33.220 30.891 1.00 14.57 H new ATOM 0 HA GLN C 18 -33.153 32.426 30.081 1.00 15.67 H new ATOM 0 HB2 GLN C 18 -32.672 34.707 30.482 1.00 14.91 H new ATOM 0 HB3 GLN C 18 -31.836 34.738 29.166 1.00 14.91 H new ATOM 0 HG2 GLN C 18 -33.961 35.595 28.710 1.00 19.81 H new ATOM 0 HG3 GLN C 18 -33.781 34.274 27.901 1.00 19.81 H new ATOM 0 HE21 GLN C 18 -35.791 33.287 27.830 1.00 24.73 H new ATOM 0 HE22 GLN C 18 -36.675 33.015 28.997 1.00 24.73 H new ATOM 2196 N PHE C 19 -30.747 32.240 27.960 1.00 13.93 N ATOM 2197 CA PHE C 19 -30.298 31.601 26.719 1.00 12.51 C ATOM 2198 C PHE C 19 -30.551 30.090 26.711 1.00 13.58 C ATOM 2199 O PHE C 19 -31.056 29.568 25.707 1.00 12.84 O ATOM 2200 CB PHE C 19 -28.849 31.947 26.443 1.00 13.20 C ATOM 2201 CG PHE C 19 -28.270 31.242 25.232 1.00 10.36 C ATOM 2202 CD1 PHE C 19 -28.540 31.711 23.947 1.00 11.59 C ATOM 2203 CD2 PHE C 19 -27.478 30.106 25.384 1.00 13.21 C ATOM 2204 CE1 PHE C 19 -27.987 31.031 22.821 1.00 10.48 C ATOM 2205 CE2 PHE C 19 -26.916 29.423 24.251 1.00 10.54 C ATOM 2206 CZ PHE C 19 -27.196 29.881 23.003 1.00 9.04 C ATOM 0 H PHE C 19 -30.129 32.653 28.392 1.00 13.93 H new ATOM 0 HA PHE C 19 -30.833 31.956 25.992 1.00 12.51 H new ATOM 0 HB2 PHE C 19 -28.773 32.906 26.315 1.00 13.20 H new ATOM 0 HB3 PHE C 19 -28.318 31.722 27.222 1.00 13.20 H new ATOM 0 HD1 PHE C 19 -29.076 32.461 23.825 1.00 11.59 H new ATOM 0 HD2 PHE C 19 -27.309 29.782 26.239 1.00 13.21 H new ATOM 0 HE1 PHE C 19 -28.150 31.349 21.962 1.00 10.48 H new ATOM 0 HE2 PHE C 19 -26.370 28.680 24.370 1.00 10.54 H new ATOM 0 HZ PHE C 19 -26.862 29.430 22.261 1.00 9.04 H new ATOM 2207 N ARG C 20 -30.186 29.395 27.811 1.00 13.04 N ATOM 2208 CA AARG C 20 -30.485 27.979 28.001 0.50 14.38 C ATOM 2209 CA BARG C 20 -30.480 27.972 27.989 0.50 13.94 C ATOM 2210 C ARG C 20 -31.979 27.711 27.791 1.00 14.22 C ATOM 2211 O ARG C 20 -32.369 26.784 27.062 1.00 14.73 O ATOM 2212 CB AARG C 20 -30.082 27.540 29.423 0.50 14.98 C ATOM 2213 CB BARG C 20 -30.020 27.479 29.384 0.50 14.22 C ATOM 2214 CG AARG C 20 -30.042 26.033 29.636 0.50 18.24 C ATOM 2215 CG BARG C 20 -30.372 26.010 29.700 0.50 15.55 C ATOM 2216 CD AARG C 20 -30.668 25.639 30.972 0.50 24.51 C ATOM 2217 CD BARG C 20 -30.150 25.646 31.199 0.50 18.29 C ATOM 2218 NE AARG C 20 -32.030 25.163 30.731 0.50 27.82 N ATOM 2219 NE BARG C 20 -28.743 25.491 31.552 0.50 21.84 N ATOM 2220 CZ AARG C 20 -33.010 25.184 31.616 0.50 27.91 C ATOM 2221 CZ BARG C 20 -28.113 24.312 31.619 0.50 22.83 C ATOM 2222 NH1AARG C 20 -32.814 25.666 32.839 0.50 29.31 N ATOM 2223 NH1BARG C 20 -26.822 24.258 31.941 0.50 21.17 N ATOM 2224 NH2AARG C 20 -34.191 24.716 31.270 0.50 27.79 N ATOM 2225 NH2BARG C 20 -28.770 23.192 31.343 0.50 23.42 N ATOM 0 H AARG C 20 -29.755 29.747 28.467 0.50 13.04 H new ATOM 0 H BARG C 20 -29.760 29.746 28.471 0.50 13.04 H new ATOM 0 HA AARG C 20 -29.978 27.471 27.349 0.50 13.94 H new ATOM 0 HA BARG C 20 -29.986 27.473 27.319 0.50 13.94 H new ATOM 0 HB2AARG C 20 -29.207 27.906 29.626 0.50 14.22 H new ATOM 0 HB2BARG C 20 -29.059 27.590 29.451 0.50 14.22 H new ATOM 0 HB3AARG C 20 -30.706 27.928 30.057 0.50 14.22 H new ATOM 0 HB3BARG C 20 -30.419 28.047 30.062 0.50 14.22 H new ATOM 0 HG2AARG C 20 -30.514 25.590 28.913 0.50 15.55 H new ATOM 0 HG2BARG C 20 -31.299 25.846 29.465 0.50 15.55 H new ATOM 0 HG3AARG C 20 -29.123 25.725 29.605 0.50 15.55 H new ATOM 0 HG3BARG C 20 -29.831 25.426 29.146 0.50 15.55 H new ATOM 0 HD2AARG C 20 -30.140 24.946 31.399 0.50 18.29 H new ATOM 0 HD2BARG C 20 -30.542 26.337 31.755 0.50 18.29 H new ATOM 0 HD3AARG C 20 -30.679 26.399 31.575 0.50 18.29 H new ATOM 0 HD3BARG C 20 -30.620 24.821 31.398 0.50 18.29 H new ATOM 0 HE AARG C 20 -32.206 24.844 29.952 0.50 21.84 H new ATOM 0 HE BARG C 20 -28.291 26.201 31.728 0.50 21.84 H new ATOM 0 HH11AARG C 20 -32.041 25.970 33.063 0.50 21.17 H new ATOM 0 HH11BARG C 20 -26.390 24.983 32.107 0.50 21.17 H new ATOM 0 HH12AARG C 20 -33.460 25.674 33.407 0.50 21.17 H new ATOM 0 HH12BARG C 20 -26.421 23.499 31.983 0.50 21.17 H new ATOM 0 HH21AARG C 20 -34.315 24.403 30.478 0.50 23.42 H new ATOM 0 HH21BARG C 20 -29.600 23.224 31.121 0.50 23.42 H new ATOM 0 HH22AARG C 20 -34.839 24.723 31.836 0.50 23.42 H new ATOM 0 HH22BARG C 20 -28.365 22.434 31.386 0.50 23.42 H new ATOM 2226 N LYS C 21 -32.817 28.511 28.447 1.00 13.45 N ATOM 2227 CA ALYS C 21 -34.256 28.301 28.335 0.50 13.02 C ATOM 2228 CA BLYS C 21 -34.284 28.399 28.348 0.50 13.33 C ATOM 2229 C LYS C 21 -34.733 28.533 26.886 1.00 13.38 C ATOM 2230 O LYS C 21 -35.585 27.812 26.406 1.00 13.24 O ATOM 2231 CB ALYS C 21 -35.017 29.159 29.348 0.50 13.41 C ATOM 2232 CB BLYS C 21 -34.961 29.519 29.157 0.50 13.34 C ATOM 2233 CG ALYS C 21 -34.921 28.615 30.815 0.50 12.98 C ATOM 2234 CG BLYS C 21 -35.003 29.333 30.696 0.50 15.62 C ATOM 2235 CD ALYS C 21 -35.354 29.652 31.852 0.50 17.35 C ATOM 2236 CD BLYS C 21 -35.849 30.467 31.348 0.50 16.55 C ATOM 2237 CE ALYS C 21 -35.310 29.066 33.267 0.50 18.00 C ATOM 2238 CE BLYS C 21 -36.088 30.226 32.843 0.50 19.60 C ATOM 2239 NZ ALYS C 21 -35.278 30.146 34.283 0.50 20.55 N ATOM 2240 NZ BLYS C 21 -36.469 28.809 33.191 0.50 21.29 N ATOM 0 H ALYS C 21 -32.579 29.166 28.951 0.50 13.45 H new ATOM 0 H BLYS C 21 -32.553 29.142 28.969 0.50 13.45 H new ATOM 0 HA ALYS C 21 -34.451 27.376 28.552 0.50 13.33 H new ATOM 0 HA BLYS C 21 -34.540 27.531 28.698 0.50 13.33 H new ATOM 0 HB2ALYS C 21 -34.670 30.064 29.322 0.50 13.34 H new ATOM 0 HB2BLYS C 21 -34.503 30.352 28.964 0.50 13.34 H new ATOM 0 HB3ALYS C 21 -35.950 29.206 29.087 0.50 13.34 H new ATOM 0 HB3BLYS C 21 -35.872 29.616 28.838 0.50 13.34 H new ATOM 0 HG2ALYS C 21 -35.476 27.824 30.901 0.50 15.62 H new ATOM 0 HG2BLYS C 21 -35.385 28.468 30.914 0.50 15.62 H new ATOM 0 HG3ALYS C 21 -34.008 28.342 30.997 0.50 15.62 H new ATOM 0 HG3BLYS C 21 -34.102 29.344 31.055 0.50 15.62 H new ATOM 0 HD2ALYS C 21 -34.773 30.427 31.801 0.50 16.55 H new ATOM 0 HD2BLYS C 21 -35.396 31.316 31.227 0.50 16.55 H new ATOM 0 HD3ALYS C 21 -36.253 29.958 31.653 0.50 16.55 H new ATOM 0 HD3BLYS C 21 -36.703 30.534 30.892 0.50 16.55 H new ATOM 0 HE2ALYS C 21 -36.086 28.502 33.412 0.50 19.60 H new ATOM 0 HE2BLYS C 21 -35.283 30.462 33.330 0.50 19.60 H new ATOM 0 HE3ALYS C 21 -34.527 28.502 33.364 0.50 19.60 H new ATOM 0 HE3BLYS C 21 -36.790 30.822 33.148 0.50 19.60 H new ATOM 0 HZ1ALYS C 21 -35.253 29.787 35.097 0.50 21.29 H new ATOM 0 HZ1BLYS C 21 -37.048 28.815 33.867 0.50 21.29 H new ATOM 0 HZ2ALYS C 21 -34.555 30.650 34.159 0.50 21.29 H new ATOM 0 HZ2BLYS C 21 -36.843 28.420 32.484 0.50 21.29 H new ATOM 0 HZ3ALYS C 21 -36.007 30.650 34.204 0.50 21.29 H new ATOM 0 HZ3BLYS C 21 -35.741 28.355 33.428 0.50 21.29 H new ATOM 2241 N GLU C 22 -34.167 29.512 26.195 1.00 13.08 N ATOM 2242 CA GLU C 22 -34.591 29.752 24.816 1.00 12.95 C ATOM 2243 C GLU C 22 -34.120 28.623 23.858 1.00 12.37 C ATOM 2244 O GLU C 22 -34.785 28.376 22.852 1.00 11.51 O ATOM 2245 CB GLU C 22 -34.097 31.115 24.320 1.00 13.20 C ATOM 2246 CG GLU C 22 -34.729 32.356 25.056 1.00 16.49 C ATOM 2247 CD GLU C 22 -36.272 32.314 25.077 1.00 20.98 C ATOM 2248 OE1 GLU C 22 -36.873 31.926 24.042 1.00 15.98 O ATOM 2249 OE2 GLU C 22 -36.875 32.615 26.148 1.00 20.87 O ATOM 0 H GLU C 22 -33.553 30.037 26.491 1.00 13.08 H new ATOM 0 HA GLU C 22 -35.561 29.753 24.813 1.00 12.95 H new ATOM 0 HB2 GLU C 22 -33.133 31.152 24.421 1.00 13.20 H new ATOM 0 HB3 GLU C 22 -34.286 31.187 23.371 1.00 13.20 H new ATOM 0 HG2 GLU C 22 -34.398 32.390 25.967 1.00 16.49 H new ATOM 0 HG3 GLU C 22 -34.437 33.170 24.617 1.00 16.49 H new ATOM 2250 N CYS C 23 -32.948 28.002 24.130 1.00 11.92 N ATOM 2251 CA CYS C 23 -32.486 26.846 23.328 1.00 11.14 C ATOM 2252 C CYS C 23 -33.534 25.737 23.417 1.00 11.45 C ATOM 2253 O CYS C 23 -33.874 25.090 22.431 1.00 10.99 O ATOM 2254 CB CYS C 23 -31.111 26.294 23.801 1.00 10.81 C ATOM 2255 SG CYS C 23 -29.712 27.345 23.495 1.00 11.72 S ATOM 0 H CYS C 23 -32.416 28.233 24.765 1.00 11.92 H new ATOM 0 HA CYS C 23 -32.371 27.149 22.414 1.00 11.14 H new ATOM 0 HB2 CYS C 23 -31.162 26.120 24.754 1.00 10.81 H new ATOM 0 HB3 CYS C 23 -30.956 25.442 23.365 1.00 10.81 H new ATOM 0 HG CYS C 23 -29.801 28.336 24.166 1.00 11.72 H new ATOM 2256 N VAL C 24 -34.061 25.525 24.621 1.00 11.46 N ATOM 2257 CA VAL C 24 -35.044 24.469 24.840 1.00 11.47 C ATOM 2258 C VAL C 24 -36.337 24.785 24.081 1.00 11.94 C ATOM 2259 O VAL C 24 -36.935 23.894 23.451 1.00 11.85 O ATOM 2260 CB VAL C 24 -35.340 24.263 26.360 1.00 11.29 C ATOM 2261 CG1 VAL C 24 -36.524 23.336 26.554 1.00 11.26 C ATOM 2262 CG2 VAL C 24 -34.125 23.653 27.036 1.00 12.75 C ATOM 0 H VAL C 24 -33.863 25.981 25.323 1.00 11.46 H new ATOM 0 HA VAL C 24 -34.671 23.641 24.500 1.00 11.47 H new ATOM 0 HB VAL C 24 -35.545 25.126 26.752 1.00 11.29 H new ATOM 0 HG11 VAL C 24 -36.693 23.220 27.502 1.00 11.26 H new ATOM 0 HG12 VAL C 24 -37.308 23.720 26.131 1.00 11.26 H new ATOM 0 HG13 VAL C 24 -36.330 22.474 26.153 1.00 11.26 H new ATOM 0 HG21 VAL C 24 -34.309 23.525 27.980 1.00 12.75 H new ATOM 0 HG22 VAL C 24 -33.923 22.797 26.628 1.00 12.75 H new ATOM 0 HG23 VAL C 24 -33.365 24.247 26.933 1.00 12.75 H new ATOM 2263 N VAL C 25 -36.757 26.050 24.125 1.00 10.12 N ATOM 2264 CA VAL C 25 -37.995 26.432 23.442 1.00 11.03 C ATOM 2265 C VAL C 25 -37.769 26.224 21.943 1.00 12.20 C ATOM 2266 O VAL C 25 -38.686 25.803 21.192 1.00 11.69 O ATOM 2267 CB VAL C 25 -38.294 27.943 23.701 1.00 10.18 C ATOM 2268 CG1 VAL C 25 -39.252 28.549 22.628 1.00 12.12 C ATOM 2269 CG2 VAL C 25 -38.838 28.164 25.169 1.00 12.35 C ATOM 0 H VAL C 25 -36.352 26.689 24.534 1.00 10.12 H new ATOM 0 HA VAL C 25 -38.740 25.902 23.765 1.00 11.03 H new ATOM 0 HB VAL C 25 -37.456 28.424 23.619 1.00 10.18 H new ATOM 0 HG11 VAL C 25 -39.410 29.485 22.827 1.00 12.12 H new ATOM 0 HG12 VAL C 25 -38.847 28.469 21.750 1.00 12.12 H new ATOM 0 HG13 VAL C 25 -40.095 28.070 22.639 1.00 12.12 H new ATOM 0 HG21 VAL C 25 -39.017 29.107 25.309 1.00 12.35 H new ATOM 0 HG22 VAL C 25 -39.657 27.658 25.290 1.00 12.35 H new ATOM 0 HG23 VAL C 25 -38.174 27.863 25.809 1.00 12.35 H new ATOM 2270 N HIS C 26 -36.547 26.552 21.506 1.00 11.32 N ATOM 2271 CA HIS C 26 -36.218 26.453 20.073 1.00 10.87 C ATOM 2272 C HIS C 26 -36.341 25.007 19.607 1.00 11.08 C ATOM 2273 O HIS C 26 -36.882 24.722 18.494 1.00 10.20 O ATOM 2274 CB HIS C 26 -34.824 27.031 19.768 1.00 10.02 C ATOM 2275 CG HIS C 26 -34.682 27.539 18.356 1.00 11.77 C ATOM 2276 ND1 HIS C 26 -35.500 28.526 17.843 1.00 10.50 N ATOM 2277 CD2 HIS C 26 -33.868 27.166 17.343 1.00 10.71 C ATOM 2278 CE1 HIS C 26 -35.171 28.760 16.583 1.00 15.16 C ATOM 2279 NE2 HIS C 26 -34.179 27.955 16.255 1.00 10.46 N ATOM 0 H HIS C 26 -35.906 26.828 22.008 1.00 11.32 H new ATOM 0 HA HIS C 26 -36.856 26.989 19.576 1.00 10.87 H new ATOM 0 HB2 HIS C 26 -34.640 27.756 20.385 1.00 10.02 H new ATOM 0 HB3 HIS C 26 -34.156 26.346 19.927 1.00 10.02 H new ATOM 0 HD2 HIS C 26 -33.219 26.501 17.374 1.00 10.71 H new ATOM 0 HE1 HIS C 26 -35.571 29.386 16.024 1.00 15.16 H new ATOM 0 HE2 HIS C 26 -33.790 27.927 15.489 1.00 10.46 H new ATOM 2280 N PHE C 27 -35.816 24.098 20.422 1.00 9.41 N ATOM 2281 CA PHE C 27 -35.986 22.696 20.121 1.00 9.91 C ATOM 2282 C PHE C 27 -37.488 22.294 20.099 1.00 10.40 C ATOM 2283 O PHE C 27 -37.944 21.616 19.178 1.00 9.46 O ATOM 2284 CB PHE C 27 -35.196 21.812 21.099 1.00 10.07 C ATOM 2285 CG PHE C 27 -35.485 20.363 20.911 1.00 8.60 C ATOM 2286 CD1 PHE C 27 -34.877 19.640 19.865 1.00 8.69 C ATOM 2287 CD2 PHE C 27 -36.420 19.743 21.703 1.00 8.89 C ATOM 2288 CE1 PHE C 27 -35.194 18.280 19.670 1.00 12.64 C ATOM 2289 CE2 PHE C 27 -36.766 18.403 21.504 1.00 10.64 C ATOM 2290 CZ PHE C 27 -36.148 17.671 20.488 1.00 13.06 C ATOM 0 H PHE C 27 -35.369 24.272 21.136 1.00 9.41 H new ATOM 0 HA PHE C 27 -35.628 22.549 19.231 1.00 9.91 H new ATOM 0 HB2 PHE C 27 -34.246 21.969 20.978 1.00 10.07 H new ATOM 0 HB3 PHE C 27 -35.412 22.067 22.009 1.00 10.07 H new ATOM 0 HD1 PHE C 27 -34.266 20.060 19.303 1.00 8.69 H new ATOM 0 HD2 PHE C 27 -36.831 20.224 22.385 1.00 8.89 H new ATOM 0 HE1 PHE C 27 -34.771 17.792 19.001 1.00 12.64 H new ATOM 0 HE2 PHE C 27 -37.405 18.001 22.046 1.00 10.64 H new ATOM 0 HZ PHE C 27 -36.372 16.778 20.356 1.00 13.06 H new ATOM 2291 N GLN C 28 -38.261 22.707 21.106 1.00 10.66 N ATOM 2292 CA GLN C 28 -39.666 22.343 21.143 1.00 11.54 C ATOM 2293 C GLN C 28 -40.403 22.911 19.903 1.00 11.38 C ATOM 2294 O GLN C 28 -41.189 22.189 19.296 1.00 11.34 O ATOM 2295 CB GLN C 28 -40.346 22.820 22.443 1.00 12.84 C ATOM 2296 CG GLN C 28 -39.747 22.189 23.717 1.00 15.77 C ATOM 2297 CD GLN C 28 -40.102 22.952 25.020 1.00 23.11 C ATOM 2298 OE1 GLN C 28 -40.294 24.175 25.023 1.00 22.71 O ATOM 2299 NE2 GLN C 28 -40.145 22.221 26.135 1.00 26.10 N ATOM 0 H GLN C 28 -37.991 23.190 21.764 1.00 10.66 H new ATOM 0 HA GLN C 28 -39.720 21.375 21.125 1.00 11.54 H new ATOM 0 HB2 GLN C 28 -40.272 23.785 22.503 1.00 12.84 H new ATOM 0 HB3 GLN C 28 -41.292 22.610 22.401 1.00 12.84 H new ATOM 0 HG2 GLN C 28 -40.060 21.274 23.792 1.00 15.77 H new ATOM 0 HG3 GLN C 28 -38.782 22.152 23.626 1.00 15.77 H new ATOM 0 HE21 GLN C 28 -40.007 21.373 26.099 1.00 26.10 H new ATOM 0 HE22 GLN C 28 -40.311 22.598 26.890 1.00 26.10 H new ATOM 2300 N MET C 29 -40.112 24.158 19.497 1.00 11.04 N ATOM 2301 CA MET C 29 -40.728 24.734 18.268 1.00 11.66 C ATOM 2302 C MET C 29 -40.469 23.900 17.000 1.00 11.72 C ATOM 2303 O MET C 29 -41.266 23.919 16.055 1.00 12.01 O ATOM 2304 CB MET C 29 -40.190 26.131 17.999 1.00 11.91 C ATOM 2305 CG MET C 29 -40.710 27.145 18.977 1.00 14.29 C ATOM 2306 SD MET C 29 -39.789 28.648 18.796 1.00 14.37 S ATOM 2307 CE MET C 29 -40.896 29.803 19.629 1.00 16.62 C ATOM 0 H MET C 29 -39.570 24.685 19.907 1.00 11.04 H new ATOM 0 HA MET C 29 -41.681 24.744 18.447 1.00 11.66 H new ATOM 0 HB2 MET C 29 -39.221 26.115 18.039 1.00 11.91 H new ATOM 0 HB3 MET C 29 -40.432 26.400 17.099 1.00 11.91 H new ATOM 0 HG2 MET C 29 -41.653 27.309 18.820 1.00 14.29 H new ATOM 0 HG3 MET C 29 -40.628 26.809 19.883 1.00 14.29 H new ATOM 0 HE1 MET C 29 -40.496 30.687 19.635 1.00 16.62 H new ATOM 0 HE2 MET C 29 -41.744 29.835 19.159 1.00 16.62 H new ATOM 0 HE3 MET C 29 -41.044 29.509 20.541 1.00 16.62 H new ATOM 2308 N SER C 30 -39.350 23.188 16.980 1.00 11.12 N ATOM 2309 CA SER C 30 -38.876 22.516 15.736 1.00 11.42 C ATOM 2310 C SER C 30 -39.641 21.216 15.389 1.00 11.47 C ATOM 2311 O SER C 30 -39.431 20.619 14.310 1.00 10.81 O ATOM 2312 CB SER C 30 -37.356 22.240 15.853 1.00 10.49 C ATOM 2313 OG SER C 30 -37.109 21.089 16.672 1.00 9.45 O ATOM 0 H SER C 30 -38.841 23.072 17.664 1.00 11.12 H new ATOM 0 HA SER C 30 -39.057 23.124 15.002 1.00 11.42 H new ATOM 0 HB2 SER C 30 -36.979 22.101 14.970 1.00 10.49 H new ATOM 0 HB3 SER C 30 -36.911 23.014 16.232 1.00 10.49 H new ATOM 0 HG SER C 30 -37.353 21.248 17.460 1.00 9.45 H new ATOM 2314 N ALA C 31 -40.473 20.738 16.312 1.00 10.90 N ATOM 2315 CA ALA C 31 -41.113 19.440 16.150 1.00 10.86 C ATOM 2316 C ALA C 31 -41.970 19.489 14.874 1.00 10.31 C ATOM 2317 O ALA C 31 -42.741 20.426 14.671 1.00 9.54 O ATOM 2318 CB ALA C 31 -41.999 19.114 17.365 1.00 11.38 C ATOM 0 H ALA C 31 -40.679 21.151 17.038 1.00 10.90 H new ATOM 0 HA ALA C 31 -40.438 18.747 16.081 1.00 10.86 H new ATOM 0 HB1 ALA C 31 -42.416 18.247 17.239 1.00 11.38 H new ATOM 0 HB2 ALA C 31 -41.454 19.096 18.167 1.00 11.38 H new ATOM 0 HB3 ALA C 31 -42.686 19.793 17.456 1.00 11.38 H new ATOM 2319 N GLY C 32 -41.810 18.502 14.017 1.00 7.93 N ATOM 2320 CA GLY C 32 -42.635 18.417 12.786 1.00 9.16 C ATOM 2321 C GLY C 32 -42.462 19.561 11.807 1.00 8.87 C ATOM 2322 O GLY C 32 -43.347 19.781 10.961 1.00 9.68 O ATOM 0 H GLY C 32 -41.238 17.866 14.111 1.00 7.93 H new ATOM 0 HA2 GLY C 32 -42.424 17.587 12.330 1.00 9.16 H new ATOM 0 HA3 GLY C 32 -43.569 18.370 13.043 1.00 9.16 H new ATOM 2323 N MET C 33 -41.378 20.320 11.963 1.00 8.73 N ATOM 2324 CA MET C 33 -40.974 21.400 11.028 1.00 10.61 C ATOM 2325 C MET C 33 -40.855 20.852 9.581 1.00 10.22 C ATOM 2326 O MET C 33 -40.210 19.813 9.351 1.00 10.26 O ATOM 2327 CB MET C 33 -39.631 21.967 11.512 1.00 9.81 C ATOM 2328 CG MET C 33 -38.951 22.994 10.648 1.00 13.56 C ATOM 2329 SD MET C 33 -39.849 24.527 10.729 1.00 19.74 S ATOM 2330 CE MET C 33 -39.762 24.958 12.480 1.00 13.70 C ATOM 0 H MET C 33 -40.839 20.227 12.626 1.00 8.73 H new ATOM 0 HA MET C 33 -41.644 22.102 11.016 1.00 10.61 H new ATOM 0 HB2 MET C 33 -39.772 22.360 12.388 1.00 9.81 H new ATOM 0 HB3 MET C 33 -39.019 21.224 11.630 1.00 9.81 H new ATOM 0 HG2 MET C 33 -38.037 23.127 10.946 1.00 13.56 H new ATOM 0 HG3 MET C 33 -38.908 22.681 9.731 1.00 13.56 H new ATOM 0 HE1 MET C 33 -39.983 25.896 12.594 1.00 13.70 H new ATOM 0 HE2 MET C 33 -40.392 24.415 12.979 1.00 13.70 H new ATOM 0 HE3 MET C 33 -38.864 24.796 12.809 1.00 13.70 H new ATOM 2331 N PRO C 34 -41.530 21.514 8.617 1.00 11.28 N ATOM 2332 CA PRO C 34 -41.519 21.023 7.212 1.00 11.32 C ATOM 2333 C PRO C 34 -40.112 20.864 6.674 1.00 9.81 C ATOM 2334 O PRO C 34 -39.290 21.717 6.896 1.00 8.44 O ATOM 2335 CB PRO C 34 -42.284 22.111 6.444 1.00 9.80 C ATOM 2336 CG PRO C 34 -43.380 22.495 7.511 1.00 12.33 C ATOM 2337 CD PRO C 34 -42.578 22.551 8.831 1.00 10.08 C ATOM 0 HA PRO C 34 -41.918 20.143 7.128 1.00 11.32 H new ATOM 0 HB2 PRO C 34 -41.719 22.863 6.208 1.00 9.80 H new ATOM 0 HB3 PRO C 34 -42.672 21.778 5.620 1.00 9.80 H new ATOM 0 HG2 PRO C 34 -43.796 23.347 7.307 1.00 12.33 H new ATOM 0 HG3 PRO C 34 -44.090 21.835 7.550 1.00 12.33 H new ATOM 0 HD2 PRO C 34 -42.192 23.428 8.982 1.00 10.08 H new ATOM 0 HD3 PRO C 34 -43.134 22.349 9.600 1.00 10.08 H new ATOM 2338 N GLY C 35 -39.844 19.725 6.041 1.00 10.48 N ATOM 2339 CA GLY C 35 -38.529 19.511 5.396 1.00 10.47 C ATOM 2340 C GLY C 35 -37.397 19.091 6.345 1.00 11.75 C ATOM 2341 O GLY C 35 -36.378 18.561 5.900 1.00 12.48 O ATOM 0 H GLY C 35 -40.394 19.068 5.969 1.00 10.48 H new ATOM 0 HA2 GLY C 35 -38.627 18.831 4.712 1.00 10.47 H new ATOM 0 HA3 GLY C 35 -38.268 20.330 4.947 1.00 10.47 H new ATOM 2342 N LEU C 36 -37.606 19.220 7.654 1.00 11.84 N ATOM 2343 CA LEU C 36 -36.500 19.013 8.602 1.00 12.20 C ATOM 2344 C LEU C 36 -36.491 17.577 9.103 1.00 12.12 C ATOM 2345 O LEU C 36 -37.502 17.069 9.607 1.00 14.26 O ATOM 2346 CB LEU C 36 -36.617 20.000 9.757 1.00 13.10 C ATOM 2347 CG LEU C 36 -35.553 19.944 10.873 1.00 12.88 C ATOM 2348 CD1 LEU C 36 -34.222 20.510 10.320 1.00 10.06 C ATOM 2349 CD2 LEU C 36 -36.001 20.776 12.007 1.00 14.64 C ATOM 0 H LEU C 36 -38.361 19.422 8.012 1.00 11.84 H new ATOM 0 HA LEU C 36 -35.658 19.172 8.148 1.00 12.20 H new ATOM 0 HB2 LEU C 36 -36.609 20.895 9.384 1.00 13.10 H new ATOM 0 HB3 LEU C 36 -37.486 19.873 10.169 1.00 13.10 H new ATOM 0 HG LEU C 36 -35.426 19.029 11.169 1.00 12.88 H new ATOM 0 HD11 LEU C 36 -33.544 20.480 11.013 1.00 10.06 H new ATOM 0 HD12 LEU C 36 -33.933 19.977 9.563 1.00 10.06 H new ATOM 0 HD13 LEU C 36 -34.354 21.428 10.037 1.00 10.06 H new ATOM 0 HD21 LEU C 36 -35.337 20.746 12.713 1.00 14.64 H new ATOM 0 HD22 LEU C 36 -36.116 21.692 11.711 1.00 14.64 H new ATOM 0 HD23 LEU C 36 -36.845 20.437 12.343 1.00 14.64 H new ATOM 2350 N HIS C 37 -35.375 16.877 8.954 1.00 11.87 N ATOM 2351 CA HIS C 37 -35.353 15.507 9.476 1.00 11.75 C ATOM 2352 C HIS C 37 -35.127 15.503 10.987 1.00 12.71 C ATOM 2353 O HIS C 37 -35.701 14.673 11.724 1.00 11.75 O ATOM 2354 CB HIS C 37 -34.261 14.692 8.816 1.00 13.17 C ATOM 2355 CG HIS C 37 -34.215 13.275 9.297 1.00 16.11 C ATOM 2356 ND1 HIS C 37 -35.079 12.256 9.108 1.00 20.22 N flip ATOM 2357 CD2 HIS C 37 -33.218 12.789 10.117 1.00 17.08 C flip ATOM 2358 CE1 HIS C 37 -34.579 11.173 9.788 1.00 20.59 C flip ATOM 2359 NE2 HIS C 37 -33.459 11.521 10.396 1.00 22.52 N flip ATOM 0 H HIS C 37 -34.653 17.152 8.576 1.00 11.87 H new ATOM 0 HA HIS C 37 -36.215 15.110 9.277 1.00 11.75 H new ATOM 0 HB2 HIS C 37 -34.396 14.698 7.855 1.00 13.17 H new ATOM 0 HB3 HIS C 37 -33.404 15.113 8.984 1.00 13.17 H new ATOM 0 HD1 HIS C 37 -35.806 12.280 8.648 1.00 20.22 H new ATOM 0 HD2 HIS C 37 -32.490 13.278 10.425 1.00 17.08 H new ATOM 0 HE1 HIS C 37 -34.967 10.328 9.816 1.00 20.59 H new ATOM 2360 N LYS C 38 -34.278 16.420 11.443 1.00 10.86 N ATOM 2361 CA LYS C 38 -33.890 16.477 12.864 1.00 11.47 C ATOM 2362 C LYS C 38 -33.273 17.831 13.167 1.00 10.92 C ATOM 2363 O LYS C 38 -32.543 18.424 12.326 1.00 10.59 O ATOM 2364 CB LYS C 38 -32.872 15.351 13.166 1.00 10.96 C ATOM 2365 CG LYS C 38 -32.487 15.161 14.635 1.00 14.12 C ATOM 2366 CD LYS C 38 -31.420 14.006 14.738 1.00 18.54 C ATOM 2367 CE LYS C 38 -30.598 14.134 16.016 1.00 21.98 C ATOM 2368 NZ LYS C 38 -29.741 12.931 16.191 1.00 23.83 N ATOM 0 H LYS C 38 -33.911 17.022 10.950 1.00 10.86 H new ATOM 0 HA LYS C 38 -34.674 16.354 13.421 1.00 11.47 H new ATOM 0 HB2 LYS C 38 -33.236 14.515 12.836 1.00 10.96 H new ATOM 0 HB3 LYS C 38 -32.064 15.528 12.660 1.00 10.96 H new ATOM 0 HG2 LYS C 38 -32.125 15.985 14.996 1.00 14.12 H new ATOM 0 HG3 LYS C 38 -33.271 14.941 15.162 1.00 14.12 H new ATOM 0 HD2 LYS C 38 -31.867 13.145 14.722 1.00 18.54 H new ATOM 0 HD3 LYS C 38 -30.832 14.034 13.967 1.00 18.54 H new ATOM 0 HE2 LYS C 38 -30.046 14.931 15.976 1.00 21.98 H new ATOM 0 HE3 LYS C 38 -31.187 14.235 16.780 1.00 21.98 H new ATOM 0 HZ1 LYS C 38 -28.979 13.164 16.588 1.00 23.83 H new ATOM 0 HZ2 LYS C 38 -30.167 12.334 16.695 1.00 23.83 H new ATOM 0 HZ3 LYS C 38 -29.563 12.574 15.395 1.00 23.83 H new ATOM 2369 N TYR C 39 -33.520 18.297 14.404 1.00 9.98 N ATOM 2370 CA TYR C 39 -32.770 19.428 14.960 1.00 9.40 C ATOM 2371 C TYR C 39 -32.198 19.019 16.301 1.00 9.78 C ATOM 2372 O TYR C 39 -32.838 18.288 17.060 1.00 8.29 O ATOM 2373 CB TYR C 39 -33.636 20.691 15.068 1.00 9.65 C ATOM 2374 CG TYR C 39 -33.026 21.870 15.803 1.00 9.17 C ATOM 2375 CD1 TYR C 39 -32.019 22.665 15.214 1.00 10.97 C ATOM 2376 CD2 TYR C 39 -33.451 22.198 17.076 1.00 9.64 C ATOM 2377 CE1 TYR C 39 -31.462 23.719 15.875 1.00 12.46 C ATOM 2378 CE2 TYR C 39 -32.900 23.294 17.757 1.00 12.41 C ATOM 2379 CZ TYR C 39 -31.908 24.041 17.133 1.00 13.09 C ATOM 2380 OH TYR C 39 -31.369 25.110 17.772 1.00 15.08 O ATOM 0 H TYR C 39 -34.116 17.971 14.931 1.00 9.98 H new ATOM 0 HA TYR C 39 -32.043 19.656 14.359 1.00 9.40 H new ATOM 0 HB2 TYR C 39 -33.866 20.979 14.171 1.00 9.65 H new ATOM 0 HB3 TYR C 39 -34.465 20.453 15.511 1.00 9.65 H new ATOM 0 HD1 TYR C 39 -31.728 22.465 14.354 1.00 10.97 H new ATOM 0 HD2 TYR C 39 -34.110 21.686 17.486 1.00 9.64 H new ATOM 0 HE1 TYR C 39 -30.785 24.216 15.477 1.00 12.46 H new ATOM 0 HE2 TYR C 39 -33.193 23.517 18.611 1.00 12.41 H new ATOM 0 HH TYR C 39 -30.924 25.568 17.226 1.00 15.08 H new ATOM 2381 N GLU C 40 -30.976 19.456 16.564 1.00 8.97 N ATOM 2382 CA GLU C 40 -30.384 19.267 17.906 1.00 8.89 C ATOM 2383 C GLU C 40 -29.717 20.539 18.371 1.00 7.63 C ATOM 2384 O GLU C 40 -29.091 21.226 17.585 1.00 6.42 O ATOM 2385 CB GLU C 40 -29.336 18.154 17.864 1.00 7.90 C ATOM 2386 CG GLU C 40 -28.748 17.829 19.271 1.00 9.51 C ATOM 2387 CD GLU C 40 -28.001 16.518 19.268 1.00 10.59 C ATOM 2388 OE1 GLU C 40 -27.211 16.328 18.357 1.00 11.93 O ATOM 2389 OE2 GLU C 40 -28.229 15.678 20.160 1.00 12.38 O ATOM 0 H GLU C 40 -30.470 19.860 15.998 1.00 8.97 H new ATOM 0 HA GLU C 40 -31.096 19.029 18.520 1.00 8.89 H new ATOM 0 HB2 GLU C 40 -29.735 17.352 17.491 1.00 7.90 H new ATOM 0 HB3 GLU C 40 -28.616 18.415 17.269 1.00 7.90 H new ATOM 0 HG2 GLU C 40 -28.151 18.542 19.546 1.00 9.51 H new ATOM 0 HG3 GLU C 40 -29.466 17.792 19.922 1.00 9.51 H new ATOM 2390 N VAL C 41 -29.853 20.842 19.663 1.00 8.00 N ATOM 2391 CA VAL C 41 -29.152 21.989 20.262 1.00 7.48 C ATOM 2392 C VAL C 41 -28.565 21.583 21.615 1.00 8.65 C ATOM 2393 O VAL C 41 -29.227 20.925 22.429 1.00 9.55 O ATOM 2394 CB VAL C 41 -30.065 23.271 20.383 1.00 7.33 C ATOM 2395 CG1 VAL C 41 -31.242 23.022 21.338 1.00 6.36 C ATOM 2396 CG2 VAL C 41 -29.239 24.518 20.843 1.00 6.19 C ATOM 0 H VAL C 41 -30.345 20.399 20.212 1.00 8.00 H new ATOM 0 HA VAL C 41 -28.429 22.240 19.665 1.00 7.48 H new ATOM 0 HB VAL C 41 -30.422 23.458 19.501 1.00 7.33 H new ATOM 0 HG11 VAL C 41 -31.787 23.822 21.396 1.00 6.36 H new ATOM 0 HG12 VAL C 41 -31.781 22.288 21.004 1.00 6.36 H new ATOM 0 HG13 VAL C 41 -30.903 22.798 22.219 1.00 6.36 H new ATOM 0 HG21 VAL C 41 -29.825 25.288 20.908 1.00 6.19 H new ATOM 0 HG22 VAL C 41 -28.841 24.341 21.710 1.00 6.19 H new ATOM 0 HG23 VAL C 41 -28.539 24.699 20.197 1.00 6.19 H new ATOM 2397 N AARG C 42 -27.301 21.921 21.832 0.50 9.09 N ATOM 2398 N BARG C 42 -27.321 21.976 21.860 0.50 9.62 N ATOM 2399 CA AARG C 42 -26.619 21.599 23.095 0.50 9.15 C ATOM 2400 CA BARG C 42 -26.616 21.599 23.095 0.50 10.23 C ATOM 2401 C AARG C 42 -25.934 22.859 23.590 0.50 10.01 C ATOM 2402 C BARG C 42 -25.809 22.787 23.589 0.50 10.70 C ATOM 2403 O AARG C 42 -25.574 23.698 22.787 0.50 10.41 O ATOM 2404 O BARG C 42 -25.211 23.496 22.788 0.50 11.01 O ATOM 2405 CB AARG C 42 -25.582 20.483 22.884 0.50 8.36 C ATOM 2406 CB BARG C 42 -25.673 20.429 22.804 0.50 10.05 C ATOM 2407 CG AARG C 42 -26.164 19.183 22.339 0.50 6.47 C ATOM 2408 CG BARG C 42 -24.762 20.741 21.641 0.50 10.87 C ATOM 2409 CD AARG C 42 -25.071 18.231 21.942 0.50 4.57 C ATOM 2410 CD BARG C 42 -24.669 19.593 20.610 0.50 14.06 C ATOM 2411 NE AARG C 42 -24.680 18.336 20.535 0.50 5.38 N ATOM 2412 NE BARG C 42 -23.738 18.578 21.043 0.50 17.89 N ATOM 2413 CZ AARG C 42 -23.548 17.824 20.058 0.50 6.92 C ATOM 2414 CZ BARG C 42 -23.134 17.705 20.247 0.50 18.05 C ATOM 2415 NH1AARG C 42 -22.690 17.204 20.887 0.50 5.38 N ATOM 2416 NH1BARG C 42 -22.288 16.833 20.778 0.50 16.25 N ATOM 2417 NH2AARG C 42 -23.264 17.927 18.771 0.50 7.91 N ATOM 2418 NH2BARG C 42 -23.373 17.697 18.942 0.50 17.68 N ATOM 0 H AARG C 42 -26.812 22.340 21.262 0.50 9.62 H new ATOM 0 H BARG C 42 -26.859 22.465 21.324 0.50 9.62 H new ATOM 0 HA AARG C 42 -27.264 21.284 23.747 0.50 10.23 H new ATOM 0 HA BARG C 42 -27.259 21.335 23.772 0.50 10.23 H new ATOM 0 HB2AARG C 42 -24.899 20.801 22.273 0.50 10.05 H new ATOM 0 HB2BARG C 42 -25.142 20.235 23.592 0.50 10.05 H new ATOM 0 HB3AARG C 42 -25.143 20.300 23.729 0.50 10.05 H new ATOM 0 HB3BARG C 42 -26.191 19.633 22.608 0.50 10.05 H new ATOM 0 HG2AARG C 42 -26.729 18.771 23.011 0.50 10.87 H new ATOM 0 HG2BARG C 42 -25.080 21.542 21.196 0.50 10.87 H new ATOM 0 HG3AARG C 42 -26.727 19.373 21.572 0.50 10.87 H new ATOM 0 HG3BARG C 42 -23.874 20.937 21.978 0.50 10.87 H new ATOM 0 HD2AARG C 42 -24.293 18.394 22.498 0.50 14.06 H new ATOM 0 HD2BARG C 42 -25.546 19.198 20.482 0.50 14.06 H new ATOM 0 HD3AARG C 42 -25.363 17.323 22.121 0.50 14.06 H new ATOM 0 HD3BARG C 42 -24.389 19.947 19.752 0.50 14.06 H new ATOM 0 HE AARG C 42 -25.206 18.747 19.992 0.50 17.89 H new ATOM 0 HE BARG C 42 -23.561 18.536 21.884 0.50 17.89 H new ATOM 0 HH11AARG C 42 -22.873 17.139 21.725 0.50 16.25 H new ATOM 0 HH11BARG C 42 -22.139 16.840 21.625 0.50 16.25 H new ATOM 0 HH12AARG C 42 -21.958 16.873 20.579 0.50 16.25 H new ATOM 0 HH12BARG C 42 -21.889 16.261 20.275 0.50 16.25 H new ATOM 0 HH21AARG C 42 -23.811 18.325 18.240 0.50 17.68 H new ATOM 0 HH21BARG C 42 -23.925 18.262 18.603 0.50 17.68 H new ATOM 0 HH22AARG C 42 -22.532 17.596 18.464 0.50 17.68 H new ATOM 0 HH22BARG C 42 -22.976 17.127 18.436 0.50 17.68 H new ATOM 2419 N LEU C 43 -25.753 22.999 24.908 1.00 10.11 N ATOM 2420 CA LEU C 43 -24.864 24.029 25.421 1.00 10.75 C ATOM 2421 C LEU C 43 -23.421 23.574 25.354 1.00 11.01 C ATOM 2422 O LEU C 43 -23.123 22.372 25.440 1.00 12.03 O ATOM 2423 CB LEU C 43 -25.172 24.372 26.890 1.00 10.76 C ATOM 2424 CG LEU C 43 -26.531 24.994 27.207 1.00 13.04 C ATOM 2425 CD1 LEU C 43 -26.623 25.280 28.724 1.00 16.32 C ATOM 2426 CD2 LEU C 43 -26.656 26.307 26.464 1.00 13.61 C ATOM 0 H ALEU C 43 -26.132 22.513 25.508 0.50 10.11 H new ATOM 0 H BLEU C 43 -26.207 22.571 25.500 0.50 10.11 H new ATOM 0 HA LEU C 43 -25.005 24.812 24.866 1.00 10.75 H new ATOM 0 HB2 LEU C 43 -25.089 23.557 27.410 1.00 10.76 H new ATOM 0 HB3 LEU C 43 -24.485 24.981 27.204 1.00 10.76 H new ATOM 0 HG LEU C 43 -27.237 24.385 26.940 1.00 13.04 H new ATOM 0 HD11 LEU C 43 -27.485 25.675 28.927 1.00 16.32 H new ATOM 0 HD12 LEU C 43 -26.524 24.450 29.217 1.00 16.32 H new ATOM 0 HD13 LEU C 43 -25.918 25.894 28.981 1.00 16.32 H new ATOM 0 HD21 LEU C 43 -27.517 26.709 26.660 1.00 13.61 H new ATOM 0 HD22 LEU C 43 -25.948 26.907 26.746 1.00 13.61 H new ATOM 0 HD23 LEU C 43 -26.584 26.147 25.510 1.00 13.61 H new ATOM 2427 N VAL C 44 -22.528 24.540 25.202 1.00 10.67 N ATOM 2428 CA VAL C 44 -21.109 24.327 25.499 1.00 10.48 C ATOM 2429 C VAL C 44 -20.890 24.423 27.010 1.00 11.77 C ATOM 2430 O VAL C 44 -21.001 25.504 27.598 1.00 10.89 O ATOM 2431 CB VAL C 44 -20.192 25.341 24.796 1.00 8.90 C ATOM 2432 CG1 VAL C 44 -18.744 25.071 25.140 1.00 9.21 C ATOM 2433 CG2 VAL C 44 -20.333 25.270 23.291 1.00 10.28 C ATOM 0 H VAL C 44 -22.719 25.332 24.927 1.00 10.67 H new ATOM 0 HA VAL C 44 -20.877 23.446 25.166 1.00 10.48 H new ATOM 0 HB VAL C 44 -20.458 26.221 25.104 1.00 8.90 H new ATOM 0 HG11 VAL C 44 -18.178 25.718 24.690 1.00 9.21 H new ATOM 0 HG12 VAL C 44 -18.620 25.146 26.099 1.00 9.21 H new ATOM 0 HG13 VAL C 44 -18.504 24.176 24.852 1.00 9.21 H new ATOM 0 HG21 VAL C 44 -19.743 25.921 22.879 1.00 10.28 H new ATOM 0 HG22 VAL C 44 -20.096 24.380 22.985 1.00 10.28 H new ATOM 0 HG23 VAL C 44 -21.250 25.464 23.042 1.00 10.28 H new ATOM 2434 N ALA C 45 -20.588 23.283 27.605 1.00 13.06 N ATOM 2435 CA ALA C 45 -20.357 23.160 29.065 1.00 14.85 C ATOM 2436 C ALA C 45 -18.875 23.211 29.458 1.00 15.78 C ATOM 2437 O ALA C 45 -18.565 23.502 30.600 1.00 17.96 O ATOM 2438 CB ALA C 45 -20.965 21.876 29.568 1.00 15.91 C ATOM 0 H ALA C 45 -20.507 22.540 27.180 1.00 13.06 H new ATOM 0 HA ALA C 45 -20.782 23.929 29.477 1.00 14.85 H new ATOM 0 HB1 ALA C 45 -20.813 21.798 30.523 1.00 15.91 H new ATOM 0 HB2 ALA C 45 -21.919 21.879 29.392 1.00 15.91 H new ATOM 0 HB3 ALA C 45 -20.555 21.124 29.113 1.00 15.91 H new ATOM 2439 N GLY C 46 -17.956 22.899 28.542 1.00 14.78 N ATOM 2440 CA GLY C 46 -16.521 22.948 28.867 1.00 13.73 C ATOM 2441 C GLY C 46 -15.628 23.308 27.711 1.00 13.50 C ATOM 2442 O GLY C 46 -15.920 22.992 26.549 1.00 12.31 O ATOM 0 H GLY C 46 -18.136 22.659 27.736 1.00 14.78 H new ATOM 0 HA2 GLY C 46 -16.385 23.593 29.579 1.00 13.73 H new ATOM 0 HA3 GLY C 46 -16.250 22.083 29.212 1.00 13.73 H new ATOM 2443 N ASN C 47 -14.513 23.960 28.033 1.00 13.21 N ATOM 2444 CA ASN C 47 -13.558 24.420 27.026 1.00 14.77 C ATOM 2445 C ASN C 47 -12.150 24.024 27.403 1.00 16.49 C ATOM 2446 O ASN C 47 -11.304 24.889 27.738 1.00 16.46 O ATOM 2447 CB ASN C 47 -13.650 25.949 26.877 1.00 14.57 C ATOM 2448 CG ASN C 47 -14.971 26.379 26.206 1.00 16.06 C ATOM 2449 OD1 ASN C 47 -15.059 26.381 24.992 1.00 16.50 O ATOM 2450 ND2 ASN C 47 -15.984 26.732 27.003 1.00 14.91 N ATOM 0 H ASN C 47 -14.288 24.148 28.842 1.00 13.21 H new ATOM 0 HA ASN C 47 -13.779 24.001 26.179 1.00 14.77 H new ATOM 0 HB2 ASN C 47 -13.581 26.364 27.751 1.00 14.57 H new ATOM 0 HB3 ASN C 47 -12.900 26.269 26.351 1.00 14.57 H new ATOM 0 HD21 ASN C 47 -16.736 26.973 26.662 1.00 14.91 H new ATOM 0 HD22 ASN C 47 -15.884 26.718 27.857 1.00 14.91 H new ATOM 2451 N PRO C 48 -11.880 22.730 27.356 1.00 17.61 N ATOM 2452 CA PRO C 48 -10.547 22.263 27.774 1.00 19.21 C ATOM 2453 C PRO C 48 -9.463 22.753 26.789 1.00 20.64 C ATOM 2454 O PRO C 48 -9.648 22.659 25.575 1.00 19.06 O ATOM 2455 CB PRO C 48 -10.706 20.731 27.780 1.00 19.55 C ATOM 2456 CG PRO C 48 -11.917 20.444 26.867 1.00 18.99 C ATOM 2457 CD PRO C 48 -12.809 21.620 27.006 1.00 18.07 C ATOM 0 HA PRO C 48 -10.259 22.602 28.636 1.00 19.21 H new ATOM 0 HB2 PRO C 48 -9.906 20.295 27.448 1.00 19.55 H new ATOM 0 HB3 PRO C 48 -10.858 20.398 28.678 1.00 19.55 H new ATOM 0 HG2 PRO C 48 -11.639 20.324 25.946 1.00 18.99 H new ATOM 0 HG3 PRO C 48 -12.370 19.629 27.134 1.00 18.99 H new ATOM 0 HD2 PRO C 48 -13.288 21.803 26.183 1.00 18.07 H new ATOM 0 HD3 PRO C 48 -13.475 21.482 27.697 1.00 18.07 H new ATOM 2458 N THR C 49 -8.360 23.314 27.288 1.00 22.32 N ATOM 2459 CA THR C 49 -7.308 23.838 26.379 1.00 24.38 C ATOM 2460 C THR C 49 -6.049 22.962 26.310 1.00 25.94 C ATOM 2461 O THR C 49 -5.140 23.239 25.532 1.00 26.42 O ATOM 2462 CB THR C 49 -6.878 25.294 26.755 1.00 24.49 C ATOM 2463 OG1 THR C 49 -6.218 25.253 28.020 1.00 26.85 O ATOM 2464 CG2 THR C 49 -8.070 26.237 26.845 1.00 23.57 C ATOM 0 H THR C 49 -8.194 23.404 28.127 1.00 22.32 H new ATOM 0 HA THR C 49 -7.727 23.830 25.504 1.00 24.38 H new ATOM 0 HB THR C 49 -6.291 25.630 26.060 1.00 24.49 H new ATOM 0 HG1 THR C 49 -5.421 25.501 27.928 1.00 26.85 H new ATOM 0 HG21 THR C 49 -7.762 27.126 27.079 1.00 23.57 H new ATOM 0 HG22 THR C 49 -8.524 26.268 25.988 1.00 23.57 H new ATOM 0 HG23 THR C 49 -8.684 25.918 27.525 1.00 23.57 H new ATOM 2465 N ASP C 50 -6.002 21.899 27.118 1.00 28.27 N ATOM 2466 CA ASP C 50 -4.841 20.977 27.166 1.00 29.60 C ATOM 2467 C ASP C 50 -4.820 19.977 25.992 1.00 28.96 C ATOM 2468 O ASP C 50 -4.831 18.749 26.184 1.00 29.81 O ATOM 2469 CB ASP C 50 -4.828 20.217 28.511 1.00 30.96 C ATOM 2470 CG ASP C 50 -5.987 19.184 28.630 1.00 34.17 C ATOM 2471 OD1 ASP C 50 -7.167 19.537 28.369 1.00 38.96 O ATOM 2472 OD2 ASP C 50 -5.708 18.007 28.966 1.00 39.15 O ATOM 0 H ASP C 50 -6.638 21.686 27.656 1.00 28.27 H new ATOM 0 HA ASP C 50 -4.042 21.522 27.085 1.00 29.60 H new ATOM 0 HB2 ASP C 50 -3.979 19.758 28.610 1.00 30.96 H new ATOM 0 HB3 ASP C 50 -4.892 20.855 29.239 1.00 30.96 H new ATOM 2473 N THR C 51 -4.807 20.490 24.765 1.00 28.28 N ATOM 2474 CA THR C 51 -4.878 19.611 23.598 1.00 26.81 C ATOM 2475 C THR C 51 -3.521 18.960 23.249 1.00 26.82 C ATOM 2476 O THR C 51 -2.467 19.525 23.522 1.00 25.06 O ATOM 2477 CB THR C 51 -5.441 20.371 22.385 1.00 27.03 C ATOM 2478 OG1 THR C 51 -4.766 21.624 22.264 1.00 25.18 O ATOM 2479 CG2 THR C 51 -6.943 20.634 22.549 1.00 25.59 C ATOM 0 H THR C 51 -4.758 21.330 24.586 1.00 28.28 H new ATOM 0 HA THR C 51 -5.480 18.887 23.831 1.00 26.81 H new ATOM 0 HB THR C 51 -5.303 19.829 21.592 1.00 27.03 H new ATOM 0 HG1 THR C 51 -4.166 21.564 21.679 1.00 25.18 H new ATOM 0 HG21 THR C 51 -7.274 21.113 21.774 1.00 25.59 H new ATOM 0 HG22 THR C 51 -7.413 19.789 22.631 1.00 25.59 H new ATOM 0 HG23 THR C 51 -7.093 21.166 23.346 1.00 25.59 H new ATOM 2480 N ALA C 52 -3.557 17.779 22.637 1.00 26.77 N ATOM 2481 CA ALA C 52 -2.319 17.086 22.240 1.00 26.82 C ATOM 2482 C ALA C 52 -1.728 17.660 20.924 1.00 26.79 C ATOM 2483 O ALA C 52 -0.579 17.398 20.574 1.00 28.34 O ATOM 2484 CB ALA C 52 -2.561 15.610 22.128 1.00 27.68 C ATOM 0 H ALA C 52 -4.281 17.359 22.441 1.00 26.77 H new ATOM 0 HA ALA C 52 -1.659 17.239 22.934 1.00 26.82 H new ATOM 0 HB1 ALA C 52 -1.739 15.166 21.866 1.00 27.68 H new ATOM 0 HB2 ALA C 52 -2.856 15.264 22.985 1.00 27.68 H new ATOM 0 HB3 ALA C 52 -3.245 15.444 21.460 1.00 27.68 H new ATOM 2485 N VAL C 53 -2.514 18.445 20.189 1.00 25.16 N ATOM 2486 CA VAL C 53 -1.985 19.205 19.055 1.00 23.43 C ATOM 2487 C VAL C 53 -2.252 20.662 19.399 1.00 22.53 C ATOM 2488 O VAL C 53 -2.978 20.911 20.363 1.00 22.97 O ATOM 2489 CB VAL C 53 -2.631 18.776 17.694 1.00 23.67 C ATOM 2490 CG1 VAL C 53 -2.323 17.301 17.404 1.00 23.11 C ATOM 2491 CG2 VAL C 53 -4.150 19.012 17.677 1.00 21.37 C ATOM 0 H VAL C 53 -3.356 18.552 20.329 1.00 25.16 H new ATOM 0 HA VAL C 53 -1.038 19.040 18.923 1.00 23.43 H new ATOM 0 HB VAL C 53 -2.242 19.330 17.000 1.00 23.67 H new ATOM 0 HG11 VAL C 53 -2.727 17.046 16.560 1.00 23.11 H new ATOM 0 HG12 VAL C 53 -1.363 17.175 17.354 1.00 23.11 H new ATOM 0 HG13 VAL C 53 -2.684 16.749 18.115 1.00 23.11 H new ATOM 0 HG21 VAL C 53 -4.511 18.735 16.820 1.00 21.37 H new ATOM 0 HG22 VAL C 53 -4.566 18.496 18.385 1.00 21.37 H new ATOM 0 HG23 VAL C 53 -4.333 19.955 17.815 1.00 21.37 H new ATOM 2492 N PRO C 54 -1.676 21.628 18.656 1.00 21.64 N ATOM 2493 CA PRO C 54 -1.973 23.015 19.074 1.00 21.17 C ATOM 2494 C PRO C 54 -3.487 23.353 19.265 1.00 19.92 C ATOM 2495 O PRO C 54 -4.345 22.979 18.461 1.00 17.30 O ATOM 2496 CB PRO C 54 -1.328 23.890 17.985 1.00 21.73 C ATOM 2497 CG PRO C 54 -0.266 22.980 17.363 1.00 22.69 C ATOM 2498 CD PRO C 54 -0.670 21.561 17.577 1.00 21.57 C ATOM 0 HA PRO C 54 -1.616 23.172 19.962 1.00 21.17 H new ATOM 0 HB2 PRO C 54 -1.980 24.177 17.327 1.00 21.73 H new ATOM 0 HB3 PRO C 54 -0.933 24.692 18.361 1.00 21.73 H new ATOM 0 HG2 PRO C 54 -0.177 23.165 16.415 1.00 22.69 H new ATOM 0 HG3 PRO C 54 0.600 23.148 17.767 1.00 22.69 H new ATOM 0 HD2 PRO C 54 -1.042 21.173 16.770 1.00 21.57 H new ATOM 0 HD3 PRO C 54 0.088 21.012 17.833 1.00 21.57 H new ATOM 2499 N TYR C 55 -3.760 24.047 20.363 1.00 18.65 N ATOM 2500 CA TYR C 55 -5.093 24.484 20.706 1.00 18.70 C ATOM 2501 C TYR C 55 -5.533 25.633 19.812 1.00 18.77 C ATOM 2502 O TYR C 55 -4.733 26.534 19.522 1.00 18.72 O ATOM 2503 CB TYR C 55 -5.095 24.919 22.168 1.00 18.19 C ATOM 2504 CG TYR C 55 -6.382 25.571 22.592 1.00 18.63 C ATOM 2505 CD1 TYR C 55 -7.586 24.821 22.700 1.00 19.15 C ATOM 2506 CD2 TYR C 55 -6.412 26.920 22.921 1.00 17.99 C ATOM 2507 CE1 TYR C 55 -8.785 25.445 23.122 1.00 18.72 C ATOM 2508 CE2 TYR C 55 -7.597 27.542 23.330 1.00 16.91 C ATOM 2509 CZ TYR C 55 -8.768 26.807 23.431 1.00 17.71 C ATOM 2510 OH TYR C 55 -9.913 27.454 23.837 1.00 17.35 O ATOM 0 H TYR C 55 -3.161 24.278 20.936 1.00 18.65 H new ATOM 0 HA TYR C 55 -5.718 23.754 20.574 1.00 18.70 H new ATOM 0 HB2 TYR C 55 -4.931 24.145 22.730 1.00 18.19 H new ATOM 0 HB3 TYR C 55 -4.362 25.537 22.316 1.00 18.19 H new ATOM 0 HD1 TYR C 55 -7.586 23.915 22.492 1.00 19.15 H new ATOM 0 HD2 TYR C 55 -5.629 27.420 22.868 1.00 17.99 H new ATOM 0 HE1 TYR C 55 -9.572 24.955 23.192 1.00 18.72 H new ATOM 0 HE2 TYR C 55 -7.599 28.449 23.534 1.00 16.91 H new ATOM 0 HH TYR C 55 -9.744 28.266 23.971 1.00 17.35 H new ATOM 2511 N LEU C 56 -6.799 25.601 19.381 1.00 18.37 N ATOM 2512 CA LEU C 56 -7.387 26.645 18.530 1.00 18.10 C ATOM 2513 C LEU C 56 -8.382 27.432 19.361 1.00 18.37 C ATOM 2514 O LEU C 56 -9.376 26.872 19.839 1.00 16.98 O ATOM 2515 CB LEU C 56 -8.154 26.003 17.336 1.00 18.97 C ATOM 2516 CG LEU C 56 -8.897 26.930 16.358 1.00 20.76 C ATOM 2517 CD1 LEU C 56 -7.885 27.629 15.482 1.00 20.32 C ATOM 2518 CD2 LEU C 56 -9.791 26.100 15.467 1.00 18.79 C ATOM 0 H LEU C 56 -7.346 24.967 19.576 1.00 18.37 H new ATOM 0 HA LEU C 56 -6.680 27.215 18.190 1.00 18.10 H new ATOM 0 HB2 LEU C 56 -7.517 25.482 16.822 1.00 18.97 H new ATOM 0 HB3 LEU C 56 -8.801 25.380 17.702 1.00 18.97 H new ATOM 0 HG LEU C 56 -9.422 27.574 16.858 1.00 20.76 H new ATOM 0 HD11 LEU C 56 -8.345 28.216 14.862 1.00 20.32 H new ATOM 0 HD12 LEU C 56 -7.283 28.151 16.035 1.00 20.32 H new ATOM 0 HD13 LEU C 56 -7.376 26.969 14.985 1.00 20.32 H new ATOM 0 HD21 LEU C 56 -10.261 26.681 14.849 1.00 18.79 H new ATOM 0 HD22 LEU C 56 -9.252 25.466 14.968 1.00 18.79 H new ATOM 0 HD23 LEU C 56 -10.434 25.619 16.011 1.00 18.79 H new ATOM 2519 N AASP C 57 -8.152 28.734 19.503 0.50 18.05 N ATOM 2520 N BASP C 57 -8.129 28.727 19.529 0.50 18.05 N ATOM 2521 CA AASP C 57 -9.054 29.577 20.284 0.50 18.29 C ATOM 2522 CA BASP C 57 -9.048 29.584 20.266 0.50 18.27 C ATOM 2523 C AASP C 57 -10.007 30.323 19.353 0.50 18.27 C ATOM 2524 C BASP C 57 -9.995 30.192 19.247 0.50 18.29 C ATOM 2525 O AASP C 57 -9.586 31.167 18.547 0.50 18.92 O ATOM 2526 O BASP C 57 -9.555 30.808 18.269 0.50 19.07 O ATOM 2527 CB AASP C 57 -8.251 30.535 21.172 0.50 18.55 C ATOM 2528 CB BASP C 57 -8.274 30.674 21.022 0.50 18.52 C ATOM 2529 CG AASP C 57 -9.071 31.698 21.664 0.50 18.57 C ATOM 2530 CG BASP C 57 -9.029 31.208 22.222 0.50 18.15 C ATOM 2531 OD1AASP C 57 -10.302 31.571 21.765 0.50 19.53 O ATOM 2532 OD1BASP C 57 -10.258 31.000 22.324 0.50 17.39 O ATOM 2533 OD2AASP C 57 -8.475 32.743 21.952 0.50 19.16 O ATOM 2534 OD2BASP C 57 -8.383 31.846 23.077 0.50 18.96 O ATOM 0 H AASP C 57 -7.482 29.148 19.157 0.50 18.05 H new ATOM 0 H BASP C 57 -7.431 29.127 19.224 0.50 18.05 H new ATOM 0 HA AASP C 57 -9.590 29.021 20.870 0.50 18.27 H new ATOM 0 HA BASP C 57 -9.543 29.078 20.929 0.50 18.27 H new ATOM 0 HB2AASP C 57 -7.900 30.047 21.933 0.50 18.52 H new ATOM 0 HB2BASP C 57 -7.422 30.315 21.315 0.50 18.52 H new ATOM 0 HB3AASP C 57 -7.489 30.869 20.674 0.50 18.52 H new ATOM 0 HB3BASP C 57 -8.080 31.406 20.416 0.50 18.52 H new ATOM 2535 N VAL C 58 -11.294 29.998 19.455 1.00 17.72 N ATOM 2536 CA VAL C 58 -12.299 30.551 18.558 1.00 16.87 C ATOM 2537 C VAL C 58 -13.191 31.507 19.329 1.00 16.90 C ATOM 2538 O VAL C 58 -14.266 31.835 18.853 1.00 15.88 O ATOM 2539 CB VAL C 58 -13.181 29.455 17.864 1.00 16.81 C ATOM 2540 CG1 VAL C 58 -12.351 28.647 16.851 1.00 18.76 C ATOM 2541 CG2 VAL C 58 -13.836 28.522 18.897 1.00 15.36 C ATOM 0 H AVAL C 58 -11.605 29.454 20.043 0.50 17.72 H new ATOM 0 H BVAL C 58 -11.614 29.547 20.114 0.50 17.72 H new ATOM 0 HA VAL C 58 -11.823 31.016 17.852 1.00 16.87 H new ATOM 0 HB VAL C 58 -13.891 29.910 17.385 1.00 16.81 H new ATOM 0 HG11 VAL C 58 -12.913 27.976 16.434 1.00 18.76 H new ATOM 0 HG12 VAL C 58 -12.001 29.243 16.171 1.00 18.76 H new ATOM 0 HG13 VAL C 58 -11.615 28.212 17.309 1.00 18.76 H new ATOM 0 HG21 VAL C 58 -14.373 27.857 18.438 1.00 15.36 H new ATOM 0 HG22 VAL C 58 -13.147 28.078 19.416 1.00 15.36 H new ATOM 0 HG23 VAL C 58 -14.402 29.041 19.490 1.00 15.36 H new ATOM 2542 N GLY C 59 -12.776 31.907 20.535 1.00 16.97 N ATOM 2543 CA GLY C 59 -13.657 32.727 21.369 1.00 16.36 C ATOM 2544 C GLY C 59 -14.655 31.933 22.202 1.00 16.77 C ATOM 2545 O GLY C 59 -14.527 30.699 22.337 1.00 14.76 O ATOM 0 H GLY C 59 -12.011 31.721 20.880 1.00 16.97 H new ATOM 0 HA2 GLY C 59 -13.112 33.265 21.964 1.00 16.36 H new ATOM 0 HA3 GLY C 59 -14.145 33.341 20.798 1.00 16.36 H new ATOM 2546 N ARG C 60 -15.599 32.654 22.829 1.00 15.70 N ATOM 2547 CA ARG C 60 -16.618 32.019 23.656 1.00 16.56 C ATOM 2548 C ARG C 60 -17.819 31.627 22.781 1.00 15.10 C ATOM 2549 O ARG C 60 -18.535 32.492 22.246 1.00 14.43 O ATOM 2550 CB ARG C 60 -17.094 32.927 24.813 1.00 17.31 C ATOM 2551 CG ARG C 60 -17.856 32.168 25.926 1.00 19.24 C ATOM 2552 CD ARG C 60 -18.808 33.097 26.735 1.00 18.08 C ATOM 2553 NE ARG C 60 -19.989 33.494 25.969 1.00 19.88 N ATOM 2554 CZ ARG C 60 -20.227 34.723 25.505 1.00 20.04 C ATOM 2555 NH1 ARG C 60 -21.338 34.960 24.815 1.00 17.10 N ATOM 2556 NH2 ARG C 60 -19.364 35.720 25.731 1.00 18.75 N ATOM 0 H ARG C 60 -15.660 33.511 22.783 1.00 15.70 H new ATOM 0 HA ARG C 60 -16.217 31.231 24.055 1.00 16.56 H new ATOM 0 HB2 ARG C 60 -16.325 33.370 25.203 1.00 17.31 H new ATOM 0 HB3 ARG C 60 -17.669 33.621 24.454 1.00 17.31 H new ATOM 0 HG2 ARG C 60 -18.371 31.449 25.529 1.00 19.24 H new ATOM 0 HG3 ARG C 60 -17.217 31.759 26.530 1.00 19.24 H new ATOM 0 HD2 ARG C 60 -19.089 32.641 27.544 1.00 18.08 H new ATOM 0 HD3 ARG C 60 -18.323 33.891 27.010 1.00 18.08 H new ATOM 0 HE ARG C 60 -20.577 32.888 25.804 1.00 19.88 H new ATOM 0 HH11 ARG C 60 -21.898 34.324 24.670 1.00 17.10 H new ATOM 0 HH12 ARG C 60 -21.497 35.750 24.514 1.00 17.10 H new ATOM 0 HH21 ARG C 60 -18.645 35.573 26.180 1.00 18.75 H new ATOM 0 HH22 ARG C 60 -19.528 36.508 25.427 1.00 18.75 H new ATOM 2557 N ILE C 61 -18.040 30.324 22.644 1.00 13.27 N ATOM 2558 CA ILE C 61 -19.229 29.817 21.932 1.00 12.36 C ATOM 2559 C ILE C 61 -20.178 29.260 22.991 1.00 11.78 C ATOM 2560 O ILE C 61 -19.745 28.515 23.856 1.00 11.80 O ATOM 2561 CB ILE C 61 -18.862 28.676 20.926 1.00 11.50 C ATOM 2562 CG1 ILE C 61 -17.755 29.139 19.953 1.00 12.65 C ATOM 2563 CG2 ILE C 61 -20.140 28.117 20.227 1.00 11.48 C ATOM 2564 CD1 ILE C 61 -18.134 30.349 19.063 1.00 9.39 C ATOM 0 H ILE C 61 -17.520 29.712 22.952 1.00 13.27 H new ATOM 0 HA ILE C 61 -19.631 30.537 21.421 1.00 12.36 H new ATOM 0 HB ILE C 61 -18.485 27.926 21.412 1.00 11.50 H new ATOM 0 HG12 ILE C 61 -16.965 29.367 20.467 1.00 12.65 H new ATOM 0 HG13 ILE C 61 -17.515 28.395 19.379 1.00 12.65 H new ATOM 0 HG21 ILE C 61 -19.889 27.412 19.609 1.00 11.48 H new ATOM 0 HG22 ILE C 61 -20.745 27.760 20.896 1.00 11.48 H new ATOM 0 HG23 ILE C 61 -20.582 28.831 19.741 1.00 11.48 H new ATOM 0 HD11 ILE C 61 -17.387 30.573 18.486 1.00 9.39 H new ATOM 0 HD12 ILE C 61 -18.905 30.123 18.520 1.00 9.39 H new ATOM 0 HD13 ILE C 61 -18.347 31.110 19.625 1.00 9.39 H new ATOM 2565 N ASP C 62 -21.450 29.632 22.925 1.00 11.40 N ATOM 2566 CA ASP C 62 -22.395 29.288 23.978 1.00 11.53 C ATOM 2567 C ASP C 62 -23.165 27.981 23.739 1.00 11.58 C ATOM 2568 O ASP C 62 -23.505 27.299 24.689 1.00 10.85 O ATOM 2569 CB ASP C 62 -23.339 30.436 24.213 1.00 11.72 C ATOM 2570 CG ASP C 62 -22.602 31.670 24.718 1.00 12.39 C ATOM 2571 OD1 ASP C 62 -21.819 31.556 25.693 1.00 12.61 O ATOM 2572 OD2 ASP C 62 -22.718 32.726 24.069 1.00 13.79 O ATOM 0 H ASP C 62 -21.787 30.086 22.277 1.00 11.40 H new ATOM 0 HA ASP C 62 -21.866 29.125 24.775 1.00 11.53 H new ATOM 0 HB2 ASP C 62 -23.802 30.649 23.388 1.00 11.72 H new ATOM 0 HB3 ASP C 62 -24.014 30.174 24.858 1.00 11.72 H new ATOM 2573 N ALA C 63 -23.443 27.655 22.476 1.00 9.59 N ATOM 2574 CA ALA C 63 -24.254 26.487 22.129 1.00 9.50 C ATOM 2575 C ALA C 63 -23.899 26.011 20.700 1.00 8.76 C ATOM 2576 O ALA C 63 -23.293 26.760 19.912 1.00 8.78 O ATOM 2577 CB ALA C 63 -25.785 26.732 22.294 1.00 9.66 C ATOM 0 H ALA C 63 -23.167 28.105 21.797 1.00 9.59 H new ATOM 0 HA ALA C 63 -24.038 25.783 22.760 1.00 9.50 H new ATOM 0 HB1 ALA C 63 -26.270 25.928 22.051 1.00 9.66 H new ATOM 0 HB2 ALA C 63 -25.979 26.960 23.217 1.00 9.66 H new ATOM 0 HB3 ALA C 63 -26.060 27.462 21.717 1.00 9.66 H new ATOM 2578 N ILE C 64 -24.217 24.745 20.432 1.00 9.25 N ATOM 2579 CA ILE C 64 -23.976 24.099 19.107 1.00 9.60 C ATOM 2580 C ILE C 64 -25.345 23.668 18.611 1.00 9.92 C ATOM 2581 O ILE C 64 -26.042 22.994 19.324 1.00 10.59 O ATOM 2582 CB ILE C 64 -23.123 22.827 19.271 1.00 8.34 C ATOM 2583 CG1 ILE C 64 -21.807 23.096 20.057 1.00 12.32 C ATOM 2584 CG2 ILE C 64 -22.907 22.096 17.929 1.00 10.54 C ATOM 2585 CD1 ILE C 64 -20.855 24.040 19.422 1.00 13.43 C ATOM 0 H ILE C 64 -24.582 24.221 21.008 1.00 9.25 H new ATOM 0 HA ILE C 64 -23.518 24.708 18.507 1.00 9.60 H new ATOM 0 HB ILE C 64 -23.629 22.211 19.823 1.00 8.34 H new ATOM 0 HG12 ILE C 64 -22.039 23.439 20.934 1.00 12.32 H new ATOM 0 HG13 ILE C 64 -21.354 22.250 20.194 1.00 12.32 H new ATOM 0 HG21 ILE C 64 -22.367 21.304 18.075 1.00 10.54 H new ATOM 0 HG22 ILE C 64 -23.766 21.838 17.559 1.00 10.54 H new ATOM 0 HG23 ILE C 64 -22.452 22.686 17.308 1.00 10.54 H new ATOM 0 HD11 ILE C 64 -20.073 24.139 19.987 1.00 13.43 H new ATOM 0 HD12 ILE C 64 -20.587 23.696 18.556 1.00 13.43 H new ATOM 0 HD13 ILE C 64 -21.283 24.903 19.308 1.00 13.43 H new ATOM 2586 N GLY C 65 -25.728 24.088 17.405 1.00 9.43 N ATOM 2587 CA GLY C 65 -27.011 23.713 16.831 1.00 9.41 C ATOM 2588 C GLY C 65 -26.728 22.844 15.614 1.00 8.74 C ATOM 2589 O GLY C 65 -25.635 22.925 15.047 1.00 9.84 O ATOM 0 H GLY C 65 -25.251 24.596 16.902 1.00 9.43 H new ATOM 0 HA2 GLY C 65 -27.547 23.229 17.479 1.00 9.41 H new ATOM 0 HA3 GLY C 65 -27.516 24.502 16.578 1.00 9.41 H new ATOM 2590 N GLU C 66 -27.658 21.969 15.249 1.00 9.00 N ATOM 2591 CA GLU C 66 -27.449 21.120 14.038 1.00 9.24 C ATOM 2592 C GLU C 66 -28.752 20.788 13.360 1.00 9.45 C ATOM 2593 O GLU C 66 -29.732 20.439 14.033 1.00 8.55 O ATOM 2594 CB GLU C 66 -26.677 19.812 14.359 1.00 10.00 C ATOM 2595 CG GLU C 66 -26.270 19.002 13.104 1.00 10.23 C ATOM 2596 CD GLU C 66 -25.183 17.936 13.365 1.00 11.60 C ATOM 2597 OE1 GLU C 66 -24.809 17.751 14.553 1.00 11.86 O ATOM 2598 OE2 GLU C 66 -24.715 17.281 12.377 1.00 9.11 O ATOM 0 H GLU C 66 -28.401 21.841 15.663 1.00 9.00 H new ATOM 0 HA GLU C 66 -26.906 21.648 13.432 1.00 9.24 H new ATOM 0 HB2 GLU C 66 -25.879 20.033 14.864 1.00 10.00 H new ATOM 0 HB3 GLU C 66 -27.228 19.253 14.930 1.00 10.00 H new ATOM 0 HG2 GLU C 66 -27.058 18.565 12.744 1.00 10.23 H new ATOM 0 HG3 GLU C 66 -25.950 19.616 12.424 1.00 10.23 H new ATOM 2599 N CYS C 67 -28.779 20.870 12.012 1.00 8.98 N ATOM 2600 CA CYS C 67 -30.016 20.506 11.273 1.00 8.87 C ATOM 2601 C CYS C 67 -29.671 19.368 10.312 1.00 9.13 C ATOM 2602 O CYS C 67 -28.585 19.368 9.744 1.00 8.84 O ATOM 2603 CB CYS C 67 -30.507 21.703 10.465 1.00 8.36 C ATOM 2604 SG CYS C 67 -31.167 23.004 11.468 1.00 12.05 S ATOM 0 H CYS C 67 -28.120 21.124 11.522 1.00 8.98 H new ATOM 0 HA CYS C 67 -30.709 20.237 11.896 1.00 8.87 H new ATOM 0 HB2 CYS C 67 -29.772 22.052 9.937 1.00 8.36 H new ATOM 0 HB3 CYS C 67 -31.189 21.407 9.842 1.00 8.36 H new ATOM 0 HG CYS C 67 -31.529 23.907 10.765 1.00 12.05 H new ATOM 2605 N TRP C 68 -30.585 18.408 10.144 1.00 9.85 N ATOM 2606 CA TRP C 68 -30.453 17.314 9.204 1.00 9.54 C ATOM 2607 C TRP C 68 -31.612 17.397 8.177 1.00 10.38 C ATOM 2608 O TRP C 68 -32.743 17.641 8.579 1.00 11.80 O ATOM 2609 CB TRP C 68 -30.623 15.972 9.942 1.00 8.80 C ATOM 2610 CG TRP C 68 -29.477 15.415 10.780 1.00 9.01 C ATOM 2611 CD1 TRP C 68 -28.676 14.318 10.487 1.00 12.16 C ATOM 2612 CD2 TRP C 68 -29.101 15.846 12.092 1.00 9.45 C ATOM 2613 NE1 TRP C 68 -27.796 14.092 11.544 1.00 12.44 N ATOM 2614 CE2 TRP C 68 -28.035 15.020 12.526 1.00 11.76 C ATOM 2615 CE3 TRP C 68 -29.566 16.880 12.957 1.00 8.08 C ATOM 2616 CZ2 TRP C 68 -27.441 15.175 13.790 1.00 9.66 C ATOM 2617 CZ3 TRP C 68 -28.945 17.040 14.192 1.00 7.15 C ATOM 2618 CH2 TRP C 68 -27.914 16.180 14.593 1.00 7.43 C ATOM 0 H TRP C 68 -31.319 18.383 10.592 1.00 9.85 H new ATOM 0 HA TRP C 68 -29.584 17.371 8.777 1.00 9.54 H new ATOM 0 HB2 TRP C 68 -31.392 16.059 10.526 1.00 8.80 H new ATOM 0 HB3 TRP C 68 -30.846 15.303 9.277 1.00 8.80 H new ATOM 0 HD1 TRP C 68 -28.720 13.813 9.707 1.00 12.16 H new ATOM 0 HE1 TRP C 68 -27.201 13.472 11.576 1.00 12.44 H new ATOM 0 HE3 TRP C 68 -30.268 17.434 12.702 1.00 8.08 H new ATOM 0 HZ2 TRP C 68 -26.753 14.616 14.071 1.00 9.66 H new ATOM 0 HZ3 TRP C 68 -29.217 17.726 14.758 1.00 7.15 H new ATOM 0 HH2 TRP C 68 -27.537 16.295 15.435 1.00 7.43 H new ATOM 2619 N PHE C 69 -31.338 17.246 6.874 1.00 10.33 N ATOM 2620 CA PHE C 69 -32.401 17.184 5.848 1.00 10.92 C ATOM 2621 C PHE C 69 -32.167 15.920 4.986 1.00 11.78 C ATOM 2622 O PHE C 69 -31.030 15.633 4.587 1.00 11.40 O ATOM 2623 CB PHE C 69 -32.332 18.422 4.952 1.00 10.55 C ATOM 2624 CG PHE C 69 -32.231 19.690 5.715 1.00 9.60 C ATOM 2625 CD1 PHE C 69 -33.402 20.353 6.148 1.00 10.03 C ATOM 2626 CD2 PHE C 69 -30.987 20.207 6.053 1.00 10.99 C ATOM 2627 CE1 PHE C 69 -33.299 21.555 6.940 1.00 11.32 C ATOM 2628 CE2 PHE C 69 -30.868 21.392 6.816 1.00 10.91 C ATOM 2629 CZ PHE C 69 -32.043 22.082 7.248 1.00 10.66 C ATOM 0 H PHE C 69 -30.541 17.177 6.559 1.00 10.33 H new ATOM 0 HA PHE C 69 -33.271 17.151 6.275 1.00 10.92 H new ATOM 0 HB2 PHE C 69 -31.566 18.345 4.362 1.00 10.55 H new ATOM 0 HB3 PHE C 69 -33.122 18.452 4.390 1.00 10.55 H new ATOM 0 HD1 PHE C 69 -34.238 20.015 5.923 1.00 10.03 H new ATOM 0 HD2 PHE C 69 -30.218 19.766 5.772 1.00 10.99 H new ATOM 0 HE1 PHE C 69 -34.069 21.978 7.245 1.00 11.32 H new ATOM 0 HE2 PHE C 69 -30.027 21.722 7.036 1.00 10.91 H new ATOM 0 HZ PHE C 69 -31.972 22.874 7.730 1.00 10.66 H new ATOM 2630 N ALA C 70 -33.233 15.208 4.679 1.00 11.89 N ATOM 2631 CA ALA C 70 -33.113 13.874 4.048 1.00 12.94 C ATOM 2632 C ALA C 70 -32.805 13.982 2.570 1.00 12.78 C ATOM 2633 O ALA C 70 -32.342 13.011 1.980 1.00 12.90 O ATOM 2634 CB ALA C 70 -34.448 13.073 4.219 1.00 13.87 C ATOM 0 H ALA C 70 -34.041 15.465 4.821 1.00 11.89 H new ATOM 0 HA ALA C 70 -32.383 13.413 4.489 1.00 12.94 H new ATOM 0 HB1 ALA C 70 -34.358 12.202 3.802 1.00 13.87 H new ATOM 0 HB2 ALA C 70 -34.640 12.961 5.163 1.00 13.87 H new ATOM 0 HB3 ALA C 70 -35.174 13.559 3.797 1.00 13.87 H new ATOM 2635 N SER C 71 -33.030 15.144 1.973 1.00 11.57 N ATOM 2636 CA SER C 71 -32.829 15.338 0.488 1.00 13.13 C ATOM 2637 C SER C 71 -32.777 16.806 0.140 1.00 12.41 C ATOM 2638 O SER C 71 -33.145 17.663 0.951 1.00 10.78 O ATOM 2639 CB SER C 71 -33.980 14.736 -0.324 1.00 12.52 C ATOM 2640 OG SER C 71 -35.213 15.435 -0.030 1.00 13.39 O ATOM 0 H SER C 71 -33.300 15.848 2.387 1.00 11.57 H new ATOM 0 HA SER C 71 -31.994 14.895 0.270 1.00 13.13 H new ATOM 0 HB2 SER C 71 -33.783 14.797 -1.272 1.00 12.52 H new ATOM 0 HB3 SER C 71 -34.076 13.794 -0.114 1.00 12.52 H new ATOM 0 HG SER C 71 -35.865 14.921 -0.159 1.00 13.39 H new ATOM 2641 N GLU C 72 -32.317 17.110 -1.072 1.00 12.43 N ATOM 2642 CA GLU C 72 -32.364 18.480 -1.577 1.00 13.32 C ATOM 2643 C GLU C 72 -33.803 18.960 -1.640 1.00 12.03 C ATOM 2644 O GLU C 72 -34.068 20.113 -1.336 1.00 12.25 O ATOM 2645 CB GLU C 72 -31.770 18.616 -2.993 1.00 13.14 C ATOM 2646 CG GLU C 72 -30.356 18.202 -3.052 1.00 18.40 C ATOM 2647 CD GLU C 72 -29.739 18.366 -4.408 1.00 22.66 C ATOM 2648 OE1 GLU C 72 -30.393 18.849 -5.396 1.00 24.19 O ATOM 2649 OE2 GLU C 72 -28.563 17.958 -4.488 1.00 23.80 O ATOM 0 H GLU C 72 -31.975 16.539 -1.616 1.00 12.43 H new ATOM 0 HA GLU C 72 -31.834 19.013 -0.963 1.00 13.32 H new ATOM 0 HB2 GLU C 72 -32.288 18.077 -3.611 1.00 13.14 H new ATOM 0 HB3 GLU C 72 -31.847 19.537 -3.286 1.00 13.14 H new ATOM 0 HG2 GLU C 72 -29.848 18.721 -2.409 1.00 18.40 H new ATOM 0 HG3 GLU C 72 -30.288 17.272 -2.784 1.00 18.40 H new ATOM 2650 N GLU C 73 -34.738 18.081 -2.006 1.00 12.48 N ATOM 2651 CA GLU C 73 -36.131 18.545 -2.072 1.00 13.02 C ATOM 2652 C GLU C 73 -36.606 18.950 -0.659 1.00 14.08 C ATOM 2653 O GLU C 73 -37.269 19.990 -0.488 1.00 13.67 O ATOM 2654 CB GLU C 73 -37.060 17.469 -2.636 1.00 13.20 C ATOM 2655 CG GLU C 73 -36.799 17.152 -4.161 1.00 14.21 C ATOM 2656 CD GLU C 73 -35.769 16.044 -4.416 1.00 17.52 C ATOM 2657 OE1 GLU C 73 -34.983 15.706 -3.508 1.00 16.28 O ATOM 2658 OE2 GLU C 73 -35.767 15.488 -5.545 1.00 14.87 O ATOM 0 H GLU C 73 -34.602 17.257 -2.210 1.00 12.48 H new ATOM 0 HA GLU C 73 -36.164 19.309 -2.668 1.00 13.02 H new ATOM 0 HB2 GLU C 73 -36.952 16.655 -2.120 1.00 13.20 H new ATOM 0 HB3 GLU C 73 -37.980 17.755 -2.525 1.00 13.20 H new ATOM 0 HG2 GLU C 73 -37.639 16.898 -4.575 1.00 14.21 H new ATOM 0 HG3 GLU C 73 -36.500 17.963 -4.601 1.00 14.21 H new ATOM 2659 N GLN C 74 -36.270 18.128 0.340 1.00 13.00 N ATOM 2660 CA GLN C 74 -36.724 18.462 1.718 1.00 12.70 C ATOM 2661 C GLN C 74 -36.121 19.796 2.145 1.00 11.77 C ATOM 2662 O GLN C 74 -36.779 20.596 2.800 1.00 11.43 O ATOM 2663 CB GLN C 74 -36.381 17.352 2.715 1.00 12.81 C ATOM 2664 CG GLN C 74 -37.184 16.090 2.500 1.00 15.15 C ATOM 2665 CD GLN C 74 -38.663 16.414 2.318 1.00 23.59 C ATOM 2666 OE1 GLN C 74 -39.216 16.315 1.205 1.00 32.61 O ATOM 2667 NE2 GLN C 74 -39.283 16.872 3.369 1.00 18.73 N ATOM 0 H GLN C 74 -35.806 17.408 0.261 1.00 13.00 H new ATOM 0 HA GLN C 74 -37.691 18.540 1.712 1.00 12.70 H new ATOM 0 HB2 GLN C 74 -35.436 17.143 2.645 1.00 12.81 H new ATOM 0 HB3 GLN C 74 -36.534 17.676 3.616 1.00 12.81 H new ATOM 0 HG2 GLN C 74 -36.853 15.620 1.719 1.00 15.15 H new ATOM 0 HG3 GLN C 74 -37.070 15.496 3.258 1.00 15.15 H new ATOM 0 HE21 GLN C 74 -38.871 16.927 4.122 1.00 18.73 H new ATOM 0 HE22 GLN C 74 -40.104 17.119 3.310 1.00 18.73 H new ATOM 2668 N TYR C 75 -34.855 20.048 1.784 1.00 11.64 N ATOM 2669 CA TYR C 75 -34.273 21.335 2.105 1.00 11.62 C ATOM 2670 C TYR C 75 -35.016 22.474 1.452 1.00 11.23 C ATOM 2671 O TYR C 75 -35.169 23.544 2.082 1.00 10.58 O ATOM 2672 CB TYR C 75 -32.755 21.392 1.751 1.00 13.35 C ATOM 2673 CG TYR C 75 -32.106 22.694 2.191 1.00 14.13 C ATOM 2674 CD1 TYR C 75 -31.765 22.893 3.536 1.00 16.44 C ATOM 2675 CD2 TYR C 75 -31.821 23.723 1.283 1.00 17.35 C ATOM 2676 CE1 TYR C 75 -31.194 24.066 3.971 1.00 18.10 C ATOM 2677 CE2 TYR C 75 -31.222 24.920 1.728 1.00 17.93 C ATOM 2678 CZ TYR C 75 -30.922 25.067 3.072 1.00 15.38 C ATOM 2679 OH TYR C 75 -30.351 26.210 3.559 1.00 18.53 O ATOM 0 H TYR C 75 -34.339 19.501 1.367 1.00 11.64 H new ATOM 0 HA TYR C 75 -34.359 21.441 3.065 1.00 11.62 H new ATOM 0 HB2 TYR C 75 -32.299 20.647 2.173 1.00 13.35 H new ATOM 0 HB3 TYR C 75 -32.645 21.286 0.793 1.00 13.35 H new ATOM 0 HD1 TYR C 75 -31.929 22.214 4.150 1.00 16.44 H new ATOM 0 HD2 TYR C 75 -32.028 23.616 0.383 1.00 17.35 H new ATOM 0 HE1 TYR C 75 -30.993 24.181 4.872 1.00 18.10 H new ATOM 0 HE2 TYR C 75 -31.031 25.603 1.126 1.00 17.93 H new ATOM 0 HH TYR C 75 -29.953 26.040 4.279 1.00 18.53 H new ATOM 2680 N GLN C 76 -35.465 22.309 0.204 1.00 9.97 N ATOM 2681 CA GLN C 76 -36.297 23.398 -0.439 1.00 10.75 C ATOM 2682 C GLN C 76 -37.597 23.639 0.302 1.00 10.19 C ATOM 2683 O GLN C 76 -38.005 24.801 0.501 1.00 8.93 O ATOM 2684 CB GLN C 76 -36.638 23.090 -1.922 1.00 11.09 C ATOM 2685 CG GLN C 76 -37.459 24.229 -2.624 1.00 14.81 C ATOM 2686 CD GLN C 76 -37.676 23.978 -4.128 1.00 18.00 C ATOM 2687 OE1 GLN C 76 -36.840 23.356 -4.784 1.00 18.62 O ATOM 2688 NE2 GLN C 76 -38.799 24.433 -4.654 1.00 15.25 N ATOM 0 H GLN C 76 -35.320 21.617 -0.286 1.00 9.97 H new ATOM 0 HA GLN C 76 -35.744 24.194 -0.395 1.00 10.75 H new ATOM 0 HB2 GLN C 76 -35.814 22.945 -2.413 1.00 11.09 H new ATOM 0 HB3 GLN C 76 -37.143 22.263 -1.965 1.00 11.09 H new ATOM 0 HG2 GLN C 76 -38.321 24.314 -2.188 1.00 14.81 H new ATOM 0 HG3 GLN C 76 -36.997 25.073 -2.506 1.00 14.81 H new ATOM 0 HE21 GLN C 76 -39.360 24.864 -4.164 1.00 15.25 H new ATOM 0 HE22 GLN C 76 -38.969 24.299 -5.486 1.00 15.25 H new ATOM 2689 N VAL C 77 -38.288 22.539 0.607 1.00 9.42 N ATOM 2690 CA VAL C 77 -39.562 22.604 1.370 1.00 9.50 C ATOM 2691 C VAL C 77 -39.367 23.409 2.659 1.00 9.78 C ATOM 2692 O VAL C 77 -40.204 24.287 3.028 1.00 9.22 O ATOM 2693 CB VAL C 77 -40.052 21.191 1.670 1.00 9.73 C ATOM 2694 CG1 VAL C 77 -41.196 21.197 2.692 1.00 10.11 C ATOM 2695 CG2 VAL C 77 -40.589 20.498 0.405 1.00 10.25 C ATOM 0 H VAL C 77 -38.046 21.744 0.387 1.00 9.42 H new ATOM 0 HA VAL C 77 -40.235 23.055 0.837 1.00 9.50 H new ATOM 0 HB VAL C 77 -39.283 20.714 2.020 1.00 9.73 H new ATOM 0 HG11 VAL C 77 -41.484 20.286 2.861 1.00 10.11 H new ATOM 0 HG12 VAL C 77 -40.888 21.597 3.520 1.00 10.11 H new ATOM 0 HG13 VAL C 77 -41.940 21.712 2.342 1.00 10.11 H new ATOM 0 HG21 VAL C 77 -40.892 19.604 0.629 1.00 10.25 H new ATOM 0 HG22 VAL C 77 -41.331 21.010 0.046 1.00 10.25 H new ATOM 0 HG23 VAL C 77 -39.883 20.443 -0.258 1.00 10.25 H new ATOM 2696 N TYR C 78 -38.287 23.071 3.366 1.00 9.34 N ATOM 2697 CA TYR C 78 -37.917 23.754 4.626 1.00 9.95 C ATOM 2698 C TYR C 78 -37.699 25.224 4.369 1.00 9.70 C ATOM 2699 O TYR C 78 -38.282 26.073 5.051 1.00 10.49 O ATOM 2700 CB TYR C 78 -36.646 23.091 5.159 1.00 10.19 C ATOM 2701 CG TYR C 78 -35.878 23.771 6.278 1.00 8.62 C ATOM 2702 CD1 TYR C 78 -36.264 23.598 7.604 1.00 12.09 C ATOM 2703 CD2 TYR C 78 -34.691 24.493 6.003 1.00 10.35 C ATOM 2704 CE1 TYR C 78 -35.506 24.138 8.633 1.00 11.05 C ATOM 2705 CE2 TYR C 78 -33.916 25.051 7.027 1.00 8.62 C ATOM 2706 CZ TYR C 78 -34.349 24.867 8.336 1.00 12.73 C ATOM 2707 OH TYR C 78 -33.601 25.406 9.351 1.00 13.23 O ATOM 0 H TYR C 78 -37.746 22.443 3.136 1.00 9.34 H new ATOM 0 HA TYR C 78 -38.626 23.676 5.284 1.00 9.95 H new ATOM 0 HB2 TYR C 78 -36.885 22.202 5.465 1.00 10.19 H new ATOM 0 HB3 TYR C 78 -36.038 22.979 4.412 1.00 10.19 H new ATOM 0 HD1 TYR C 78 -37.035 23.117 7.802 1.00 12.09 H new ATOM 0 HD2 TYR C 78 -34.419 24.599 5.120 1.00 10.35 H new ATOM 0 HE1 TYR C 78 -35.766 24.016 9.518 1.00 11.05 H new ATOM 0 HE2 TYR C 78 -33.140 25.527 6.839 1.00 8.62 H new ATOM 0 HH TYR C 78 -33.529 26.235 9.237 1.00 13.23 H new ATOM 2708 N MET C 79 -36.902 25.565 3.359 1.00 10.16 N ATOM 2709 CA MET C 79 -36.679 26.993 3.050 1.00 12.09 C ATOM 2710 C MET C 79 -37.974 27.739 2.662 1.00 11.61 C ATOM 2711 O MET C 79 -38.109 28.922 2.954 1.00 10.68 O ATOM 2712 CB MET C 79 -35.597 27.168 1.957 1.00 11.95 C ATOM 2713 CG MET C 79 -34.165 26.741 2.382 1.00 16.57 C ATOM 2714 SD MET C 79 -33.636 27.625 3.879 1.00 23.28 S ATOM 2715 CE MET C 79 -33.664 29.317 3.324 1.00 17.19 C ATOM 0 H MET C 79 -36.488 25.010 2.849 1.00 10.16 H new ATOM 0 HA MET C 79 -36.360 27.399 3.871 1.00 12.09 H new ATOM 0 HB2 MET C 79 -35.857 26.652 1.178 1.00 11.95 H new ATOM 0 HB3 MET C 79 -35.576 28.099 1.687 1.00 11.95 H new ATOM 0 HG2 MET C 79 -34.144 25.785 2.543 1.00 16.57 H new ATOM 0 HG3 MET C 79 -33.543 26.921 1.660 1.00 16.57 H new ATOM 0 HE1 MET C 79 -33.178 29.872 3.954 1.00 17.19 H new ATOM 0 HE2 MET C 79 -33.247 29.378 2.450 1.00 17.19 H new ATOM 0 HE3 MET C 79 -34.582 29.623 3.265 1.00 17.19 H new ATOM 2716 N GLU C 80 -38.954 27.060 2.039 1.00 12.05 N ATOM 2717 CA GLU C 80 -40.234 27.745 1.655 1.00 12.25 C ATOM 2718 C GLU C 80 -41.221 27.954 2.801 1.00 13.11 C ATOM 2719 O GLU C 80 -42.205 28.709 2.662 1.00 11.89 O ATOM 2720 CB GLU C 80 -40.991 26.946 0.548 1.00 11.93 C ATOM 2721 CG GLU C 80 -40.224 26.864 -0.742 1.00 11.73 C ATOM 2722 CD GLU C 80 -40.777 25.845 -1.750 1.00 11.76 C ATOM 2723 OE1 GLU C 80 -41.528 24.902 -1.388 1.00 10.31 O ATOM 2724 OE2 GLU C 80 -40.418 25.998 -2.935 1.00 12.40 O ATOM 0 H GLU C 80 -38.912 26.227 1.830 1.00 12.05 H new ATOM 0 HA GLU C 80 -39.942 28.616 1.344 1.00 12.25 H new ATOM 0 HB2 GLU C 80 -41.171 26.049 0.869 1.00 11.93 H new ATOM 0 HB3 GLU C 80 -41.850 27.366 0.382 1.00 11.93 H new ATOM 0 HG2 GLU C 80 -40.217 27.741 -1.157 1.00 11.73 H new ATOM 0 HG3 GLU C 80 -39.302 26.637 -0.543 1.00 11.73 H new ATOM 2725 N SER C 81 -40.987 27.263 3.907 1.00 13.29 N ATOM 2726 CA SER C 81 -42.007 27.132 4.986 1.00 13.23 C ATOM 2727 C SER C 81 -42.216 28.372 5.836 1.00 13.41 C ATOM 2728 O SER C 81 -41.254 28.903 6.413 1.00 13.07 O ATOM 2729 CB SER C 81 -41.606 25.976 5.908 1.00 13.17 C ATOM 2730 OG SER C 81 -42.363 25.982 7.110 1.00 14.04 O ATOM 0 H SER C 81 -40.247 26.855 4.069 1.00 13.29 H new ATOM 0 HA SER C 81 -42.849 26.975 4.530 1.00 13.23 H new ATOM 0 HB2 SER C 81 -41.736 25.133 5.447 1.00 13.17 H new ATOM 0 HB3 SER C 81 -40.661 26.041 6.119 1.00 13.17 H new ATOM 0 HG SER C 81 -43.118 25.642 6.968 1.00 14.04 H new ATOM 2731 N ASP C 82 -43.473 28.834 5.945 1.00 13.72 N ATOM 2732 CA ASP C 82 -43.792 29.987 6.823 1.00 13.39 C ATOM 2733 C ASP C 82 -43.457 29.720 8.297 1.00 12.57 C ATOM 2734 O ASP C 82 -43.032 30.627 9.024 1.00 11.38 O ATOM 2735 CB ASP C 82 -45.290 30.275 6.800 1.00 14.10 C ATOM 2736 CG ASP C 82 -45.768 30.846 5.486 1.00 16.50 C ATOM 2737 OD1 ASP C 82 -44.970 31.451 4.767 1.00 17.54 O ATOM 2738 OD2 ASP C 82 -46.978 30.673 5.225 1.00 21.64 O ATOM 0 H ASP C 82 -44.148 28.503 5.528 1.00 13.72 H new ATOM 0 HA ASP C 82 -43.262 30.724 6.481 1.00 13.39 H new ATOM 0 HB2 ASP C 82 -45.774 29.455 6.984 1.00 14.10 H new ATOM 0 HB3 ASP C 82 -45.505 30.897 7.513 1.00 14.10 H new ATOM 2739 N ILE C 83 -43.665 28.490 8.760 1.00 12.57 N ATOM 2740 CA ILE C 83 -43.365 28.222 10.162 1.00 12.64 C ATOM 2741 C ILE C 83 -41.859 28.214 10.400 1.00 12.75 C ATOM 2742 O ILE C 83 -41.402 28.559 11.498 1.00 10.69 O ATOM 2743 CB ILE C 83 -44.078 26.915 10.729 1.00 12.34 C ATOM 2744 CG1 ILE C 83 -44.047 26.885 12.267 1.00 14.43 C ATOM 2745 CG2 ILE C 83 -43.470 25.639 10.166 1.00 12.11 C ATOM 2746 CD1 ILE C 83 -45.000 27.903 12.962 1.00 14.84 C ATOM 0 H ILE C 83 -43.965 27.825 8.304 1.00 12.57 H new ATOM 0 HA ILE C 83 -43.746 28.953 10.673 1.00 12.64 H new ATOM 0 HB ILE C 83 -45.002 26.955 10.437 1.00 12.34 H new ATOM 0 HG12 ILE C 83 -44.277 25.991 12.565 1.00 14.43 H new ATOM 0 HG13 ILE C 83 -43.139 27.058 12.563 1.00 14.43 H new ATOM 0 HG21 ILE C 83 -43.931 24.870 10.536 1.00 12.11 H new ATOM 0 HG22 ILE C 83 -43.560 25.636 9.200 1.00 12.11 H new ATOM 0 HG23 ILE C 83 -42.530 25.596 10.403 1.00 12.11 H new ATOM 0 HD11 ILE C 83 -44.918 27.818 13.925 1.00 14.84 H new ATOM 0 HD12 ILE C 83 -44.760 28.805 12.696 1.00 14.84 H new ATOM 0 HD13 ILE C 83 -45.916 27.721 12.698 1.00 14.84 H new ATOM 2747 N ARG C 84 -41.098 27.789 9.391 1.00 13.16 N ATOM 2748 CA ARG C 84 -39.650 27.881 9.480 1.00 12.92 C ATOM 2749 C ARG C 84 -39.212 29.329 9.567 1.00 12.62 C ATOM 2750 O ARG C 84 -38.373 29.681 10.384 1.00 11.03 O ATOM 2751 CB ARG C 84 -38.917 27.185 8.325 1.00 14.72 C ATOM 2752 CG ARG C 84 -37.407 27.288 8.578 1.00 14.61 C ATOM 2753 CD ARG C 84 -36.500 27.516 7.432 1.00 19.86 C ATOM 2754 NE ARG C 84 -36.899 28.450 6.382 1.00 18.53 N ATOM 2755 CZ ARG C 84 -36.463 29.690 6.226 1.00 20.07 C ATOM 2756 NH1 ARG C 84 -35.682 30.265 7.131 1.00 19.84 N ATOM 2757 NH2 ARG C 84 -36.854 30.366 5.152 1.00 17.84 N ATOM 0 H ARG C 84 -41.398 27.450 8.660 1.00 13.16 H new ATOM 0 HA ARG C 84 -39.404 27.410 10.292 1.00 12.92 H new ATOM 0 HB2 ARG C 84 -39.187 26.255 8.266 1.00 14.72 H new ATOM 0 HB3 ARG C 84 -39.147 27.601 7.480 1.00 14.72 H new ATOM 0 HG2 ARG C 84 -37.265 28.009 9.211 1.00 14.61 H new ATOM 0 HG3 ARG C 84 -37.127 26.468 9.014 1.00 14.61 H new ATOM 0 HD2 ARG C 84 -35.651 27.822 7.788 1.00 19.86 H new ATOM 0 HD3 ARG C 84 -36.338 26.657 7.012 1.00 19.86 H new ATOM 0 HE ARG C 84 -37.474 28.166 5.809 1.00 18.53 H new ATOM 0 HH11 ARG C 84 -35.449 29.831 7.836 1.00 19.84 H new ATOM 0 HH12 ARG C 84 -35.408 31.072 7.013 1.00 19.84 H new ATOM 0 HH21 ARG C 84 -37.378 29.997 4.579 1.00 17.84 H new ATOM 0 HH22 ARG C 84 -36.583 31.173 5.030 1.00 17.84 H new ATOM 2758 N LYS C 85 -39.811 30.203 8.764 1.00 12.48 N ATOM 2759 CA LYS C 85 -39.456 31.616 8.842 1.00 12.12 C ATOM 2760 C LYS C 85 -39.761 32.162 10.238 1.00 12.28 C ATOM 2761 O LYS C 85 -38.976 32.941 10.776 1.00 13.65 O ATOM 2762 CB LYS C 85 -40.232 32.400 7.769 1.00 13.02 C ATOM 2763 CG LYS C 85 -39.699 32.142 6.374 1.00 14.69 C ATOM 2764 CD LYS C 85 -40.548 32.780 5.241 1.00 17.81 C ATOM 2765 CE LYS C 85 -40.128 32.076 3.910 1.00 17.64 C ATOM 2766 NZ LYS C 85 -40.983 32.483 2.695 1.00 19.08 N ATOM 0 H LYS C 85 -40.411 30.006 8.181 1.00 12.48 H new ATOM 0 HA LYS C 85 -38.505 31.718 8.679 1.00 12.12 H new ATOM 0 HB2 LYS C 85 -41.170 32.154 7.806 1.00 13.02 H new ATOM 0 HB3 LYS C 85 -40.180 33.349 7.963 1.00 13.02 H new ATOM 0 HG2 LYS C 85 -38.793 32.483 6.317 1.00 14.69 H new ATOM 0 HG3 LYS C 85 -39.651 31.184 6.229 1.00 14.69 H new ATOM 0 HD2 LYS C 85 -41.495 32.658 5.411 1.00 17.81 H new ATOM 0 HD3 LYS C 85 -40.390 33.736 5.189 1.00 17.81 H new ATOM 0 HE2 LYS C 85 -39.198 32.282 3.724 1.00 17.64 H new ATOM 0 HE3 LYS C 85 -40.187 31.115 4.029 1.00 17.64 H new ATOM 0 HZ1 LYS C 85 -40.581 32.218 1.947 1.00 19.08 H new ATOM 0 HZ2 LYS C 85 -41.784 32.099 2.753 1.00 19.08 H new ATOM 0 HZ3 LYS C 85 -41.079 33.368 2.682 1.00 19.08 H new ATOM 2767 N ALA C 86 -40.874 31.747 10.837 1.00 12.51 N ATOM 2768 CA ALA C 86 -41.251 32.201 12.198 1.00 12.44 C ATOM 2769 C ALA C 86 -40.260 31.598 13.206 1.00 12.60 C ATOM 2770 O ALA C 86 -39.864 32.264 14.147 1.00 12.30 O ATOM 2771 CB ALA C 86 -42.705 31.775 12.530 1.00 12.18 C ATOM 0 H ALA C 86 -41.434 31.200 10.480 1.00 12.51 H new ATOM 0 HA ALA C 86 -41.213 33.169 12.245 1.00 12.44 H new ATOM 0 HB1 ALA C 86 -42.936 32.079 13.422 1.00 12.18 H new ATOM 0 HB2 ALA C 86 -43.313 32.171 11.886 1.00 12.18 H new ATOM 0 HB3 ALA C 86 -42.776 30.808 12.490 1.00 12.18 H new ATOM 2772 N TRP C 87 -39.863 30.340 13.010 1.00 11.64 N ATOM 2773 CA TRP C 87 -38.817 29.736 13.871 1.00 11.43 C ATOM 2774 C TRP C 87 -37.535 30.541 13.815 1.00 11.13 C ATOM 2775 O TRP C 87 -36.930 30.795 14.874 1.00 11.70 O ATOM 2776 CB TRP C 87 -38.578 28.298 13.393 1.00 10.84 C ATOM 2777 CG TRP C 87 -37.724 27.396 14.256 1.00 12.64 C ATOM 2778 CD1 TRP C 87 -37.844 27.140 15.614 1.00 11.57 C ATOM 2779 CD2 TRP C 87 -36.706 26.509 13.770 1.00 11.13 C ATOM 2780 NE1 TRP C 87 -36.900 26.196 15.997 1.00 11.09 N ATOM 2781 CE2 TRP C 87 -36.203 25.782 14.891 1.00 10.56 C ATOM 2782 CE3 TRP C 87 -36.154 26.274 12.497 1.00 9.96 C ATOM 2783 CZ2 TRP C 87 -35.166 24.834 14.779 1.00 10.06 C ATOM 2784 CZ3 TRP C 87 -35.125 25.322 12.374 1.00 10.10 C ATOM 2785 CH2 TRP C 87 -34.620 24.628 13.516 1.00 10.14 C ATOM 0 H TRP C 87 -40.174 29.821 12.399 1.00 11.64 H new ATOM 0 HA TRP C 87 -39.112 29.735 14.795 1.00 11.43 H new ATOM 0 HB2 TRP C 87 -39.443 27.873 13.284 1.00 10.84 H new ATOM 0 HB3 TRP C 87 -38.171 28.341 12.514 1.00 10.84 H new ATOM 0 HD1 TRP C 87 -38.463 27.540 16.182 1.00 11.57 H new ATOM 0 HE1 TRP C 87 -36.773 25.916 16.800 1.00 11.09 H new ATOM 0 HE3 TRP C 87 -36.463 26.738 11.753 1.00 9.96 H new ATOM 0 HZ2 TRP C 87 -34.859 24.364 15.521 1.00 10.06 H new ATOM 0 HZ3 TRP C 87 -34.767 25.141 11.535 1.00 10.10 H new ATOM 0 HH2 TRP C 87 -33.916 24.029 13.414 1.00 10.14 H new ATOM 2786 N PHE C 88 -37.099 30.958 12.614 1.00 11.23 N ATOM 2787 CA PHE C 88 -35.916 31.852 12.486 1.00 12.16 C ATOM 2788 C PHE C 88 -36.106 33.200 13.199 1.00 12.50 C ATOM 2789 O PHE C 88 -35.124 33.781 13.679 1.00 12.82 O ATOM 2790 CB PHE C 88 -35.443 32.082 11.021 1.00 12.32 C ATOM 2791 CG PHE C 88 -34.609 30.927 10.418 1.00 11.40 C ATOM 2792 CD1 PHE C 88 -34.968 29.602 10.606 1.00 15.24 C ATOM 2793 CD2 PHE C 88 -33.519 31.199 9.628 1.00 16.84 C ATOM 2794 CE1 PHE C 88 -34.228 28.562 10.037 1.00 15.81 C ATOM 2795 CE2 PHE C 88 -32.775 30.177 9.057 1.00 20.18 C ATOM 2796 CZ PHE C 88 -33.118 28.858 9.266 1.00 14.68 C ATOM 0 H PHE C 88 -37.465 30.741 11.867 1.00 11.23 H new ATOM 0 HA PHE C 88 -35.209 31.364 12.936 1.00 12.16 H new ATOM 0 HB2 PHE C 88 -36.222 32.227 10.462 1.00 12.32 H new ATOM 0 HB3 PHE C 88 -34.916 32.896 10.989 1.00 12.32 H new ATOM 0 HD1 PHE C 88 -35.716 29.401 11.121 1.00 15.24 H new ATOM 0 HD2 PHE C 88 -33.276 32.083 9.473 1.00 16.84 H new ATOM 0 HE1 PHE C 88 -34.480 27.678 10.176 1.00 15.81 H new ATOM 0 HE2 PHE C 88 -32.038 30.383 8.528 1.00 20.18 H new ATOM 0 HZ PHE C 88 -32.609 28.175 8.893 1.00 14.68 H new ATOM 2797 N GLU C 89 -37.341 33.710 13.268 1.00 13.61 N ATOM 2798 CA GLU C 89 -37.602 34.943 14.056 1.00 14.69 C ATOM 2799 C GLU C 89 -37.331 34.693 15.541 1.00 13.79 C ATOM 2800 O GLU C 89 -36.794 35.576 16.237 1.00 13.48 O ATOM 2801 CB GLU C 89 -39.024 35.482 13.840 1.00 16.26 C ATOM 2802 CG GLU C 89 -39.232 35.998 12.368 1.00 20.32 C ATOM 2803 CD GLU C 89 -38.174 37.020 11.970 1.00 25.36 C ATOM 2804 OE1 GLU C 89 -38.016 38.020 12.678 1.00 28.78 O ATOM 2805 OE2 GLU C 89 -37.463 36.819 10.969 1.00 30.83 O ATOM 0 H GLU C 89 -38.031 33.374 12.880 1.00 13.61 H new ATOM 0 HA GLU C 89 -36.992 35.626 13.737 1.00 14.69 H new ATOM 0 HB2 GLU C 89 -39.668 34.783 14.032 1.00 16.26 H new ATOM 0 HB3 GLU C 89 -39.195 36.205 14.464 1.00 16.26 H new ATOM 0 HG2 GLU C 89 -39.202 35.247 11.755 1.00 20.32 H new ATOM 0 HG3 GLU C 89 -40.113 36.396 12.287 1.00 20.32 H new ATOM 2806 N HIS C 90 -37.639 33.486 16.013 1.00 12.33 N ATOM 2807 CA HIS C 90 -37.210 33.113 17.371 1.00 12.59 C ATOM 2808 C HIS C 90 -35.688 33.085 17.484 1.00 13.28 C ATOM 2809 O HIS C 90 -35.147 33.594 18.496 1.00 12.81 O ATOM 2810 CB HIS C 90 -37.885 31.831 17.910 1.00 12.54 C ATOM 2811 CG HIS C 90 -37.451 31.473 19.296 1.00 12.32 C ATOM 2812 ND1 HIS C 90 -36.635 30.395 19.566 1.00 11.40 N ATOM 2813 CD2 HIS C 90 -37.650 32.105 20.480 1.00 15.26 C ATOM 2814 CE1 HIS C 90 -36.402 30.342 20.863 1.00 13.94 C ATOM 2815 NE2 HIS C 90 -36.968 31.392 21.434 1.00 14.84 N ATOM 0 H HIS C 90 -38.080 32.884 15.585 1.00 12.33 H new ATOM 0 HA HIS C 90 -37.528 33.814 17.961 1.00 12.59 H new ATOM 0 HB2 HIS C 90 -38.848 31.951 17.900 1.00 12.54 H new ATOM 0 HB3 HIS C 90 -37.685 31.092 17.314 1.00 12.54 H new ATOM 0 HD1 HIS C 90 -36.327 29.845 18.981 1.00 11.40 H new ATOM 0 HD2 HIS C 90 -38.153 32.875 20.619 1.00 15.26 H new ATOM 0 HE1 HIS C 90 -35.921 29.678 21.302 1.00 13.94 H new ATOM 0 HE2 HIS C 90 -36.917 31.595 22.268 1.00 14.84 H new ATOM 2816 N GLY C 91 -35.012 32.534 16.456 1.00 12.51 N ATOM 2817 CA GLY C 91 -33.545 32.580 16.342 1.00 13.11 C ATOM 2818 C GLY C 91 -32.974 33.980 16.501 1.00 14.66 C ATOM 2819 O GLY C 91 -31.980 34.165 17.195 1.00 14.33 O ATOM 0 H GLY C 91 -35.397 32.123 15.806 1.00 12.51 H new ATOM 0 HA2 GLY C 91 -33.156 32.000 17.015 1.00 13.11 H new ATOM 0 HA3 GLY C 91 -33.283 32.227 15.478 1.00 13.11 H new ATOM 2820 N LYS C 92 -33.592 34.956 15.845 1.00 14.63 N ATOM 2821 CA ALYS C 92 -33.127 36.331 15.926 0.50 16.14 C ATOM 2822 CA BLYS C 92 -33.170 36.360 15.924 0.50 16.44 C ATOM 2823 C LYS C 92 -33.150 36.904 17.353 1.00 16.75 C ATOM 2824 O LYS C 92 -32.323 37.777 17.700 1.00 18.21 O ATOM 2825 CB ALYS C 92 -33.888 37.202 14.929 0.50 16.05 C ATOM 2826 CB BLYS C 92 -34.065 37.259 15.065 0.50 16.49 C ATOM 2827 CG ALYS C 92 -33.650 36.731 13.499 0.50 17.96 C ATOM 2828 CG BLYS C 92 -33.660 37.356 13.611 0.50 19.99 C ATOM 2829 CD ALYS C 92 -34.345 37.598 12.445 0.50 19.84 C ATOM 2830 CD BLYS C 92 -34.305 38.580 12.955 0.50 22.26 C ATOM 2831 CE ALYS C 92 -33.874 37.179 11.060 0.50 19.46 C ATOM 2832 CE BLYS C 92 -34.636 38.327 11.485 0.50 24.22 C ATOM 2833 NZ ALYS C 92 -33.759 35.707 11.021 0.50 22.52 N ATOM 2834 NZ BLYS C 92 -35.563 39.367 10.969 0.50 24.24 N ATOM 0 H ALYS C 92 -34.284 34.841 15.347 0.50 14.63 H new ATOM 0 H BLYS C 92 -34.273 34.826 15.337 0.50 14.63 H new ATOM 0 HA ALYS C 92 -32.189 36.334 15.679 0.50 16.44 H new ATOM 0 HA BLYS C 92 -32.261 36.375 15.585 0.50 16.44 H new ATOM 0 HB2ALYS C 92 -34.837 37.174 15.129 0.50 16.49 H new ATOM 0 HB2BLYS C 92 -34.975 36.927 15.112 0.50 16.49 H new ATOM 0 HB3ALYS C 92 -33.606 38.126 15.020 0.50 16.49 H new ATOM 0 HB3BLYS C 92 -34.068 38.151 15.447 0.50 16.49 H new ATOM 0 HG2ALYS C 92 -32.696 36.724 13.323 0.50 19.99 H new ATOM 0 HG2BLYS C 92 -32.694 37.417 13.542 0.50 19.99 H new ATOM 0 HG3ALYS C 92 -33.961 35.817 13.411 0.50 19.99 H new ATOM 0 HG3BLYS C 92 -33.928 36.551 13.141 0.50 19.99 H new ATOM 0 HD2ALYS C 92 -35.308 37.500 12.514 0.50 22.26 H new ATOM 0 HD2BLYS C 92 -35.116 38.814 13.434 0.50 22.26 H new ATOM 0 HD3ALYS C 92 -34.143 38.535 12.597 0.50 22.26 H new ATOM 0 HD3BLYS C 92 -33.705 39.339 13.026 0.50 22.26 H new ATOM 0 HE2ALYS C 92 -34.500 37.485 10.386 0.50 24.22 H new ATOM 0 HE2BLYS C 92 -33.820 38.326 10.961 0.50 24.22 H new ATOM 0 HE3ALYS C 92 -33.018 37.588 10.858 0.50 24.22 H new ATOM 0 HE3BLYS C 92 -35.039 37.450 11.386 0.50 24.22 H new ATOM 0 HZ1ALYS C 92 -33.801 35.428 10.177 0.50 24.24 H new ATOM 0 HZ1BLYS C 92 -35.745 39.205 10.113 0.50 24.24 H new ATOM 0 HZ2ALYS C 92 -32.981 35.460 11.376 0.50 24.24 H new ATOM 0 HZ2BLYS C 92 -36.318 39.352 11.440 0.50 24.24 H new ATOM 0 HZ3ALYS C 92 -34.426 35.345 11.486 0.50 24.24 H new ATOM 0 HZ3BLYS C 92 -35.182 40.168 11.044 0.50 24.24 H new ATOM 2835 N TYR C 93 -34.076 36.410 18.159 1.00 17.21 N ATOM 2836 CA TYR C 93 -34.230 36.812 19.539 1.00 17.75 C ATOM 2837 C TYR C 93 -33.170 36.192 20.471 1.00 17.29 C ATOM 2838 O TYR C 93 -32.643 36.891 21.337 1.00 18.38 O ATOM 2839 CB TYR C 93 -35.635 36.447 20.022 1.00 17.64 C ATOM 2840 CG TYR C 93 -35.847 36.613 21.537 1.00 20.76 C ATOM 2841 CD1 TYR C 93 -35.710 37.852 22.150 1.00 23.10 C ATOM 2842 CD2 TYR C 93 -36.219 35.531 22.335 1.00 23.14 C ATOM 2843 CE1 TYR C 93 -35.903 38.005 23.539 1.00 24.25 C ATOM 2844 CE2 TYR C 93 -36.437 35.681 23.716 1.00 24.86 C ATOM 2845 CZ TYR C 93 -36.273 36.926 24.298 1.00 26.90 C ATOM 2846 OH TYR C 93 -36.487 37.080 25.646 1.00 29.27 O ATOM 0 H TYR C 93 -34.646 35.816 17.909 1.00 17.21 H new ATOM 0 HA TYR C 93 -34.100 37.773 19.575 1.00 17.75 H new ATOM 0 HB2 TYR C 93 -36.280 36.999 19.553 1.00 17.64 H new ATOM 0 HB3 TYR C 93 -35.820 35.526 19.779 1.00 17.64 H new ATOM 0 HD1 TYR C 93 -35.487 38.594 21.635 1.00 23.10 H new ATOM 0 HD2 TYR C 93 -36.325 34.693 21.946 1.00 23.14 H new ATOM 0 HE1 TYR C 93 -35.779 38.836 23.938 1.00 24.25 H new ATOM 0 HE2 TYR C 93 -36.689 34.951 24.233 1.00 24.86 H new ATOM 0 HH TYR C 93 -36.707 36.342 25.981 1.00 29.27 H new ATOM 2847 N PHE C 94 -32.847 34.903 20.313 1.00 15.71 N ATOM 2848 CA PHE C 94 -31.927 34.249 21.284 1.00 14.57 C ATOM 2849 C PHE C 94 -30.522 33.936 20.760 1.00 14.41 C ATOM 2850 O PHE C 94 -29.625 33.545 21.531 1.00 14.38 O ATOM 2851 CB PHE C 94 -32.569 33.016 21.960 1.00 14.11 C ATOM 2852 CG PHE C 94 -32.374 31.704 21.208 1.00 14.89 C ATOM 2853 CD1 PHE C 94 -31.374 30.792 21.605 1.00 14.52 C ATOM 2854 CD2 PHE C 94 -33.157 31.408 20.081 1.00 12.12 C ATOM 2855 CE1 PHE C 94 -31.173 29.600 20.905 1.00 12.58 C ATOM 2856 CE2 PHE C 94 -32.967 30.239 19.356 1.00 14.18 C ATOM 2857 CZ PHE C 94 -32.004 29.303 19.770 1.00 12.16 C ATOM 0 H PHE C 94 -33.132 34.398 19.678 1.00 15.71 H new ATOM 0 HA PHE C 94 -31.786 34.931 21.959 1.00 14.57 H new ATOM 0 HB2 PHE C 94 -32.199 32.922 22.852 1.00 14.11 H new ATOM 0 HB3 PHE C 94 -33.520 33.177 22.063 1.00 14.11 H new ATOM 0 HD1 PHE C 94 -30.842 30.987 22.342 1.00 14.52 H new ATOM 0 HD2 PHE C 94 -33.816 32.007 19.814 1.00 12.12 H new ATOM 0 HE1 PHE C 94 -30.509 29.005 21.170 1.00 12.58 H new ATOM 0 HE2 PHE C 94 -33.477 30.075 18.596 1.00 14.18 H new ATOM 0 HZ PHE C 94 -31.905 28.499 19.314 1.00 12.16 H new ATOM 2858 N ILE C 95 -30.314 34.129 19.463 1.00 13.03 N ATOM 2859 CA ILE C 95 -28.980 33.978 18.883 1.00 12.94 C ATOM 2860 C ILE C 95 -28.349 35.305 18.467 1.00 12.42 C ATOM 2861 O ILE C 95 -28.780 35.902 17.493 1.00 13.79 O ATOM 2862 CB ILE C 95 -28.992 33.042 17.658 1.00 12.19 C ATOM 2863 CG1 ILE C 95 -29.682 31.717 18.056 1.00 13.05 C ATOM 2864 CG2 ILE C 95 -27.552 32.825 17.158 1.00 11.90 C ATOM 2865 CD1 ILE C 95 -30.037 30.752 16.919 1.00 10.25 C ATOM 0 H ILE C 95 -30.928 34.347 18.901 1.00 13.03 H new ATOM 0 HA ILE C 95 -28.444 33.592 19.593 1.00 12.94 H new ATOM 0 HB ILE C 95 -29.492 33.435 16.926 1.00 12.19 H new ATOM 0 HG12 ILE C 95 -29.103 31.250 18.679 1.00 13.05 H new ATOM 0 HG13 ILE C 95 -30.498 31.933 18.535 1.00 13.05 H new ATOM 0 HG21 ILE C 95 -27.562 32.236 16.387 1.00 11.90 H new ATOM 0 HG22 ILE C 95 -27.164 33.678 16.907 1.00 11.90 H new ATOM 0 HG23 ILE C 95 -27.021 32.424 17.864 1.00 11.90 H new ATOM 0 HD11 ILE C 95 -30.462 29.961 17.286 1.00 10.25 H new ATOM 0 HD12 ILE C 95 -30.645 31.188 16.302 1.00 10.25 H new ATOM 0 HD13 ILE C 95 -29.229 30.495 16.448 1.00 10.25 H new ATOM 2866 N GLY C 96 -27.318 35.742 19.178 1.00 12.76 N ATOM 2867 CA GLY C 96 -26.617 37.003 18.821 1.00 12.70 C ATOM 2868 C GLY C 96 -25.703 36.944 17.604 1.00 14.48 C ATOM 2869 O GLY C 96 -25.669 37.880 16.775 1.00 13.74 O ATOM 0 H GLY C 96 -27.000 35.338 19.867 1.00 12.76 H new ATOM 0 HA2 GLY C 96 -27.285 37.690 18.668 1.00 12.70 H new ATOM 0 HA3 GLY C 96 -26.090 37.285 19.585 1.00 12.70 H new ATOM 2870 N GLN C 97 -24.926 35.860 17.490 1.00 14.01 N ATOM 2871 CA GLN C 97 -24.053 35.639 16.342 1.00 14.43 C ATOM 2872 C GLN C 97 -24.061 34.152 15.980 1.00 13.52 C ATOM 2873 O GLN C 97 -24.251 33.308 16.841 1.00 11.54 O ATOM 2874 CB GLN C 97 -22.598 36.058 16.633 1.00 14.92 C ATOM 2875 CG GLN C 97 -22.378 37.515 17.072 1.00 16.86 C ATOM 2876 CD GLN C 97 -20.987 37.706 17.646 1.00 21.45 C ATOM 2877 OE1 GLN C 97 -20.027 37.908 16.916 1.00 21.90 O ATOM 2878 NE2 GLN C 97 -20.877 37.639 18.961 1.00 22.01 N ATOM 0 H GLN C 97 -24.894 35.235 18.079 1.00 14.01 H new ATOM 0 HA GLN C 97 -24.389 36.181 15.611 1.00 14.43 H new ATOM 0 HB2 GLN C 97 -22.247 35.476 17.325 1.00 14.92 H new ATOM 0 HB3 GLN C 97 -22.071 35.899 15.835 1.00 14.92 H new ATOM 0 HG2 GLN C 97 -22.503 38.107 16.314 1.00 16.86 H new ATOM 0 HG3 GLN C 97 -23.042 37.760 17.736 1.00 16.86 H new ATOM 0 HE21 GLN C 97 -21.574 37.495 19.444 1.00 22.01 H new ATOM 0 HE22 GLN C 97 -20.109 37.739 19.334 1.00 22.01 H new ATOM 2879 N LEU C 98 -23.788 33.847 14.708 1.00 13.77 N ATOM 2880 CA LEU C 98 -24.027 32.489 14.199 1.00 14.29 C ATOM 2881 C LEU C 98 -22.971 32.122 13.190 1.00 13.67 C ATOM 2882 O LEU C 98 -22.680 32.919 12.325 1.00 14.59 O ATOM 2883 CB LEU C 98 -25.419 32.428 13.521 1.00 14.69 C ATOM 2884 CG LEU C 98 -25.930 31.081 13.042 1.00 16.11 C ATOM 2885 CD1 LEU C 98 -25.977 30.114 14.212 1.00 19.40 C ATOM 2886 CD2 LEU C 98 -27.345 31.192 12.413 1.00 17.08 C ATOM 0 H LEU C 98 -23.470 34.400 14.131 1.00 13.77 H new ATOM 0 HA LEU C 98 -23.993 31.865 14.941 1.00 14.29 H new ATOM 0 HB2 LEU C 98 -26.068 32.785 14.147 1.00 14.69 H new ATOM 0 HB3 LEU C 98 -25.402 33.026 12.758 1.00 14.69 H new ATOM 0 HG LEU C 98 -25.322 30.758 12.359 1.00 16.11 H new ATOM 0 HD11 LEU C 98 -26.303 29.253 13.907 1.00 19.40 H new ATOM 0 HD12 LEU C 98 -25.086 30.009 14.582 1.00 19.40 H new ATOM 0 HD13 LEU C 98 -26.571 30.461 14.895 1.00 19.40 H new ATOM 0 HD21 LEU C 98 -27.638 30.315 12.119 1.00 17.08 H new ATOM 0 HD22 LEU C 98 -27.967 31.536 13.073 1.00 17.08 H new ATOM 0 HD23 LEU C 98 -27.315 31.794 11.653 1.00 17.08 H new ATOM 2887 N LYS C 99 -22.390 30.926 13.305 1.00 12.12 N ATOM 2888 CA LYS C 99 -21.465 30.392 12.293 1.00 12.13 C ATOM 2889 C LYS C 99 -22.029 29.064 11.780 1.00 12.53 C ATOM 2890 O LYS C 99 -22.044 28.074 12.559 1.00 12.47 O ATOM 2891 CB LYS C 99 -20.058 30.154 12.862 1.00 12.03 C ATOM 2892 CG LYS C 99 -19.068 29.387 11.910 1.00 13.10 C ATOM 2893 CD LYS C 99 -18.775 30.128 10.584 1.00 13.60 C ATOM 2894 CE LYS C 99 -17.951 29.232 9.622 1.00 14.99 C ATOM 2895 NZ LYS C 99 -17.565 29.965 8.360 1.00 17.36 N ATOM 0 H LYS C 99 -22.520 30.399 13.972 1.00 12.12 H new ATOM 0 HA LYS C 99 -21.385 31.043 11.579 1.00 12.13 H new ATOM 0 HB2 LYS C 99 -19.667 31.013 13.087 1.00 12.03 H new ATOM 0 HB3 LYS C 99 -20.140 29.654 13.689 1.00 12.03 H new ATOM 0 HG2 LYS C 99 -18.232 29.238 12.379 1.00 13.10 H new ATOM 0 HG3 LYS C 99 -19.439 28.514 11.707 1.00 13.10 H new ATOM 0 HD2 LYS C 99 -19.609 30.383 10.160 1.00 13.60 H new ATOM 0 HD3 LYS C 99 -18.288 30.947 10.767 1.00 13.60 H new ATOM 0 HE2 LYS C 99 -17.150 28.924 10.074 1.00 14.99 H new ATOM 0 HE3 LYS C 99 -18.468 28.444 9.392 1.00 14.99 H new ATOM 0 HZ1 LYS C 99 -17.185 29.396 7.791 1.00 17.36 H new ATOM 0 HZ2 LYS C 99 -18.292 30.316 7.986 1.00 17.36 H new ATOM 0 HZ3 LYS C 99 -16.990 30.615 8.558 1.00 17.36 H new ATOM 2896 N PRO C 100 -22.487 29.022 10.509 1.00 11.78 N ATOM 2897 CA PRO C 100 -22.945 27.770 9.872 1.00 11.73 C ATOM 2898 C PRO C 100 -21.815 27.005 9.170 1.00 12.13 C ATOM 2899 O PRO C 100 -20.943 27.629 8.551 1.00 12.08 O ATOM 2900 CB PRO C 100 -23.929 28.252 8.806 1.00 10.72 C ATOM 2901 CG PRO C 100 -24.100 29.779 9.062 1.00 13.03 C ATOM 2902 CD PRO C 100 -22.816 30.204 9.678 1.00 11.65 C ATOM 0 HA PRO C 100 -23.313 27.163 10.533 1.00 11.73 H new ATOM 0 HB2 PRO C 100 -23.588 28.083 7.914 1.00 10.72 H new ATOM 0 HB3 PRO C 100 -24.778 27.788 8.878 1.00 10.72 H new ATOM 0 HG2 PRO C 100 -24.270 30.258 8.236 1.00 13.03 H new ATOM 0 HG3 PRO C 100 -24.849 29.956 9.652 1.00 13.03 H new ATOM 0 HD2 PRO C 100 -22.133 30.385 9.013 1.00 11.65 H new ATOM 0 HD3 PRO C 100 -22.914 31.009 10.210 1.00 11.65 H new ATOM 2903 N PHE C 101 -21.798 25.672 9.298 1.00 10.79 N ATOM 2904 CA PHE C 101 -20.879 24.844 8.517 1.00 10.52 C ATOM 2905 C PHE C 101 -21.764 23.847 7.795 1.00 10.85 C ATOM 2906 O PHE C 101 -22.415 23.022 8.443 1.00 10.84 O ATOM 2907 CB PHE C 101 -19.940 23.991 9.393 1.00 10.11 C ATOM 2908 CG PHE C 101 -19.091 24.770 10.328 1.00 11.04 C ATOM 2909 CD1 PHE C 101 -17.963 25.448 9.873 1.00 9.24 C ATOM 2910 CD2 PHE C 101 -19.369 24.762 11.695 1.00 10.81 C ATOM 2911 CE1 PHE C 101 -17.128 26.159 10.780 1.00 8.49 C ATOM 2912 CE2 PHE C 101 -18.538 25.447 12.613 1.00 13.75 C ATOM 2913 CZ PHE C 101 -17.435 26.163 12.157 1.00 12.11 C ATOM 0 H PHE C 101 -22.310 25.232 9.831 1.00 10.79 H new ATOM 0 HA PHE C 101 -20.339 25.422 7.956 1.00 10.52 H new ATOM 0 HB2 PHE C 101 -20.475 23.365 9.906 1.00 10.11 H new ATOM 0 HB3 PHE C 101 -19.366 23.466 8.814 1.00 10.11 H new ATOM 0 HD1 PHE C 101 -17.753 25.436 8.967 1.00 9.24 H new ATOM 0 HD2 PHE C 101 -20.112 24.299 12.008 1.00 10.81 H new ATOM 0 HE1 PHE C 101 -16.383 26.619 10.466 1.00 8.49 H new ATOM 0 HE2 PHE C 101 -18.729 25.419 13.523 1.00 13.75 H new ATOM 0 HZ PHE C 101 -16.905 26.640 12.755 1.00 12.11 H new ATOM 2914 N VAL C 102 -21.777 23.881 6.463 1.00 10.46 N ATOM 2915 CA VAL C 102 -22.359 22.785 5.734 1.00 10.95 C ATOM 2916 C VAL C 102 -21.334 21.629 5.688 1.00 10.15 C ATOM 2917 O VAL C 102 -20.191 21.786 5.193 1.00 10.78 O ATOM 2918 CB VAL C 102 -22.784 23.219 4.301 1.00 12.94 C ATOM 2919 CG1 VAL C 102 -23.493 22.004 3.553 1.00 13.78 C ATOM 2920 CG2 VAL C 102 -23.700 24.443 4.413 1.00 14.92 C ATOM 0 H VAL C 102 -21.459 24.519 5.981 1.00 10.46 H new ATOM 0 HA VAL C 102 -23.165 22.488 6.184 1.00 10.95 H new ATOM 0 HB VAL C 102 -22.008 23.464 3.773 1.00 12.94 H new ATOM 0 HG11 VAL C 102 -23.755 22.281 2.661 1.00 13.78 H new ATOM 0 HG12 VAL C 102 -22.876 21.258 3.491 1.00 13.78 H new ATOM 0 HG13 VAL C 102 -24.280 21.732 4.051 1.00 13.78 H new ATOM 0 HG21 VAL C 102 -23.973 24.725 3.526 1.00 14.92 H new ATOM 0 HG22 VAL C 102 -24.485 24.213 4.935 1.00 14.92 H new ATOM 0 HG23 VAL C 102 -23.222 25.166 4.849 1.00 14.92 H new ATOM 2921 N THR C 103 -21.730 20.468 6.188 1.00 9.68 N ATOM 2922 CA THR C 103 -20.787 19.383 6.266 1.00 9.97 C ATOM 2923 C THR C 103 -20.888 18.371 5.123 1.00 12.15 C ATOM 2924 O THR C 103 -21.841 18.382 4.327 1.00 12.57 O ATOM 2925 CB THR C 103 -20.811 18.683 7.677 1.00 10.13 C ATOM 2926 OG1 THR C 103 -22.074 18.049 7.891 1.00 8.99 O ATOM 2927 CG2 THR C 103 -20.555 19.717 8.802 1.00 8.86 C ATOM 0 H THR C 103 -22.521 20.296 6.479 1.00 9.68 H new ATOM 0 HA THR C 103 -19.918 19.799 6.154 1.00 9.97 H new ATOM 0 HB THR C 103 -20.108 18.015 7.697 1.00 10.13 H new ATOM 0 HG1 THR C 103 -22.692 18.578 7.681 1.00 8.99 H new ATOM 0 HG21 THR C 103 -20.573 19.270 9.663 1.00 8.86 H new ATOM 0 HG22 THR C 103 -19.687 20.130 8.671 1.00 8.86 H new ATOM 0 HG23 THR C 103 -21.244 20.399 8.778 1.00 8.86 H new ATOM 2928 N GLU C 104 -19.888 17.516 5.027 1.00 11.48 N ATOM 2929 CA GLU C 104 -19.895 16.463 4.026 1.00 13.72 C ATOM 2930 C GLU C 104 -19.410 15.196 4.706 1.00 14.23 C ATOM 2931 O GLU C 104 -18.361 15.208 5.379 1.00 13.84 O ATOM 2932 CB GLU C 104 -18.951 16.830 2.874 1.00 14.06 C ATOM 2933 CG GLU C 104 -18.582 15.663 1.978 1.00 19.00 C ATOM 2934 CD GLU C 104 -17.693 16.069 0.803 1.00 26.23 C ATOM 2935 OE1 GLU C 104 -17.364 17.267 0.645 1.00 29.64 O ATOM 2936 OE2 GLU C 104 -17.329 15.177 0.021 1.00 28.46 O ATOM 0 H GLU C 104 -19.192 17.526 5.533 1.00 11.48 H new ATOM 0 HA GLU C 104 -20.785 16.341 3.660 1.00 13.72 H new ATOM 0 HB2 GLU C 104 -19.368 17.520 2.335 1.00 14.06 H new ATOM 0 HB3 GLU C 104 -18.139 17.211 3.243 1.00 14.06 H new ATOM 0 HG2 GLU C 104 -18.125 14.989 2.505 1.00 19.00 H new ATOM 0 HG3 GLU C 104 -19.393 15.254 1.637 1.00 19.00 H new ATOM 2937 N GLU C 105 -20.139 14.098 4.493 1.00 14.53 N ATOM 2938 CA GLU C 105 -19.729 12.791 4.987 1.00 16.63 C ATOM 2939 C GLU C 105 -18.539 12.242 4.225 1.00 17.28 C ATOM 2940 O GLU C 105 -18.336 12.518 3.038 1.00 15.67 O ATOM 2941 CB GLU C 105 -20.851 11.746 4.909 1.00 17.62 C ATOM 2942 CG GLU C 105 -22.119 12.128 5.616 1.00 20.51 C ATOM 2943 CD GLU C 105 -21.914 12.285 7.101 1.00 24.64 C ATOM 2944 OE1 GLU C 105 -21.031 11.575 7.684 1.00 24.65 O ATOM 2945 OE2 GLU C 105 -22.614 13.134 7.672 1.00 23.43 O ATOM 0 H GLU C 105 -20.882 14.094 4.059 1.00 14.53 H new ATOM 0 HA GLU C 105 -19.492 12.942 5.916 1.00 16.63 H new ATOM 0 HB2 GLU C 105 -21.054 11.578 3.976 1.00 17.62 H new ATOM 0 HB3 GLU C 105 -20.526 10.912 5.283 1.00 17.62 H new ATOM 0 HG2 GLU C 105 -22.456 12.960 5.247 1.00 20.51 H new ATOM 0 HG3 GLU C 105 -22.795 11.452 5.454 1.00 20.51 H new ATOM 2946 N LEU C 106 -17.764 11.442 4.943 1.00 18.14 N ATOM 2947 CA LEU C 106 -16.499 10.894 4.431 1.00 18.95 C ATOM 2948 C LEU C 106 -16.550 9.394 4.404 1.00 20.24 C ATOM 2949 O LEU C 106 -15.810 8.736 3.668 1.00 20.17 O ATOM 2950 CB LEU C 106 -15.379 11.346 5.357 1.00 19.16 C ATOM 2951 CG LEU C 106 -15.137 12.861 5.201 1.00 18.55 C ATOM 2952 CD1 LEU C 106 -13.965 13.277 6.045 1.00 21.92 C ATOM 2953 CD2 LEU C 106 -14.863 13.163 3.746 1.00 21.79 C ATOM 0 H LEU C 106 -17.951 11.196 5.746 1.00 18.14 H new ATOM 0 HA LEU C 106 -16.347 11.211 3.527 1.00 18.95 H new ATOM 0 HB2 LEU C 106 -15.609 11.142 6.277 1.00 19.16 H new ATOM 0 HB3 LEU C 106 -14.565 10.859 5.153 1.00 19.16 H new ATOM 0 HG LEU C 106 -15.920 13.353 5.493 1.00 18.55 H new ATOM 0 HD11 LEU C 106 -13.816 14.230 5.944 1.00 21.92 H new ATOM 0 HD12 LEU C 106 -14.149 13.075 6.976 1.00 21.92 H new ATOM 0 HD13 LEU C 106 -13.173 12.794 5.760 1.00 21.92 H new ATOM 0 HD21 LEU C 106 -14.709 14.114 3.636 1.00 21.79 H new ATOM 0 HD22 LEU C 106 -14.078 12.673 3.456 1.00 21.79 H new ATOM 0 HD23 LEU C 106 -15.626 12.895 3.210 1.00 21.79 H new ATOM 2954 N VAL C 107 -17.384 8.838 5.262 1.00 21.32 N ATOM 2955 CA VAL C 107 -17.481 7.406 5.331 1.00 24.28 C ATOM 2956 C VAL C 107 -18.937 7.047 5.334 1.00 25.18 C ATOM 2957 O VAL C 107 -19.801 7.872 5.619 1.00 25.94 O ATOM 2958 CB VAL C 107 -16.770 6.813 6.575 1.00 24.56 C ATOM 2959 CG1 VAL C 107 -15.215 6.947 6.480 1.00 23.44 C ATOM 2960 CG2 VAL C 107 -17.330 7.428 7.856 1.00 24.93 C ATOM 2961 OXT VAL C 107 -19.277 5.907 5.066 1.00 27.01 O ATOM 0 H VAL C 107 -17.894 9.269 5.804 1.00 21.32 H new ATOM 0 HA VAL C 107 -17.029 7.025 4.562 1.00 24.28 H new ATOM 0 HB VAL C 107 -16.955 5.861 6.602 1.00 24.56 H new ATOM 0 HG11 VAL C 107 -14.808 6.566 7.274 1.00 23.44 H new ATOM 0 HG12 VAL C 107 -14.897 6.474 5.695 1.00 23.44 H new ATOM 0 HG13 VAL C 107 -14.974 7.884 6.412 1.00 23.44 H new ATOM 0 HG21 VAL C 107 -16.875 7.047 8.624 1.00 24.93 H new ATOM 0 HG22 VAL C 107 -17.191 8.388 7.842 1.00 24.93 H new ATOM 0 HG23 VAL C 107 -18.280 7.240 7.917 1.00 24.93 H new TER 2962 VAL C 107 ATOM 2963 N ARG D 0 29.485 28.009 37.620 1.00 37.95 N ATOM 2964 CA ARG D 0 29.907 28.180 36.195 1.00 36.66 C ATOM 2965 C ARG D 0 28.688 28.570 35.313 1.00 34.18 C ATOM 2966 O ARG D 0 27.742 29.186 35.823 1.00 35.11 O ATOM 2967 CB ARG D 0 30.634 26.930 35.690 1.00 37.20 C ATOM 2968 CG ARG D 0 30.973 26.969 34.186 1.00 40.07 C ATOM 2969 CD ARG D 0 30.900 25.570 33.542 1.00 44.97 C ATOM 2970 NE ARG D 0 32.220 24.922 33.514 1.00 49.39 N ATOM 2971 CZ ARG D 0 32.441 23.606 33.411 1.00 51.59 C ATOM 2972 NH1 ARG D 0 31.431 22.753 33.333 1.00 52.39 N ATOM 2973 NH2 ARG D 0 33.687 23.138 33.398 1.00 52.22 N ATOM 0 H1 ARG D 0 30.019 28.487 38.147 1.00 37.95 H new ATOM 0 H2 ARG D 0 28.646 28.289 37.717 1.00 37.95 H new ATOM 0 H3 ARG D 0 29.539 27.150 37.845 1.00 37.95 H new ATOM 0 HA ARG D 0 30.543 28.910 36.135 1.00 36.66 H new ATOM 0 HB2 ARG D 0 31.455 26.818 36.195 1.00 37.20 H new ATOM 0 HB3 ARG D 0 30.083 26.152 35.868 1.00 37.20 H new ATOM 0 HG2 ARG D 0 30.358 27.566 33.732 1.00 40.07 H new ATOM 0 HG3 ARG D 0 31.864 27.334 34.065 1.00 40.07 H new ATOM 0 HD2 ARG D 0 30.277 25.016 34.037 1.00 44.97 H new ATOM 0 HD3 ARG D 0 30.556 25.646 32.638 1.00 44.97 H new ATOM 0 HE ARG D 0 32.910 25.433 33.569 1.00 49.39 H new ATOM 0 HH11 ARG D 0 30.621 23.043 33.348 1.00 52.39 H new ATOM 0 HH12 ARG D 0 31.585 21.909 33.267 1.00 52.39 H new ATOM 0 HH21 ARG D 0 34.351 23.681 33.456 1.00 52.22 H new ATOM 0 HH22 ARG D 0 33.828 22.292 33.332 1.00 52.22 H new ATOM 2974 N MET D 1 28.717 28.238 34.016 1.00 31.25 N ATOM 2975 CA MET D 1 27.789 28.871 33.050 1.00 27.93 C ATOM 2976 C MET D 1 26.430 28.170 32.948 1.00 25.24 C ATOM 2977 O MET D 1 26.341 26.984 32.556 1.00 24.90 O ATOM 2978 CB MET D 1 28.460 29.071 31.686 1.00 28.86 C ATOM 2979 CG MET D 1 27.774 30.084 30.796 1.00 29.44 C ATOM 2980 SD MET D 1 28.549 31.686 30.392 1.00 31.88 S ATOM 2981 CE MET D 1 29.882 31.202 29.292 1.00 35.16 C ATOM 0 H MET D 1 29.254 27.660 33.675 1.00 31.25 H new ATOM 0 HA MET D 1 27.582 29.750 33.404 1.00 27.93 H new ATOM 0 HB2 MET D 1 29.378 29.350 31.827 1.00 28.86 H new ATOM 0 HB3 MET D 1 28.490 28.219 31.224 1.00 28.86 H new ATOM 0 HG2 MET D 1 27.591 29.640 29.953 1.00 29.44 H new ATOM 0 HG3 MET D 1 26.917 30.282 31.204 1.00 29.44 H new ATOM 0 HE1 MET D 1 30.371 31.991 29.009 1.00 35.16 H new ATOM 0 HE2 MET D 1 30.483 30.599 29.757 1.00 35.16 H new ATOM 0 HE3 MET D 1 29.514 30.754 28.514 1.00 35.16 H new ATOM 2982 N ILE D 2 25.360 28.882 33.313 1.00 21.35 N ATOM 2983 CA ILE D 2 24.034 28.313 33.187 1.00 17.82 C ATOM 2984 C ILE D 2 23.666 28.272 31.702 1.00 15.79 C ATOM 2985 O ILE D 2 23.849 29.284 31.019 1.00 13.34 O ATOM 2986 CB ILE D 2 23.010 29.162 33.938 1.00 18.67 C ATOM 2987 CG1 ILE D 2 23.376 29.216 35.430 1.00 19.29 C ATOM 2988 CG2 ILE D 2 21.607 28.661 33.682 1.00 17.72 C ATOM 2989 CD1 ILE D 2 22.534 30.249 36.264 1.00 20.47 C ATOM 0 H ILE D 2 25.387 29.681 33.629 1.00 21.35 H new ATOM 0 HA ILE D 2 24.029 27.420 33.566 1.00 17.82 H new ATOM 0 HB ILE D 2 23.031 30.073 33.607 1.00 18.67 H new ATOM 0 HG12 ILE D 2 23.258 28.333 35.814 1.00 19.29 H new ATOM 0 HG13 ILE D 2 24.316 29.438 35.514 1.00 19.29 H new ATOM 0 HG21 ILE D 2 20.973 29.212 34.167 1.00 17.72 H new ATOM 0 HG22 ILE D 2 21.415 28.707 32.732 1.00 17.72 H new ATOM 0 HG23 ILE D 2 21.532 27.742 33.982 1.00 17.72 H new ATOM 0 HD11 ILE D 2 22.820 30.227 37.191 1.00 20.47 H new ATOM 0 HD12 ILE D 2 22.669 31.140 35.906 1.00 20.47 H new ATOM 0 HD13 ILE D 2 21.593 30.018 36.211 1.00 20.47 H new ATOM 2990 N ARG D 3 23.178 27.118 31.219 1.00 13.34 N ATOM 2991 CA ARG D 3 22.707 26.974 29.825 1.00 12.92 C ATOM 2992 C ARG D 3 21.333 26.350 29.768 1.00 11.90 C ATOM 2993 O ARG D 3 21.077 25.338 30.446 1.00 11.56 O ATOM 2994 CB ARG D 3 23.681 26.123 28.999 1.00 12.92 C ATOM 2995 CG ARG D 3 24.981 26.848 28.702 1.00 16.20 C ATOM 2996 CD ARG D 3 26.094 25.861 28.326 1.00 15.20 C ATOM 2997 NE ARG D 3 25.933 25.526 26.915 1.00 13.53 N ATOM 2998 CZ ARG D 3 26.721 24.712 26.232 1.00 14.40 C ATOM 2999 NH1 ARG D 3 27.793 24.171 26.799 1.00 13.63 N ATOM 3000 NH2 ARG D 3 26.458 24.488 24.957 1.00 10.23 N ATOM 0 H ARG D 3 23.110 26.399 31.686 1.00 13.34 H new ATOM 0 HA ARG D 3 22.662 27.867 29.449 1.00 12.92 H new ATOM 0 HB2 ARG D 3 23.874 25.302 29.478 1.00 12.92 H new ATOM 0 HB3 ARG D 3 23.257 25.871 28.164 1.00 12.92 H new ATOM 0 HG2 ARG D 3 24.845 27.477 27.977 1.00 16.20 H new ATOM 0 HG3 ARG D 3 25.251 27.364 29.478 1.00 16.20 H new ATOM 0 HD2 ARG D 3 26.966 26.255 28.485 1.00 15.20 H new ATOM 0 HD3 ARG D 3 26.040 25.062 28.874 1.00 15.20 H new ATOM 0 HE ARG D 3 25.275 25.886 26.495 1.00 13.53 H new ATOM 0 HH11 ARG D 3 27.981 24.349 27.619 1.00 13.63 H new ATOM 0 HH12 ARG D 3 28.299 23.643 26.346 1.00 13.63 H new ATOM 0 HH21 ARG D 3 25.783 24.869 24.584 1.00 10.23 H new ATOM 0 HH22 ARG D 3 26.961 23.961 24.500 1.00 10.23 H new ATOM 3001 N ILE D 4 20.457 26.937 28.947 1.00 10.47 N ATOM 3002 CA ILE D 4 19.122 26.423 28.710 1.00 9.88 C ATOM 3003 C ILE D 4 18.950 26.288 27.197 1.00 9.71 C ATOM 3004 O ILE D 4 19.124 27.253 26.481 1.00 8.68 O ATOM 3005 CB ILE D 4 17.996 27.378 29.211 1.00 9.87 C ATOM 3006 CG1 ILE D 4 18.261 27.822 30.678 1.00 11.08 C ATOM 3007 CG2 ILE D 4 16.627 26.680 29.039 1.00 9.49 C ATOM 3008 CD1 ILE D 4 17.188 28.748 31.268 1.00 12.64 C ATOM 0 H ILE D 4 20.632 27.656 28.509 1.00 10.47 H new ATOM 0 HA ILE D 4 19.040 25.585 29.192 1.00 9.88 H new ATOM 0 HB ILE D 4 17.988 28.189 28.679 1.00 9.87 H new ATOM 0 HG12 ILE D 4 18.331 27.031 31.235 1.00 11.08 H new ATOM 0 HG13 ILE D 4 19.119 28.274 30.717 1.00 11.08 H new ATOM 0 HG21 ILE D 4 15.922 27.269 29.349 1.00 9.49 H new ATOM 0 HG22 ILE D 4 16.485 26.472 28.102 1.00 9.49 H new ATOM 0 HG23 ILE D 4 16.614 25.860 29.558 1.00 9.49 H new ATOM 0 HD11 ILE D 4 17.425 28.978 32.180 1.00 12.64 H new ATOM 0 HD12 ILE D 4 17.130 29.557 30.735 1.00 12.64 H new ATOM 0 HD13 ILE D 4 16.330 28.295 31.262 1.00 12.64 H new ATOM 3009 N LEU D 5 18.659 25.071 26.749 1.00 9.81 N ATOM 3010 CA LEU D 5 18.448 24.750 25.345 1.00 10.96 C ATOM 3011 C LEU D 5 16.973 24.573 25.111 1.00 10.76 C ATOM 3012 O LEU D 5 16.278 24.058 25.996 1.00 11.02 O ATOM 3013 CB LEU D 5 19.123 23.410 25.040 1.00 11.71 C ATOM 3014 CG LEU D 5 19.035 23.113 23.510 1.00 14.26 C ATOM 3015 CD1 LEU D 5 20.412 23.163 22.858 1.00 15.77 C ATOM 3016 CD2 LEU D 5 18.440 21.785 23.362 1.00 18.13 C ATOM 0 H LEU D 5 18.577 24.391 27.269 1.00 9.81 H new ATOM 0 HA LEU D 5 18.809 25.457 24.787 1.00 10.96 H new ATOM 0 HB2 LEU D 5 20.051 23.434 25.321 1.00 11.71 H new ATOM 0 HB3 LEU D 5 18.693 22.700 25.542 1.00 11.71 H new ATOM 0 HG LEU D 5 18.493 23.785 23.067 1.00 14.26 H new ATOM 0 HD11 LEU D 5 20.328 22.975 21.910 1.00 15.77 H new ATOM 0 HD12 LEU D 5 20.796 24.045 22.980 1.00 15.77 H new ATOM 0 HD13 LEU D 5 20.989 22.500 23.269 1.00 15.77 H new ATOM 0 HD21 LEU D 5 18.369 21.565 22.420 1.00 18.13 H new ATOM 0 HD22 LEU D 5 18.999 21.128 23.806 1.00 18.13 H new ATOM 0 HD23 LEU D 5 17.556 21.780 23.762 1.00 18.13 H new ATOM 3017 N TYR D 6 16.486 25.021 23.944 1.00 10.04 N ATOM 3018 CA TYR D 6 15.056 25.044 23.649 1.00 10.46 C ATOM 3019 C TYR D 6 14.752 24.385 22.328 1.00 11.86 C ATOM 3020 O TYR D 6 15.451 24.662 21.358 1.00 10.84 O ATOM 3021 CB TYR D 6 14.534 26.465 23.490 1.00 10.41 C ATOM 3022 CG TYR D 6 14.687 27.304 24.731 1.00 12.27 C ATOM 3023 CD1 TYR D 6 13.686 27.320 25.706 1.00 12.31 C ATOM 3024 CD2 TYR D 6 15.827 28.071 24.926 1.00 13.25 C ATOM 3025 CE1 TYR D 6 13.800 28.120 26.853 1.00 14.25 C ATOM 3026 CE2 TYR D 6 15.977 28.856 26.099 1.00 15.73 C ATOM 3027 CZ TYR D 6 14.937 28.866 27.039 1.00 14.57 C ATOM 3028 OH TYR D 6 15.059 29.613 28.170 1.00 18.34 O ATOM 0 H TYR D 6 16.980 25.318 23.306 1.00 10.04 H new ATOM 0 HA TYR D 6 14.640 24.584 24.395 1.00 10.46 H new ATOM 0 HB2 TYR D 6 15.004 26.894 22.758 1.00 10.41 H new ATOM 0 HB3 TYR D 6 13.596 26.432 23.244 1.00 10.41 H new ATOM 0 HD1 TYR D 6 12.930 26.790 25.592 1.00 12.31 H new ATOM 0 HD2 TYR D 6 16.498 28.071 24.283 1.00 13.25 H new ATOM 0 HE1 TYR D 6 13.113 28.145 27.480 1.00 14.25 H new ATOM 0 HE2 TYR D 6 16.750 29.354 26.241 1.00 15.73 H new ATOM 0 HH TYR D 6 14.639 29.244 28.797 1.00 18.34 H new ATOM 3029 N LEU D 7 13.702 23.546 22.297 1.00 11.58 N ATOM 3030 CA LEU D 7 13.120 23.084 21.028 1.00 11.82 C ATOM 3031 C LEU D 7 11.982 24.016 20.666 1.00 11.30 C ATOM 3032 O LEU D 7 11.108 24.232 21.515 1.00 11.15 O ATOM 3033 CB LEU D 7 12.613 21.630 21.185 1.00 11.79 C ATOM 3034 CG LEU D 7 13.622 20.583 21.724 1.00 12.67 C ATOM 3035 CD1 LEU D 7 13.001 19.211 21.766 1.00 14.12 C ATOM 3036 CD2 LEU D 7 14.947 20.511 20.886 1.00 12.45 C ATOM 0 H LEU D 7 13.315 23.235 22.999 1.00 11.58 H new ATOM 0 HA LEU D 7 13.785 23.094 20.322 1.00 11.82 H new ATOM 0 HB2 LEU D 7 11.846 21.641 21.778 1.00 11.79 H new ATOM 0 HB3 LEU D 7 12.298 21.326 20.319 1.00 11.79 H new ATOM 0 HG LEU D 7 13.851 20.878 22.619 1.00 12.67 H new ATOM 0 HD11 LEU D 7 13.648 18.573 22.105 1.00 14.12 H new ATOM 0 HD12 LEU D 7 12.225 19.225 22.348 1.00 14.12 H new ATOM 0 HD13 LEU D 7 12.730 18.951 20.872 1.00 14.12 H new ATOM 0 HD21 LEU D 7 15.536 19.842 21.269 1.00 12.45 H new ATOM 0 HD22 LEU D 7 14.738 20.271 19.970 1.00 12.45 H new ATOM 0 HD23 LEU D 7 15.387 21.375 20.901 1.00 12.45 H new ATOM 3037 N LEU D 8 12.012 24.621 19.457 1.00 10.09 N ATOM 3038 CA ALEU D 8 10.954 25.543 19.004 0.50 9.84 C ATOM 3039 CA BLEU D 8 10.958 25.547 19.003 0.50 10.62 C ATOM 3040 C LEU D 8 10.118 24.942 17.881 1.00 10.15 C ATOM 3041 O LEU D 8 10.653 24.386 16.942 1.00 9.57 O ATOM 3042 CB ALEU D 8 11.556 26.842 18.455 0.50 8.22 C ATOM 3043 CB BLEU D 8 11.560 26.844 18.441 0.50 9.56 C ATOM 3044 CG ALEU D 8 12.057 27.910 19.421 0.50 6.58 C ATOM 3045 CG BLEU D 8 12.753 27.544 19.091 0.50 11.63 C ATOM 3046 CD1ALEU D 8 13.221 27.336 20.208 0.50 4.14 C ATOM 3047 CD1BLEU D 8 12.897 28.990 18.563 0.50 11.88 C ATOM 3048 CD2ALEU D 8 12.492 29.171 18.639 0.50 7.69 C ATOM 3049 CD2BLEU D 8 12.632 27.533 20.578 0.50 11.57 C ATOM 0 H ALEU D 8 12.644 24.506 18.885 0.50 10.09 H new ATOM 0 H BLEU D 8 12.643 24.503 18.884 0.50 10.09 H new ATOM 0 HA ALEU D 8 10.400 25.713 19.782 0.50 10.62 H new ATOM 0 HA BLEU D 8 10.410 25.724 19.784 0.50 10.62 H new ATOM 0 HB2ALEU D 8 12.300 26.597 17.882 0.50 9.56 H new ATOM 0 HB2BLEU D 8 11.814 26.658 17.524 0.50 9.56 H new ATOM 0 HB3ALEU D 8 10.886 27.255 17.888 0.50 9.56 H new ATOM 0 HB3BLEU D 8 10.840 27.493 18.410 0.50 9.56 H new ATOM 0 HG ALEU D 8 11.349 28.169 20.032 0.50 11.63 H new ATOM 0 HG BLEU D 8 13.555 27.054 18.851 0.50 11.63 H new ATOM 0 HD11ALEU D 8 13.553 28.004 20.829 0.50 11.88 H new ATOM 0 HD11BLEU D 8 13.658 29.415 18.987 0.50 11.88 H new ATOM 0 HD12ALEU D 8 12.925 26.555 20.701 0.50 11.88 H new ATOM 0 HD12BLEU D 8 13.031 28.972 17.602 0.50 11.88 H new ATOM 0 HD13ALEU D 8 13.931 27.082 19.598 0.50 11.88 H new ATOM 0 HD13BLEU D 8 12.092 29.491 18.767 0.50 11.88 H new ATOM 0 HD21ALEU D 8 12.809 29.844 19.261 0.50 11.57 H new ATOM 0 HD21BLEU D 8 13.398 27.982 20.969 0.50 11.57 H new ATOM 0 HD22ALEU D 8 13.204 28.940 18.023 0.50 11.57 H new ATOM 0 HD22BLEU D 8 11.820 27.994 20.840 0.50 11.57 H new ATOM 0 HD23ALEU D 8 11.736 29.521 18.142 0.50 11.57 H new ATOM 0 HD23BLEU D 8 12.599 26.616 20.893 0.50 11.57 H new ATOM 3050 N VAL D 9 8.797 25.084 17.983 1.00 12.61 N ATOM 3051 CA VAL D 9 7.881 24.719 16.897 1.00 12.25 C ATOM 3052 C VAL D 9 7.172 26.020 16.497 1.00 11.85 C ATOM 3053 O VAL D 9 6.636 26.725 17.342 1.00 11.16 O ATOM 3054 CB VAL D 9 6.840 23.633 17.329 1.00 13.14 C ATOM 3055 CG1 VAL D 9 5.950 23.240 16.156 1.00 13.10 C ATOM 3056 CG2 VAL D 9 7.537 22.358 17.889 1.00 12.52 C ATOM 0 H VAL D 9 8.405 25.394 18.683 1.00 12.61 H new ATOM 0 HA VAL D 9 8.372 24.326 16.159 1.00 12.25 H new ATOM 0 HB VAL D 9 6.298 24.025 18.032 1.00 13.14 H new ATOM 0 HG11 VAL D 9 5.313 22.567 16.444 1.00 13.10 H new ATOM 0 HG12 VAL D 9 5.472 24.021 15.836 1.00 13.10 H new ATOM 0 HG13 VAL D 9 6.497 22.881 15.440 1.00 13.10 H new ATOM 0 HG21 VAL D 9 6.865 21.708 18.146 1.00 12.52 H new ATOM 0 HG22 VAL D 9 8.111 21.976 17.206 1.00 12.52 H new ATOM 0 HG23 VAL D 9 8.071 22.595 18.664 1.00 12.52 H new ATOM 3057 N LYS D 10 7.150 26.326 15.199 1.00 12.00 N ATOM 3058 CA LYS D 10 6.459 27.526 14.735 1.00 12.89 C ATOM 3059 C LYS D 10 4.918 27.418 14.899 1.00 12.53 C ATOM 3060 O LYS D 10 4.377 26.306 15.000 1.00 10.95 O ATOM 3061 CB LYS D 10 6.805 27.779 13.271 1.00 12.81 C ATOM 3062 CG LYS D 10 6.147 26.816 12.312 1.00 14.62 C ATOM 3063 CD LYS D 10 6.346 27.249 10.815 1.00 14.82 C ATOM 3064 CE LYS D 10 5.628 26.199 9.941 1.00 11.84 C ATOM 3065 NZ LYS D 10 4.160 26.309 10.145 1.00 13.29 N ATOM 0 H LYS D 10 7.523 25.859 14.581 1.00 12.00 H new ATOM 0 HA LYS D 10 6.758 28.268 15.284 1.00 12.89 H new ATOM 0 HB2 LYS D 10 6.544 28.683 13.038 1.00 12.81 H new ATOM 0 HB3 LYS D 10 7.767 27.725 13.161 1.00 12.81 H new ATOM 0 HG2 LYS D 10 6.515 25.928 12.443 1.00 14.62 H new ATOM 0 HG3 LYS D 10 5.199 26.762 12.509 1.00 14.62 H new ATOM 0 HD2 LYS D 10 5.977 28.133 10.662 1.00 14.82 H new ATOM 0 HD3 LYS D 10 7.289 27.293 10.593 1.00 14.82 H new ATOM 0 HE2 LYS D 10 5.846 26.338 9.006 1.00 11.84 H new ATOM 0 HE3 LYS D 10 5.931 25.308 10.174 1.00 11.84 H new ATOM 0 HZ1 LYS D 10 3.737 25.845 9.514 1.00 13.29 H new ATOM 0 HZ2 LYS D 10 3.946 25.984 10.946 1.00 13.29 H new ATOM 0 HZ3 LYS D 10 3.917 27.164 10.097 1.00 13.29 H new ATOM 3066 N PRO D 11 4.236 28.575 14.960 1.00 13.11 N ATOM 3067 CA PRO D 11 2.778 28.604 15.039 1.00 13.26 C ATOM 3068 C PRO D 11 2.213 28.074 13.718 1.00 15.22 C ATOM 3069 O PRO D 11 2.788 28.291 12.650 1.00 13.12 O ATOM 3070 CB PRO D 11 2.460 30.111 15.125 1.00 13.38 C ATOM 3071 CG PRO D 11 3.729 30.741 15.631 1.00 13.02 C ATOM 3072 CD PRO D 11 4.787 29.953 14.928 1.00 12.20 C ATOM 0 HA PRO D 11 2.417 28.083 15.773 1.00 13.26 H new ATOM 0 HB2 PRO D 11 2.210 30.468 14.259 1.00 13.38 H new ATOM 0 HB3 PRO D 11 1.718 30.281 15.726 1.00 13.38 H new ATOM 0 HG2 PRO D 11 3.776 31.685 15.411 1.00 13.02 H new ATOM 0 HG3 PRO D 11 3.807 30.670 16.595 1.00 13.02 H new ATOM 0 HD2 PRO D 11 4.926 30.265 14.020 1.00 12.20 H new ATOM 0 HD3 PRO D 11 5.642 30.011 15.382 1.00 12.20 H new ATOM 3073 N GLU D 12 1.094 27.376 13.810 1.00 17.12 N ATOM 3074 CA GLU D 12 0.411 26.860 12.623 1.00 19.66 C ATOM 3075 C GLU D 12 -0.094 27.946 11.699 1.00 20.06 C ATOM 3076 O GLU D 12 -0.306 27.707 10.515 1.00 22.33 O ATOM 3077 CB GLU D 12 -0.690 25.892 13.072 1.00 20.48 C ATOM 3078 CG GLU D 12 -0.136 24.508 13.303 1.00 21.46 C ATOM 3079 CD GLU D 12 0.205 23.808 11.979 1.00 25.42 C ATOM 3080 OE1 GLU D 12 -0.566 23.979 10.998 1.00 25.04 O ATOM 3081 OE2 GLU D 12 1.242 23.106 11.908 1.00 23.65 O ATOM 0 H GLU D 12 0.706 27.186 14.554 1.00 17.12 H new ATOM 0 HA GLU D 12 1.054 26.377 12.081 1.00 19.66 H new ATOM 0 HB2 GLU D 12 -1.100 26.220 13.888 1.00 20.48 H new ATOM 0 HB3 GLU D 12 -1.387 25.856 12.399 1.00 20.48 H new ATOM 0 HG2 GLU D 12 0.660 24.565 13.854 1.00 21.46 H new ATOM 0 HG3 GLU D 12 -0.783 23.977 13.793 1.00 21.46 H new ATOM 3082 N SER D 13 -0.243 29.167 12.205 1.00 20.47 N ATOM 3083 CA SER D 13 -0.623 30.293 11.345 1.00 20.26 C ATOM 3084 C SER D 13 0.558 30.897 10.512 1.00 19.43 C ATOM 3085 O SER D 13 0.374 31.853 9.739 1.00 18.82 O ATOM 3086 CB SER D 13 -1.275 31.373 12.200 1.00 21.36 C ATOM 3087 OG SER D 13 -0.352 31.855 13.160 1.00 23.00 O ATOM 0 H SER D 13 -0.131 29.367 13.034 1.00 20.47 H new ATOM 0 HA SER D 13 -1.247 29.945 10.689 1.00 20.26 H new ATOM 0 HB2 SER D 13 -1.578 32.103 11.637 1.00 21.36 H new ATOM 0 HB3 SER D 13 -2.058 31.014 12.645 1.00 21.36 H new ATOM 0 HG SER D 13 0.269 32.265 12.771 1.00 23.00 H new ATOM 3088 N MET D 14 1.771 30.359 10.688 1.00 17.44 N ATOM 3089 CA MET D 14 2.958 30.965 10.102 1.00 16.07 C ATOM 3090 C MET D 14 3.600 29.995 9.105 1.00 14.12 C ATOM 3091 O MET D 14 3.623 28.803 9.332 1.00 14.71 O ATOM 3092 CB MET D 14 3.948 31.311 11.246 1.00 15.96 C ATOM 3093 CG MET D 14 5.078 32.209 10.873 1.00 18.19 C ATOM 3094 SD MET D 14 6.038 32.814 12.326 1.00 18.02 S ATOM 3095 CE MET D 14 4.958 34.132 12.884 1.00 14.45 C ATOM 0 H MET D 14 1.921 29.645 11.143 1.00 17.44 H new ATOM 0 HA MET D 14 2.721 31.775 9.623 1.00 16.07 H new ATOM 0 HB2 MET D 14 3.450 31.727 11.967 1.00 15.96 H new ATOM 0 HB3 MET D 14 4.315 30.484 11.595 1.00 15.96 H new ATOM 0 HG2 MET D 14 5.675 31.735 10.273 1.00 18.19 H new ATOM 0 HG3 MET D 14 4.730 32.971 10.383 1.00 18.19 H new ATOM 0 HE1 MET D 14 5.343 34.557 13.666 1.00 14.45 H new ATOM 0 HE2 MET D 14 4.857 34.789 12.177 1.00 14.45 H new ATOM 0 HE3 MET D 14 4.089 33.765 13.111 1.00 14.45 H new ATOM 3096 N SER D 15 4.139 30.517 8.006 1.00 13.46 N ATOM 3097 CA SER D 15 4.860 29.717 7.045 1.00 11.67 C ATOM 3098 C SER D 15 6.256 29.464 7.558 1.00 13.05 C ATOM 3099 O SER D 15 6.719 30.176 8.484 1.00 11.37 O ATOM 3100 CB SER D 15 4.965 30.435 5.704 1.00 11.21 C ATOM 3101 OG SER D 15 5.696 31.637 5.830 1.00 10.52 O ATOM 0 H SER D 15 4.092 31.351 7.803 1.00 13.46 H new ATOM 0 HA SER D 15 4.379 28.884 6.922 1.00 11.67 H new ATOM 0 HB2 SER D 15 5.397 29.856 5.056 1.00 11.21 H new ATOM 0 HB3 SER D 15 4.076 30.627 5.365 1.00 11.21 H new ATOM 0 HG SER D 15 5.666 32.061 5.105 1.00 10.52 H new ATOM 3102 N HIS D 16 6.931 28.473 6.945 1.00 11.97 N ATOM 3103 CA AHIS D 16 8.314 28.140 7.268 0.50 12.65 C ATOM 3104 CA BHIS D 16 8.303 28.161 7.320 0.50 13.33 C ATOM 3105 C HIS D 16 9.213 29.363 7.060 1.00 13.60 C ATOM 3106 O HIS D 16 10.038 29.700 7.913 1.00 13.37 O ATOM 3107 CB AHIS D 16 8.812 26.987 6.386 0.50 11.90 C ATOM 3108 CB BHIS D 16 8.803 26.884 6.626 0.50 13.40 C ATOM 3109 CG AHIS D 16 10.255 26.667 6.600 0.50 11.39 C ATOM 3110 CG BHIS D 16 8.508 25.640 7.405 0.50 15.39 C ATOM 3111 ND1AHIS D 16 11.370 27.126 5.981 0.50 9.96 N flip ATOM 3112 ND1BHIS D 16 7.882 24.492 7.054 0.50 14.75 N flip ATOM 3113 CD2AHIS D 16 10.687 25.797 7.582 0.50 10.02 C flip ATOM 3114 CD2BHIS D 16 8.867 25.489 8.733 0.50 17.64 C flip ATOM 3115 CE1AHIS D 16 12.447 26.521 6.582 0.50 11.89 C flip ATOM 3116 CE1BHIS D 16 7.870 23.681 8.168 0.50 12.71 C flip ATOM 3117 NE2AHIS D 16 12.009 25.722 7.544 0.50 11.81 N flip ATOM 3118 NE2BHIS D 16 8.477 24.307 9.163 0.50 17.84 N flip ATOM 0 H AHIS D 16 6.589 27.979 6.329 0.50 11.97 H new ATOM 0 H BHIS D 16 6.608 27.981 6.318 0.50 11.97 H new ATOM 0 HA AHIS D 16 8.351 27.865 8.198 0.50 13.33 H new ATOM 0 HA BHIS D 16 8.327 27.978 8.272 0.50 13.33 H new ATOM 0 HB2AHIS D 16 8.281 26.196 6.567 0.50 13.40 H new ATOM 0 HB2BHIS D 16 8.392 26.816 5.750 0.50 13.40 H new ATOM 0 HB3AHIS D 16 8.672 27.216 5.454 0.50 13.40 H new ATOM 0 HB3BHIS D 16 9.760 26.952 6.486 0.50 13.40 H new ATOM 0 HD1AHIS D 16 11.398 27.691 5.333 0.50 14.75 H new ATOM 0 HD2AHIS D 16 10.138 25.337 8.175 0.50 17.64 H new ATOM 0 HD2BHIS D 16 9.315 26.125 9.243 0.50 17.64 H new ATOM 0 HE1AHIS D 16 13.338 26.651 6.351 0.50 12.71 H new ATOM 0 HE1BHIS D 16 7.496 22.831 8.213 0.50 12.71 H new ATOM 0 HE2BHIS D 16 8.597 23.995 9.956 0.50 17.84 H new ATOM 3119 N GLU D 17 9.044 30.016 5.911 1.00 12.98 N ATOM 3120 CA GLU D 17 9.832 31.219 5.590 1.00 14.01 C ATOM 3121 C GLU D 17 9.616 32.403 6.560 1.00 13.29 C ATOM 3122 O GLU D 17 10.601 33.086 6.937 1.00 13.83 O ATOM 3123 CB GLU D 17 9.563 31.699 4.147 1.00 14.96 C ATOM 3124 CG GLU D 17 10.358 33.005 3.760 1.00 19.78 C ATOM 3125 CD GLU D 17 11.903 32.864 3.884 1.00 28.56 C ATOM 3126 OE1 GLU D 17 12.436 31.718 3.821 1.00 28.94 O ATOM 3127 OE2 GLU D 17 12.599 33.908 4.029 1.00 30.41 O ATOM 0 H GLU D 17 8.482 29.784 5.303 1.00 12.98 H new ATOM 0 HA GLU D 17 10.755 30.936 5.687 1.00 14.01 H new ATOM 0 HB2 GLU D 17 9.799 30.990 3.529 1.00 14.96 H new ATOM 0 HB3 GLU D 17 8.613 31.864 4.040 1.00 14.96 H new ATOM 0 HG2 GLU D 17 10.137 33.249 2.848 1.00 19.78 H new ATOM 0 HG3 GLU D 17 10.062 33.733 4.328 1.00 19.78 H new ATOM 3128 N GLN D 18 8.368 32.674 6.925 1.00 12.47 N ATOM 3129 CA AGLN D 18 8.049 33.694 7.928 0.50 12.70 C ATOM 3130 CA BGLN D 18 8.131 33.735 7.909 0.50 12.86 C ATOM 3131 C GLN D 18 8.767 33.390 9.245 1.00 11.99 C ATOM 3132 O GLN D 18 9.351 34.273 9.891 1.00 11.62 O ATOM 3133 CB AGLN D 18 6.526 33.788 8.128 0.50 12.73 C ATOM 3134 CB BGLN D 18 6.654 34.094 8.085 0.50 13.14 C ATOM 3135 CG AGLN D 18 5.776 34.193 6.836 0.50 13.18 C ATOM 3136 CG BGLN D 18 6.419 35.378 8.923 0.50 13.59 C ATOM 3137 CD AGLN D 18 4.259 34.365 6.983 0.50 13.82 C ATOM 3138 CD BGLN D 18 7.231 36.586 8.437 0.50 16.44 C ATOM 3139 OE1AGLN D 18 3.534 33.531 7.569 0.50 11.09 O ATOM 3140 OE1BGLN D 18 7.928 37.237 9.216 0.50 14.12 O ATOM 3141 NE2AGLN D 18 3.774 35.454 6.417 0.50 11.52 N ATOM 3142 NE2BGLN D 18 7.138 36.884 7.152 0.50 14.54 N ATOM 0 H AGLN D 18 7.680 32.274 6.600 0.50 12.47 H new ATOM 0 H BGLN D 18 7.666 32.275 6.630 0.50 12.47 H new ATOM 0 HA AGLN D 18 8.362 34.556 7.611 0.50 12.86 H new ATOM 0 HA BGLN D 18 8.558 34.529 7.551 0.50 12.86 H new ATOM 0 HB2AGLN D 18 6.191 32.932 8.437 0.50 13.14 H new ATOM 0 HB2BGLN D 18 6.251 34.210 7.210 0.50 13.14 H new ATOM 0 HB3AGLN D 18 6.335 34.435 8.825 0.50 13.14 H new ATOM 0 HB3BGLN D 18 6.198 33.352 8.511 0.50 13.14 H new ATOM 0 HG2AGLN D 18 6.151 35.026 6.510 0.50 13.59 H new ATOM 0 HG2BGLN D 18 5.475 35.602 8.900 0.50 13.59 H new ATOM 0 HG3AGLN D 18 5.946 33.521 6.157 0.50 13.59 H new ATOM 0 HG3BGLN D 18 6.645 35.197 9.849 0.50 13.59 H new ATOM 0 HE21AGLN D 18 4.303 36.006 6.023 0.50 14.54 H new ATOM 0 HE21BGLN D 18 6.642 36.408 6.635 0.50 14.54 H new ATOM 0 HE22AGLN D 18 2.929 35.612 6.443 0.50 14.54 H new ATOM 0 HE22BGLN D 18 7.574 37.553 6.833 0.50 14.54 H new ATOM 3143 N PHE D 19 8.675 32.135 9.653 1.00 11.23 N ATOM 3144 CA PHE D 19 9.324 31.669 10.885 1.00 11.52 C ATOM 3145 C PHE D 19 10.849 31.940 10.877 1.00 12.37 C ATOM 3146 O PHE D 19 11.441 32.464 11.850 1.00 11.14 O ATOM 3147 CB PHE D 19 9.016 30.177 11.104 1.00 9.77 C ATOM 3148 CG PHE D 19 9.700 29.604 12.315 1.00 10.75 C ATOM 3149 CD1 PHE D 19 9.232 29.937 13.598 1.00 7.30 C ATOM 3150 CD2 PHE D 19 10.844 28.784 12.179 1.00 7.11 C ATOM 3151 CE1 PHE D 19 9.893 29.442 14.745 1.00 10.46 C ATOM 3152 CE2 PHE D 19 11.475 28.237 13.303 1.00 8.33 C ATOM 3153 CZ PHE D 19 10.999 28.587 14.601 1.00 8.60 C ATOM 0 H PHE D 19 8.238 31.526 9.231 1.00 11.23 H new ATOM 0 HA PHE D 19 8.961 32.175 11.629 1.00 11.52 H new ATOM 0 HB2 PHE D 19 8.057 30.060 11.195 1.00 9.77 H new ATOM 0 HB3 PHE D 19 9.289 29.677 10.319 1.00 9.77 H new ATOM 0 HD1 PHE D 19 8.486 30.484 13.692 1.00 7.30 H new ATOM 0 HD2 PHE D 19 11.182 28.606 11.331 1.00 7.11 H new ATOM 0 HE1 PHE D 19 9.597 29.682 15.593 1.00 10.46 H new ATOM 0 HE2 PHE D 19 12.193 27.655 13.205 1.00 8.33 H new ATOM 0 HZ PHE D 19 11.423 28.248 15.356 1.00 8.60 H new ATOM 3154 N ARG D 20 11.487 31.574 9.770 1.00 13.28 N ATOM 3155 CA AARG D 20 12.912 31.828 9.576 0.50 14.25 C ATOM 3156 CA BARG D 20 12.916 31.822 9.592 0.50 13.90 C ATOM 3157 C ARG D 20 13.234 33.306 9.772 1.00 14.54 C ATOM 3158 O ARG D 20 14.206 33.650 10.444 1.00 14.18 O ATOM 3159 CB AARG D 20 13.351 31.379 8.178 0.50 14.50 C ATOM 3160 CB BARG D 20 13.401 31.326 8.221 0.50 13.96 C ATOM 3161 CG AARG D 20 14.802 31.680 7.866 0.50 15.97 C ATOM 3162 CG BARG D 20 14.917 31.304 8.070 0.50 13.71 C ATOM 3163 CD AARG D 20 15.129 31.407 6.390 0.50 19.70 C ATOM 3164 CD BARG D 20 15.355 31.061 6.618 0.50 15.98 C ATOM 3165 NE AARG D 20 14.794 32.520 5.496 0.50 22.31 N ATOM 3166 NE BARG D 20 16.777 31.364 6.469 0.50 16.64 N ATOM 3167 CZ AARG D 20 15.295 33.757 5.573 0.50 22.88 C ATOM 3168 CZ BARG D 20 17.707 30.436 6.310 0.50 17.91 C ATOM 3169 NH1AARG D 20 16.138 34.098 6.540 0.50 21.87 N ATOM 3170 NH1BARG D 20 18.989 30.778 6.196 0.50 17.74 N ATOM 3171 NH2AARG D 20 14.936 34.667 4.681 0.50 20.70 N ATOM 3172 NH2BARG D 20 17.344 29.161 6.241 0.50 17.29 N ATOM 0 H AARG D 20 11.108 31.172 9.111 0.50 13.28 H new ATOM 0 H BARG D 20 11.109 31.179 9.106 0.50 13.28 H new ATOM 0 HA AARG D 20 13.400 31.316 10.240 0.50 13.90 H new ATOM 0 HA BARG D 20 13.391 31.322 10.274 0.50 13.90 H new ATOM 0 HB2AARG D 20 13.202 30.424 8.093 0.50 13.96 H new ATOM 0 HB2BARG D 20 13.057 30.431 8.071 0.50 13.96 H new ATOM 0 HB3AARG D 20 12.790 31.814 7.517 0.50 13.96 H new ATOM 0 HB3BARG D 20 13.025 31.894 7.530 0.50 13.96 H new ATOM 0 HG2AARG D 20 14.993 32.608 8.075 0.50 13.71 H new ATOM 0 HG2BARG D 20 15.283 32.147 8.379 0.50 13.71 H new ATOM 0 HG3AARG D 20 15.375 31.138 8.431 0.50 13.71 H new ATOM 0 HG3BARG D 20 15.286 30.610 8.638 0.50 13.71 H new ATOM 0 HD2AARG D 20 16.075 31.210 6.308 0.50 15.98 H new ATOM 0 HD2BARG D 20 15.185 30.138 6.371 0.50 15.98 H new ATOM 0 HD3AARG D 20 14.649 30.615 6.102 0.50 15.98 H new ATOM 0 HD3BARG D 20 14.833 31.616 6.017 0.50 15.98 H new ATOM 0 HE AARG D 20 14.227 32.364 4.869 0.50 16.64 H new ATOM 0 HE BARG D 20 17.022 32.188 6.486 0.50 16.64 H new ATOM 0 HH11AARG D 20 16.371 33.519 7.131 0.50 17.74 H new ATOM 0 HH11BARG D 20 19.217 31.607 6.226 0.50 17.74 H new ATOM 0 HH12AARG D 20 16.451 34.898 6.575 0.50 17.74 H new ATOM 0 HH12BARG D 20 19.589 30.170 6.093 0.50 17.74 H new ATOM 0 HH21AARG D 20 14.383 34.461 4.056 0.50 17.29 H new ATOM 0 HH21BARG D 20 16.513 28.947 6.300 0.50 17.29 H new ATOM 0 HH22AARG D 20 15.256 35.464 4.727 0.50 17.29 H new ATOM 0 HH22BARG D 20 17.940 28.549 6.138 0.50 17.29 H new ATOM 3173 N LYS D 21 12.404 34.178 9.197 1.00 14.19 N ATOM 3174 CA LYS D 21 12.614 35.621 9.317 1.00 15.00 C ATOM 3175 C LYS D 21 12.461 36.085 10.764 1.00 14.76 C ATOM 3176 O LYS D 21 13.239 36.935 11.210 1.00 14.78 O ATOM 3177 CB LYS D 21 11.632 36.404 8.438 1.00 15.48 C ATOM 3178 CG LYS D 21 11.989 36.371 6.954 1.00 19.72 C ATOM 3179 CD LYS D 21 10.793 36.894 6.135 1.00 25.61 C ATOM 3180 CE LYS D 21 11.193 37.322 4.727 1.00 29.96 C ATOM 3181 NZ LYS D 21 11.092 36.158 3.846 1.00 35.51 N ATOM 0 H LYS D 21 11.715 33.954 8.734 1.00 14.19 H new ATOM 0 HA LYS D 21 13.520 35.797 9.018 1.00 15.00 H new ATOM 0 HB2 LYS D 21 10.741 36.041 8.558 1.00 15.48 H new ATOM 0 HB3 LYS D 21 11.605 37.326 8.737 1.00 15.48 H new ATOM 0 HG2 LYS D 21 12.773 36.917 6.786 1.00 19.72 H new ATOM 0 HG3 LYS D 21 12.210 35.466 6.683 1.00 19.72 H new ATOM 0 HD2 LYS D 21 10.115 36.202 6.079 1.00 25.61 H new ATOM 0 HD3 LYS D 21 10.392 37.647 6.597 1.00 25.61 H new ATOM 0 HE2 LYS D 21 10.614 38.034 4.413 1.00 29.96 H new ATOM 0 HE3 LYS D 21 12.098 37.670 4.724 1.00 29.96 H new ATOM 0 HZ1 LYS D 21 11.378 36.376 3.032 1.00 35.51 H new ATOM 0 HZ2 LYS D 21 11.593 35.497 4.169 1.00 35.51 H new ATOM 0 HZ3 LYS D 21 10.244 35.892 3.801 1.00 35.51 H new ATOM 3182 N GLU D 22 11.471 35.538 11.480 1.00 13.77 N ATOM 3183 CA GLU D 22 11.278 35.880 12.903 1.00 14.44 C ATOM 3184 C GLU D 22 12.411 35.365 13.814 1.00 13.97 C ATOM 3185 O GLU D 22 12.779 36.041 14.809 1.00 14.06 O ATOM 3186 CB GLU D 22 9.904 35.422 13.428 1.00 14.44 C ATOM 3187 CG GLU D 22 8.694 36.101 12.793 1.00 17.57 C ATOM 3188 CD GLU D 22 8.798 37.628 12.717 1.00 23.56 C ATOM 3189 OE1 GLU D 22 8.419 38.179 11.658 1.00 26.66 O ATOM 3190 OE2 GLU D 22 9.267 38.280 13.679 1.00 21.71 O ATOM 0 H GLU D 22 10.904 34.972 11.167 1.00 13.77 H new ATOM 0 HA GLU D 22 11.308 36.849 12.940 1.00 14.44 H new ATOM 0 HB2 GLU D 22 9.826 34.465 13.291 1.00 14.44 H new ATOM 0 HB3 GLU D 22 9.875 35.575 14.385 1.00 14.44 H new ATOM 0 HG2 GLU D 22 8.572 35.750 11.897 1.00 17.57 H new ATOM 0 HG3 GLU D 22 7.901 35.866 13.300 1.00 17.57 H new ATOM 3191 N CYS D 23 12.972 34.199 13.489 1.00 12.67 N ATOM 3192 CA CYS D 23 14.156 33.727 14.196 1.00 12.58 C ATOM 3193 C CYS D 23 15.278 34.776 14.116 1.00 12.32 C ATOM 3194 O CYS D 23 15.936 35.069 15.117 1.00 12.27 O ATOM 3195 CB CYS D 23 14.664 32.387 13.655 1.00 12.23 C ATOM 3196 SG CYS D 23 13.627 30.925 14.053 1.00 13.32 S ATOM 0 H CYS D 23 12.685 33.675 12.870 1.00 12.67 H new ATOM 0 HA CYS D 23 13.897 33.591 15.121 1.00 12.58 H new ATOM 0 HB2 CYS D 23 14.742 32.455 12.691 1.00 12.23 H new ATOM 0 HB3 CYS D 23 15.557 32.234 14.002 1.00 12.23 H new ATOM 0 HG CYS D 23 14.123 29.941 13.577 1.00 13.32 H new ATOM 3197 N VAL D 24 15.501 35.319 12.916 1.00 12.45 N ATOM 3198 CA VAL D 24 16.580 36.282 12.702 1.00 12.09 C ATOM 3199 C VAL D 24 16.294 37.548 13.486 1.00 12.62 C ATOM 3200 O VAL D 24 17.186 38.059 14.167 1.00 11.82 O ATOM 3201 CB VAL D 24 16.791 36.597 11.210 1.00 13.02 C ATOM 3202 CG1 VAL D 24 17.814 37.725 11.035 1.00 13.78 C ATOM 3203 CG2 VAL D 24 17.248 35.317 10.458 1.00 13.20 C ATOM 0 H VAL D 24 15.037 35.141 12.214 1.00 12.45 H new ATOM 0 HA VAL D 24 17.405 35.884 13.021 1.00 12.09 H new ATOM 0 HB VAL D 24 15.949 36.896 10.831 1.00 13.02 H new ATOM 0 HG11 VAL D 24 17.934 37.910 10.090 1.00 13.78 H new ATOM 0 HG12 VAL D 24 17.494 38.524 11.482 1.00 13.78 H new ATOM 0 HG13 VAL D 24 18.662 37.456 11.422 1.00 13.78 H new ATOM 0 HG21 VAL D 24 17.379 35.522 9.519 1.00 13.20 H new ATOM 0 HG22 VAL D 24 18.082 34.998 10.838 1.00 13.20 H new ATOM 0 HG23 VAL D 24 16.569 34.630 10.546 1.00 13.20 H new ATOM 3204 N VAL D 25 15.043 38.005 13.434 1.00 11.93 N ATOM 3205 CA VAL D 25 14.634 39.209 14.182 1.00 12.52 C ATOM 3206 C VAL D 25 14.875 38.935 15.688 1.00 12.18 C ATOM 3207 O VAL D 25 15.325 39.823 16.417 1.00 11.34 O ATOM 3208 CB VAL D 25 13.128 39.543 13.946 1.00 13.39 C ATOM 3209 CG1 VAL D 25 12.566 40.549 15.003 1.00 13.12 C ATOM 3210 CG2 VAL D 25 12.898 40.093 12.506 1.00 14.03 C ATOM 0 H VAL D 25 14.414 37.639 12.975 1.00 11.93 H new ATOM 0 HA VAL D 25 15.153 39.969 13.876 1.00 12.52 H new ATOM 0 HB VAL D 25 12.641 38.711 14.049 1.00 13.39 H new ATOM 0 HG11 VAL D 25 11.631 40.726 14.816 1.00 13.12 H new ATOM 0 HG12 VAL D 25 12.652 40.168 15.891 1.00 13.12 H new ATOM 0 HG13 VAL D 25 13.066 41.379 14.958 1.00 13.12 H new ATOM 0 HG21 VAL D 25 11.957 40.293 12.382 1.00 14.03 H new ATOM 0 HG22 VAL D 25 13.419 40.901 12.381 1.00 14.03 H new ATOM 0 HG23 VAL D 25 13.174 39.427 11.857 1.00 14.03 H new ATOM 3211 N HIS D 26 14.566 37.718 16.137 1.00 9.71 N ATOM 3212 CA HIS D 26 14.668 37.402 17.557 1.00 10.24 C ATOM 3213 C HIS D 26 16.115 37.438 18.001 1.00 9.92 C ATOM 3214 O HIS D 26 16.435 37.882 19.127 1.00 9.25 O ATOM 3215 CB HIS D 26 14.042 36.029 17.874 1.00 9.49 C ATOM 3216 CG HIS D 26 13.596 35.881 19.309 1.00 9.38 C ATOM 3217 ND1 HIS D 26 12.577 36.638 19.851 1.00 10.71 N ATOM 3218 CD2 HIS D 26 13.989 35.027 20.287 1.00 8.81 C ATOM 3219 CE1 HIS D 26 12.371 36.272 21.108 1.00 11.00 C ATOM 3220 NE2 HIS D 26 13.215 35.292 21.402 1.00 9.46 N ATOM 0 H HIS D 26 14.298 37.069 15.640 1.00 9.71 H new ATOM 0 HA HIS D 26 14.171 38.075 18.049 1.00 10.24 H new ATOM 0 HB2 HIS D 26 13.280 35.888 17.291 1.00 9.49 H new ATOM 0 HB3 HIS D 26 14.687 35.334 17.671 1.00 9.49 H new ATOM 0 HD2 HIS D 26 14.656 34.382 20.220 1.00 8.81 H new ATOM 0 HE1 HIS D 26 11.742 36.640 21.686 1.00 11.00 H new ATOM 0 HE2 HIS D 26 13.271 34.889 22.159 1.00 9.46 H new ATOM 3221 N PHE D 27 17.002 36.975 17.124 1.00 8.37 N ATOM 3222 CA PHE D 27 18.411 37.064 17.432 1.00 10.26 C ATOM 3223 C PHE D 27 18.904 38.542 17.525 1.00 11.18 C ATOM 3224 O PHE D 27 19.612 38.940 18.444 1.00 10.22 O ATOM 3225 CB PHE D 27 19.256 36.287 16.405 1.00 9.73 C ATOM 3226 CG PHE D 27 20.737 36.465 16.629 1.00 11.85 C ATOM 3227 CD1 PHE D 27 21.384 35.795 17.676 1.00 12.97 C ATOM 3228 CD2 PHE D 27 21.453 37.386 15.892 1.00 13.46 C ATOM 3229 CE1 PHE D 27 22.754 35.999 17.939 1.00 15.22 C ATOM 3230 CE2 PHE D 27 22.806 37.589 16.140 1.00 15.64 C ATOM 3231 CZ PHE D 27 23.468 36.895 17.166 1.00 13.84 C ATOM 0 H PHE D 27 16.810 36.616 16.367 1.00 8.37 H new ATOM 0 HA PHE D 27 18.529 36.659 18.305 1.00 10.26 H new ATOM 0 HB2 PHE D 27 19.035 35.344 16.455 1.00 9.73 H new ATOM 0 HB3 PHE D 27 19.028 36.585 15.510 1.00 9.73 H new ATOM 0 HD1 PHE D 27 20.900 35.205 18.207 1.00 12.97 H new ATOM 0 HD2 PHE D 27 21.028 37.874 15.225 1.00 13.46 H new ATOM 0 HE1 PHE D 27 23.174 35.535 18.627 1.00 15.22 H new ATOM 0 HE2 PHE D 27 23.281 38.195 15.618 1.00 15.64 H new ATOM 0 HZ PHE D 27 24.374 37.036 17.323 1.00 13.84 H new ATOM 3232 N GLN D 28 18.523 39.330 16.523 1.00 11.39 N ATOM 3233 CA GLN D 28 18.846 40.740 16.511 1.00 12.83 C ATOM 3234 C GLN D 28 18.369 41.471 17.766 1.00 11.94 C ATOM 3235 O GLN D 28 19.107 42.293 18.272 1.00 12.56 O ATOM 3236 CB GLN D 28 18.230 41.374 15.273 1.00 13.01 C ATOM 3237 CG GLN D 28 18.986 40.883 14.007 1.00 18.98 C ATOM 3238 CD GLN D 28 18.276 41.192 12.680 1.00 26.13 C ATOM 3239 OE1 GLN D 28 17.070 41.473 12.632 1.00 25.11 O ATOM 3240 NE2 GLN D 28 19.036 41.095 11.581 1.00 29.79 N ATOM 0 H GLN D 28 18.075 39.060 15.840 1.00 11.39 H new ATOM 0 HA GLN D 28 19.812 40.822 16.495 1.00 12.83 H new ATOM 0 HB2 GLN D 28 17.291 41.140 15.211 1.00 13.01 H new ATOM 0 HB3 GLN D 28 18.278 42.341 15.335 1.00 13.01 H new ATOM 0 HG2 GLN D 28 19.866 41.290 13.992 1.00 18.98 H new ATOM 0 HG3 GLN D 28 19.118 39.924 14.074 1.00 18.98 H new ATOM 0 HE21 GLN D 28 19.870 40.898 11.651 1.00 29.79 H new ATOM 0 HE22 GLN D 28 18.690 41.230 10.805 1.00 29.79 H new ATOM 3241 N MET D 29 17.145 41.196 18.220 1.00 11.33 N ATOM 3242 CA MET D 29 16.591 41.826 19.430 1.00 11.32 C ATOM 3243 C MET D 29 17.415 41.516 20.677 1.00 11.06 C ATOM 3244 O MET D 29 17.455 42.336 21.613 1.00 10.13 O ATOM 3245 CB MET D 29 15.149 41.362 19.675 1.00 11.73 C ATOM 3246 CG MET D 29 14.120 41.900 18.673 1.00 11.78 C ATOM 3247 SD MET D 29 12.555 41.074 18.953 1.00 14.91 S ATOM 3248 CE MET D 29 11.448 42.157 18.036 1.00 17.65 C ATOM 0 H MET D 29 16.611 40.641 17.839 1.00 11.33 H new ATOM 0 HA MET D 29 16.615 42.783 19.271 1.00 11.32 H new ATOM 0 HB2 MET D 29 15.127 40.393 19.653 1.00 11.73 H new ATOM 0 HB3 MET D 29 14.883 41.632 20.568 1.00 11.73 H new ATOM 0 HG2 MET D 29 14.017 42.859 18.779 1.00 11.78 H new ATOM 0 HG3 MET D 29 14.423 41.746 17.765 1.00 11.78 H new ATOM 0 HE1 MET D 29 10.593 41.716 17.913 1.00 17.65 H new ATOM 0 HE2 MET D 29 11.318 42.981 18.531 1.00 17.65 H new ATOM 0 HE3 MET D 29 11.836 42.358 17.170 1.00 17.65 H new ATOM 3249 N SER D 30 18.048 40.333 20.694 1.00 9.70 N ATOM 3250 CA SER D 30 18.787 39.841 21.889 1.00 9.64 C ATOM 3251 C SER D 30 20.085 40.557 22.180 1.00 9.34 C ATOM 3252 O SER D 30 20.634 40.349 23.251 1.00 9.22 O ATOM 3253 CB SER D 30 19.098 38.303 21.803 1.00 8.98 C ATOM 3254 OG SER D 30 20.132 38.067 20.867 1.00 10.77 O ATOM 0 H SER D 30 18.065 39.794 20.024 1.00 9.70 H new ATOM 0 HA SER D 30 18.174 40.032 22.616 1.00 9.64 H new ATOM 0 HB2 SER D 30 19.360 37.970 22.675 1.00 8.98 H new ATOM 0 HB3 SER D 30 18.299 37.818 21.542 1.00 8.98 H new ATOM 0 HG SER D 30 19.961 38.472 20.152 1.00 10.77 H new ATOM 3255 N ALA D 31 20.626 41.334 21.220 1.00 9.49 N ATOM 3256 CA ALA D 31 21.928 41.997 21.413 1.00 9.57 C ATOM 3257 C ALA D 31 21.935 42.879 22.670 1.00 9.13 C ATOM 3258 O ALA D 31 21.052 43.707 22.872 1.00 10.10 O ATOM 3259 CB ALA D 31 22.338 42.843 20.149 1.00 10.16 C ATOM 0 H ALA D 31 20.257 41.487 20.458 1.00 9.49 H new ATOM 0 HA ALA D 31 22.585 41.294 21.535 1.00 9.57 H new ATOM 0 HB1 ALA D 31 23.197 43.266 20.307 1.00 10.16 H new ATOM 0 HB2 ALA D 31 22.402 42.260 19.376 1.00 10.16 H new ATOM 0 HB3 ALA D 31 21.668 43.525 19.985 1.00 10.16 H new ATOM 3260 N GLY D 32 22.921 42.691 23.525 1.00 9.78 N ATOM 3261 CA GLY D 32 23.046 43.521 24.741 1.00 9.14 C ATOM 3262 C GLY D 32 21.913 43.303 25.748 1.00 8.90 C ATOM 3263 O GLY D 32 21.646 44.188 26.584 1.00 10.15 O ATOM 0 H GLY D 32 23.533 42.094 23.433 1.00 9.78 H new ATOM 0 HA2 GLY D 32 23.893 43.326 25.171 1.00 9.14 H new ATOM 0 HA3 GLY D 32 23.066 44.456 24.485 1.00 9.14 H new ATOM 3264 N MET D 33 21.214 42.169 25.667 1.00 8.87 N ATOM 3265 CA MET D 33 20.144 41.862 26.628 1.00 9.05 C ATOM 3266 C MET D 33 20.742 41.834 28.054 1.00 9.65 C ATOM 3267 O MET D 33 21.704 41.126 28.258 1.00 9.93 O ATOM 3268 CB MET D 33 19.582 40.470 26.322 1.00 9.56 C ATOM 3269 CG MET D 33 18.467 39.978 27.258 1.00 14.04 C ATOM 3270 SD MET D 33 16.964 40.938 27.140 1.00 20.43 S ATOM 3271 CE MET D 33 16.514 40.840 25.388 1.00 17.87 C ATOM 0 H MET D 33 21.341 41.566 25.067 1.00 8.87 H new ATOM 0 HA MET D 33 19.446 42.532 26.564 1.00 9.05 H new ATOM 0 HB2 MET D 33 19.242 40.470 25.414 1.00 9.56 H new ATOM 0 HB3 MET D 33 20.312 39.831 26.352 1.00 9.56 H new ATOM 0 HG2 MET D 33 18.268 39.051 27.053 1.00 14.04 H new ATOM 0 HG3 MET D 33 18.788 40.003 28.173 1.00 14.04 H new ATOM 0 HE1 MET D 33 15.698 41.341 25.235 1.00 17.87 H new ATOM 0 HE2 MET D 33 17.229 41.214 24.849 1.00 17.87 H new ATOM 0 HE3 MET D 33 16.374 39.912 25.141 1.00 17.87 H new ATOM 3272 N PRO D 34 20.147 42.563 29.040 1.00 9.90 N ATOM 3273 CA PRO D 34 20.655 42.500 30.441 1.00 9.12 C ATOM 3274 C PRO D 34 20.720 41.066 30.956 1.00 8.67 C ATOM 3275 O PRO D 34 19.783 40.329 30.752 1.00 8.67 O ATOM 3276 CB PRO D 34 19.592 43.256 31.216 1.00 9.20 C ATOM 3277 CG PRO D 34 19.202 44.402 30.171 1.00 11.47 C ATOM 3278 CD PRO D 34 19.007 43.509 28.931 1.00 9.56 C ATOM 0 HA PRO D 34 21.552 42.859 30.523 1.00 9.12 H new ATOM 0 HB2 PRO D 34 18.835 42.694 31.443 1.00 9.20 H new ATOM 0 HB3 PRO D 34 19.934 43.620 32.048 1.00 9.20 H new ATOM 0 HG2 PRO D 34 18.398 44.883 30.421 1.00 11.47 H new ATOM 0 HG3 PRO D 34 19.903 45.062 30.055 1.00 11.47 H new ATOM 0 HD2 PRO D 34 18.153 43.050 28.947 1.00 9.56 H new ATOM 0 HD3 PRO D 34 19.039 44.021 28.108 1.00 9.56 H new ATOM 3279 N GLY D 35 21.843 40.682 31.573 1.00 9.32 N ATOM 3280 CA GLY D 35 21.971 39.386 32.242 1.00 9.69 C ATOM 3281 C GLY D 35 22.346 38.233 31.301 1.00 11.07 C ATOM 3282 O GLY D 35 22.648 37.156 31.764 1.00 12.00 O ATOM 0 H GLY D 35 22.551 41.168 31.614 1.00 9.32 H new ATOM 0 HA2 GLY D 35 22.644 39.456 32.937 1.00 9.69 H new ATOM 0 HA3 GLY D 35 21.132 39.174 32.680 1.00 9.69 H new ATOM 3283 N LEU D 36 22.279 38.440 29.974 1.00 10.66 N ATOM 3284 CA LEU D 36 22.424 37.357 29.034 1.00 11.04 C ATOM 3285 C LEU D 36 23.856 37.301 28.507 1.00 11.56 C ATOM 3286 O LEU D 36 24.383 38.291 27.972 1.00 13.12 O ATOM 3287 CB LEU D 36 21.413 37.486 27.875 1.00 11.28 C ATOM 3288 CG LEU D 36 21.429 36.445 26.724 1.00 11.67 C ATOM 3289 CD1 LEU D 36 20.874 35.079 27.225 1.00 9.65 C ATOM 3290 CD2 LEU D 36 20.548 36.944 25.559 1.00 12.08 C ATOM 0 H LEU D 36 22.149 39.210 29.613 1.00 10.66 H new ATOM 0 HA LEU D 36 22.234 36.526 29.496 1.00 11.04 H new ATOM 0 HB2 LEU D 36 20.524 37.476 28.263 1.00 11.28 H new ATOM 0 HB3 LEU D 36 21.539 38.361 27.476 1.00 11.28 H new ATOM 0 HG LEU D 36 22.344 36.331 26.423 1.00 11.67 H new ATOM 0 HD11 LEU D 36 20.889 34.437 26.498 1.00 9.65 H new ATOM 0 HD12 LEU D 36 21.425 34.754 27.954 1.00 9.65 H new ATOM 0 HD13 LEU D 36 19.962 35.194 27.535 1.00 9.65 H new ATOM 0 HD21 LEU D 36 20.560 36.291 24.841 1.00 12.08 H new ATOM 0 HD22 LEU D 36 19.637 37.065 25.870 1.00 12.08 H new ATOM 0 HD23 LEU D 36 20.892 37.790 25.232 1.00 12.08 H new ATOM 3291 N HIS D 37 24.501 36.162 28.650 1.00 12.05 N ATOM 3292 CA HIS D 37 25.858 36.030 28.064 1.00 13.35 C ATOM 3293 C HIS D 37 25.837 35.811 26.540 1.00 12.76 C ATOM 3294 O HIS D 37 26.600 36.431 25.769 1.00 11.13 O ATOM 3295 CB HIS D 37 26.631 34.895 28.723 1.00 14.02 C ATOM 3296 CG HIS D 37 27.968 34.674 28.097 1.00 20.08 C ATOM 3297 ND1 HIS D 37 28.970 35.617 28.149 1.00 20.91 N ATOM 3298 CD2 HIS D 37 28.450 33.646 27.361 1.00 22.09 C ATOM 3299 CE1 HIS D 37 30.027 35.166 27.498 1.00 26.25 C ATOM 3300 NE2 HIS D 37 29.740 33.968 27.017 1.00 26.67 N ATOM 0 H HIS D 37 24.203 35.469 29.062 1.00 12.05 H new ATOM 0 HA HIS D 37 26.303 36.875 28.236 1.00 13.35 H new ATOM 0 HB2 HIS D 37 26.747 35.092 29.666 1.00 14.02 H new ATOM 0 HB3 HIS D 37 26.111 34.078 28.666 1.00 14.02 H new ATOM 0 HD1 HIS D 37 28.916 36.379 28.543 1.00 20.91 H new ATOM 0 HD2 HIS D 37 27.994 32.869 27.132 1.00 22.09 H new ATOM 0 HE1 HIS D 37 30.835 35.614 27.395 1.00 26.25 H new ATOM 3301 N LYS D 38 24.949 34.940 26.099 1.00 10.95 N ATOM 3302 CA LYS D 38 24.869 34.625 24.647 1.00 12.00 C ATOM 3303 C LYS D 38 23.476 34.069 24.342 1.00 10.60 C ATOM 3304 O LYS D 38 22.888 33.412 25.186 1.00 10.35 O ATOM 3305 CB LYS D 38 25.985 33.611 24.294 1.00 11.94 C ATOM 3306 CG LYS D 38 26.080 33.148 22.839 1.00 12.90 C ATOM 3307 CD LYS D 38 27.194 32.043 22.707 1.00 14.55 C ATOM 3308 CE LYS D 38 26.998 31.310 21.378 1.00 18.49 C ATOM 3309 NZ LYS D 38 28.140 30.399 21.098 1.00 22.77 N ATOM 0 H LYS D 38 24.387 34.519 26.596 1.00 10.95 H new ATOM 0 HA LYS D 38 25.003 35.419 24.107 1.00 12.00 H new ATOM 0 HB2 LYS D 38 26.837 34.005 24.540 1.00 11.94 H new ATOM 0 HB3 LYS D 38 25.864 32.826 24.851 1.00 11.94 H new ATOM 0 HG2 LYS D 38 25.225 32.795 22.546 1.00 12.90 H new ATOM 0 HG3 LYS D 38 26.288 33.901 22.264 1.00 12.90 H new ATOM 0 HD2 LYS D 38 28.075 32.447 22.742 1.00 14.55 H new ATOM 0 HD3 LYS D 38 27.139 31.419 23.447 1.00 14.55 H new ATOM 0 HE2 LYS D 38 26.173 30.801 21.404 1.00 18.49 H new ATOM 0 HE3 LYS D 38 26.911 31.955 20.659 1.00 18.49 H new ATOM 0 HZ1 LYS D 38 27.835 29.639 20.748 1.00 22.77 H new ATOM 0 HZ2 LYS D 38 28.696 30.788 20.522 1.00 22.77 H new ATOM 0 HZ3 LYS D 38 28.573 30.224 21.856 1.00 22.77 H new ATOM 3310 N TYR D 39 22.954 34.347 23.141 1.00 10.14 N ATOM 3311 CA TYR D 39 21.765 33.651 22.640 1.00 10.17 C ATOM 3312 C TYR D 39 22.118 33.079 21.260 1.00 9.98 C ATOM 3313 O TYR D 39 22.839 33.705 20.512 1.00 10.43 O ATOM 3314 CB TYR D 39 20.543 34.615 22.521 1.00 9.16 C ATOM 3315 CG TYR D 39 19.344 34.038 21.782 1.00 8.88 C ATOM 3316 CD1 TYR D 39 18.597 32.993 22.332 1.00 10.58 C ATOM 3317 CD2 TYR D 39 18.944 34.533 20.531 1.00 10.57 C ATOM 3318 CE1 TYR D 39 17.480 32.474 21.666 1.00 9.47 C ATOM 3319 CE2 TYR D 39 17.828 33.970 19.850 1.00 8.76 C ATOM 3320 CZ TYR D 39 17.113 32.982 20.417 1.00 10.55 C ATOM 3321 OH TYR D 39 16.009 32.464 19.776 1.00 11.37 O ATOM 0 H TYR D 39 23.275 34.936 22.602 1.00 10.14 H new ATOM 0 HA TYR D 39 21.513 32.948 23.259 1.00 10.17 H new ATOM 0 HB2 TYR D 39 20.263 34.874 23.413 1.00 9.16 H new ATOM 0 HB3 TYR D 39 20.828 35.424 22.067 1.00 9.16 H new ATOM 0 HD1 TYR D 39 18.846 32.636 23.154 1.00 10.58 H new ATOM 0 HD2 TYR D 39 19.413 35.236 20.143 1.00 10.57 H new ATOM 0 HE1 TYR D 39 16.982 31.791 22.055 1.00 9.47 H new ATOM 0 HE2 TYR D 39 17.592 34.287 19.008 1.00 8.76 H new ATOM 0 HH TYR D 39 15.550 32.020 20.322 1.00 11.37 H new ATOM 3322 N GLU D 40 21.627 31.894 20.939 1.00 9.90 N ATOM 3323 CA GLU D 40 21.805 31.362 19.586 1.00 9.87 C ATOM 3324 C GLU D 40 20.510 30.694 19.155 1.00 9.92 C ATOM 3325 O GLU D 40 19.837 30.034 19.967 1.00 9.32 O ATOM 3326 CB GLU D 40 22.942 30.336 19.590 1.00 9.75 C ATOM 3327 CG GLU D 40 23.202 29.658 18.227 1.00 10.20 C ATOM 3328 CD GLU D 40 24.488 28.849 18.262 1.00 12.67 C ATOM 3329 OE1 GLU D 40 24.623 28.012 19.165 1.00 12.16 O ATOM 3330 OE2 GLU D 40 25.361 29.029 17.382 1.00 12.55 O ATOM 0 H GLU D 40 21.192 31.383 21.477 1.00 9.90 H new ATOM 0 HA GLU D 40 22.027 32.078 18.970 1.00 9.87 H new ATOM 0 HB2 GLU D 40 23.757 30.775 19.880 1.00 9.75 H new ATOM 0 HB3 GLU D 40 22.741 29.650 20.246 1.00 9.75 H new ATOM 0 HG2 GLU D 40 22.457 29.079 18.002 1.00 10.20 H new ATOM 0 HG3 GLU D 40 23.258 30.332 17.531 1.00 10.20 H new ATOM 3331 N VAL D 41 20.146 30.906 17.887 1.00 9.86 N ATOM 3332 CA VAL D 41 19.000 30.245 17.295 1.00 8.79 C ATOM 3333 C VAL D 41 19.421 29.687 15.903 1.00 9.51 C ATOM 3334 O VAL D 41 20.099 30.384 15.106 1.00 9.00 O ATOM 3335 CB VAL D 41 17.747 31.153 17.272 1.00 9.71 C ATOM 3336 CG1 VAL D 41 18.005 32.445 16.427 1.00 7.22 C ATOM 3337 CG2 VAL D 41 16.510 30.400 16.732 1.00 8.76 C ATOM 0 H VAL D 41 20.561 31.438 17.353 1.00 9.86 H new ATOM 0 HA VAL D 41 18.724 29.494 17.844 1.00 8.79 H new ATOM 0 HB VAL D 41 17.565 31.413 18.188 1.00 9.71 H new ATOM 0 HG11 VAL D 41 17.207 32.997 16.427 1.00 7.22 H new ATOM 0 HG12 VAL D 41 18.742 32.943 16.814 1.00 7.22 H new ATOM 0 HG13 VAL D 41 18.226 32.197 15.516 1.00 7.22 H new ATOM 0 HG21 VAL D 41 15.744 30.995 16.730 1.00 8.76 H new ATOM 0 HG22 VAL D 41 16.685 30.097 15.827 1.00 8.76 H new ATOM 0 HG23 VAL D 41 16.324 29.635 17.299 1.00 8.76 H new ATOM 3338 N ARG D 42 19.086 28.418 15.653 1.00 9.19 N ATOM 3339 CA AARG D 42 19.409 27.750 14.382 0.50 8.80 C ATOM 3340 CA BARG D 42 19.373 27.814 14.350 0.50 9.78 C ATOM 3341 C ARG D 42 18.164 27.013 13.903 1.00 9.66 C ATOM 3342 O ARG D 42 17.407 26.505 14.726 1.00 8.50 O ATOM 3343 CB AARG D 42 20.517 26.715 14.593 0.50 8.40 C ATOM 3344 CB BARG D 42 20.605 26.919 14.440 0.50 9.86 C ATOM 3345 CG AARG D 42 21.830 27.236 15.144 0.50 5.15 C ATOM 3346 CG BARG D 42 20.575 26.016 15.630 0.50 11.55 C ATOM 3347 CD AARG D 42 22.765 26.076 15.373 0.50 6.78 C ATOM 3348 CD BARG D 42 21.940 25.437 15.929 0.50 12.18 C ATOM 3349 NE AARG D 42 22.691 25.594 16.739 0.50 6.81 N ATOM 3350 NE BARG D 42 22.061 25.061 17.328 0.50 12.09 N ATOM 3351 CZ AARG D 42 23.166 24.422 17.163 0.50 9.84 C ATOM 3352 CZ BARG D 42 22.784 24.037 17.788 0.50 12.04 C ATOM 3353 NH1AARG D 42 23.741 23.577 16.309 0.50 6.52 N ATOM 3354 NH1BARG D 42 23.434 23.236 16.953 0.50 8.98 N ATOM 3355 NH2AARG D 42 23.070 24.102 18.459 0.50 9.24 N ATOM 3356 NH2BARG D 42 22.858 23.824 19.098 0.50 9.57 N ATOM 0 H AARG D 42 18.666 27.919 16.213 0.50 9.19 H new ATOM 0 H BARG D 42 18.697 27.897 16.216 0.50 9.19 H new ATOM 0 HA AARG D 42 19.702 28.412 13.737 0.50 9.78 H new ATOM 0 HA BARG D 42 19.557 28.511 13.701 0.50 9.78 H new ATOM 0 HB2AARG D 42 20.184 26.032 15.196 0.50 9.86 H new ATOM 0 HB2BARG D 42 20.671 26.384 13.634 0.50 9.86 H new ATOM 0 HB3AARG D 42 20.694 26.282 13.743 0.50 9.86 H new ATOM 0 HB3BARG D 42 21.400 27.473 14.479 0.50 9.86 H new ATOM 0 HG2AARG D 42 22.226 27.867 14.523 0.50 11.55 H new ATOM 0 HG2BARG D 42 20.256 26.509 16.402 0.50 11.55 H new ATOM 0 HG3AARG D 42 21.678 27.712 15.975 0.50 11.55 H new ATOM 0 HG3BARG D 42 19.945 25.295 15.474 0.50 11.55 H new ATOM 0 HD2AARG D 42 22.544 25.356 14.762 0.50 12.18 H new ATOM 0 HD2BARG D 42 22.094 24.660 15.369 0.50 12.18 H new ATOM 0 HD3AARG D 42 23.674 26.348 15.174 0.50 12.18 H new ATOM 0 HD3BARG D 42 22.625 26.087 15.706 0.50 12.18 H new ATOM 0 HE AARG D 42 22.312 26.103 17.320 0.50 12.09 H new ATOM 0 HE BARG D 42 21.634 25.535 17.904 0.50 12.09 H new ATOM 0 HH11AARG D 42 23.808 23.785 15.477 0.50 8.98 H new ATOM 0 HH11BARG D 42 23.392 23.374 16.105 0.50 8.98 H new ATOM 0 HH12AARG D 42 24.045 22.823 16.589 0.50 8.98 H new ATOM 0 HH12BARG D 42 23.897 22.579 17.260 0.50 8.98 H new ATOM 0 HH21AARG D 42 22.704 24.650 19.011 0.50 9.57 H new ATOM 0 HH21BARG D 42 22.442 24.344 19.642 0.50 9.57 H new ATOM 0 HH22AARG D 42 23.374 23.348 18.739 0.50 9.57 H new ATOM 0 HH22BARG D 42 23.322 23.166 19.401 0.50 9.57 H new ATOM 3357 N LEU D 43 17.979 26.911 12.597 1.00 10.36 N ATOM 3358 CA LEU D 43 16.948 26.029 12.074 1.00 10.95 C ATOM 3359 C LEU D 43 17.313 24.558 12.149 1.00 10.45 C ATOM 3360 O LEU D 43 18.491 24.175 12.087 1.00 10.49 O ATOM 3361 CB LEU D 43 16.650 26.323 10.598 1.00 11.49 C ATOM 3362 CG LEU D 43 15.896 27.591 10.270 1.00 14.15 C ATOM 3363 CD1 LEU D 43 15.652 27.599 8.734 1.00 14.73 C ATOM 3364 CD2 LEU D 43 14.588 27.747 11.031 1.00 17.04 C ATOM 0 H LEU D 43 18.432 27.337 12.003 1.00 10.36 H new ATOM 0 HA LEU D 43 16.178 26.203 12.638 1.00 10.95 H new ATOM 0 HB2 LEU D 43 17.495 26.347 10.123 1.00 11.49 H new ATOM 0 HB3 LEU D 43 16.145 25.575 10.241 1.00 11.49 H new ATOM 0 HG LEU D 43 16.433 28.349 10.550 1.00 14.15 H new ATOM 0 HD11 LEU D 43 15.168 28.403 8.487 1.00 14.73 H new ATOM 0 HD12 LEU D 43 16.504 27.580 8.271 1.00 14.73 H new ATOM 0 HD13 LEU D 43 15.132 26.819 8.485 1.00 14.73 H new ATOM 0 HD21 LEU D 43 14.160 28.578 10.772 1.00 17.04 H new ATOM 0 HD22 LEU D 43 14.001 27.003 10.822 1.00 17.04 H new ATOM 0 HD23 LEU D 43 14.767 27.759 11.984 1.00 17.04 H new ATOM 3365 N VAL D 44 16.275 23.718 12.241 1.00 10.78 N ATOM 3366 CA VAL D 44 16.455 22.317 11.953 1.00 11.50 C ATOM 3367 C VAL D 44 16.370 22.129 10.455 1.00 12.84 C ATOM 3368 O VAL D 44 15.304 22.315 9.846 1.00 12.39 O ATOM 3369 CB VAL D 44 15.430 21.451 12.659 1.00 11.37 C ATOM 3370 CG1 VAL D 44 15.566 19.984 12.215 1.00 10.17 C ATOM 3371 CG2 VAL D 44 15.501 21.656 14.207 1.00 11.47 C ATOM 0 H VAL D 44 15.477 23.946 12.466 1.00 10.78 H new ATOM 0 HA VAL D 44 17.323 22.037 12.282 1.00 11.50 H new ATOM 0 HB VAL D 44 14.537 21.728 12.399 1.00 11.37 H new ATOM 0 HG11 VAL D 44 14.904 19.444 12.675 1.00 10.17 H new ATOM 0 HG12 VAL D 44 15.425 19.921 11.257 1.00 10.17 H new ATOM 0 HG13 VAL D 44 16.454 19.661 12.433 1.00 10.17 H new ATOM 0 HG21 VAL D 44 14.839 21.094 14.639 1.00 11.47 H new ATOM 0 HG22 VAL D 44 16.385 21.416 14.525 1.00 11.47 H new ATOM 0 HG23 VAL D 44 15.323 22.586 14.419 1.00 11.47 H new ATOM 3372 N ALA D 45 17.493 21.770 9.857 1.00 14.94 N ATOM 3373 CA ALA D 45 17.556 21.622 8.380 1.00 16.76 C ATOM 3374 C ALA D 45 17.474 20.186 7.916 1.00 17.77 C ATOM 3375 O ALA D 45 17.209 19.925 6.735 1.00 19.09 O ATOM 3376 CB ALA D 45 18.809 22.233 7.856 1.00 16.88 C ATOM 0 H ALA D 45 18.230 21.605 10.268 1.00 14.94 H new ATOM 0 HA ALA D 45 16.777 22.082 8.029 1.00 16.76 H new ATOM 0 HB1 ALA D 45 18.840 22.131 6.892 1.00 16.88 H new ATOM 0 HB2 ALA D 45 18.828 23.176 8.082 1.00 16.88 H new ATOM 0 HB3 ALA D 45 19.576 21.790 8.253 1.00 16.88 H new ATOM 3377 N GLY D 46 17.744 19.252 8.817 1.00 17.85 N ATOM 3378 CA GLY D 46 17.784 17.855 8.461 1.00 18.20 C ATOM 3379 C GLY D 46 17.339 17.001 9.611 1.00 18.46 C ATOM 3380 O GLY D 46 17.662 17.291 10.784 1.00 17.57 O ATOM 0 H GLY D 46 17.907 19.414 9.646 1.00 17.85 H new ATOM 0 HA2 GLY D 46 17.212 17.696 7.694 1.00 18.20 H new ATOM 0 HA3 GLY D 46 18.685 17.609 8.199 1.00 18.20 H new ATOM 3381 N ASN D 47 16.593 15.950 9.275 1.00 18.81 N ATOM 3382 CA ASN D 47 16.098 14.990 10.250 1.00 20.59 C ATOM 3383 C ASN D 47 16.490 13.575 9.833 1.00 22.26 C ATOM 3384 O ASN D 47 15.637 12.765 9.478 1.00 22.71 O ATOM 3385 CB ASN D 47 14.573 15.101 10.382 1.00 19.73 C ATOM 3386 CG ASN D 47 14.143 16.371 11.111 1.00 21.72 C ATOM 3387 OD1 ASN D 47 14.118 16.405 12.344 1.00 23.30 O ATOM 3388 ND2 ASN D 47 13.752 17.402 10.351 1.00 20.19 N ATOM 0 H ASN D 47 16.360 15.775 8.466 1.00 18.81 H new ATOM 0 HA ASN D 47 16.497 15.186 11.112 1.00 20.59 H new ATOM 0 HB2 ASN D 47 14.173 15.087 9.499 1.00 19.73 H new ATOM 0 HB3 ASN D 47 14.235 14.327 10.859 1.00 19.73 H new ATOM 0 HD21 ASN D 47 13.469 18.125 10.720 1.00 20.19 H new ATOM 0 HD22 ASN D 47 13.784 17.341 9.494 1.00 20.19 H new ATOM 3389 N PRO D 48 17.785 13.269 9.875 1.00 24.26 N ATOM 3390 CA PRO D 48 18.189 11.909 9.497 1.00 26.05 C ATOM 3391 C PRO D 48 17.500 10.856 10.403 1.00 28.27 C ATOM 3392 O PRO D 48 17.356 11.086 11.605 1.00 28.48 O ATOM 3393 CB PRO D 48 19.700 11.927 9.695 1.00 25.86 C ATOM 3394 CG PRO D 48 19.971 13.057 10.624 1.00 26.01 C ATOM 3395 CD PRO D 48 18.894 14.069 10.425 1.00 23.43 C ATOM 0 HA PRO D 48 17.936 11.668 8.592 1.00 26.05 H new ATOM 0 HB2 PRO D 48 20.013 11.087 10.067 1.00 25.86 H new ATOM 0 HB3 PRO D 48 20.161 12.052 8.851 1.00 25.86 H new ATOM 0 HG2 PRO D 48 19.983 12.748 11.543 1.00 26.01 H new ATOM 0 HG3 PRO D 48 20.842 13.445 10.444 1.00 26.01 H new ATOM 0 HD2 PRO D 48 18.647 14.500 11.258 1.00 23.43 H new ATOM 0 HD3 PRO D 48 19.169 14.770 9.814 1.00 23.43 H new ATOM 3396 N THR D 49 17.042 9.729 9.859 1.00 30.96 N ATOM 3397 CA THR D 49 16.343 8.729 10.714 1.00 33.90 C ATOM 3398 C THR D 49 17.097 7.408 10.696 1.00 35.37 C ATOM 3399 O THR D 49 16.754 6.433 11.364 1.00 35.12 O ATOM 3400 CB THR D 49 14.885 8.499 10.269 1.00 34.18 C ATOM 3401 OG1 THR D 49 14.884 8.023 8.912 1.00 36.50 O ATOM 3402 CG2 THR D 49 14.075 9.805 10.362 1.00 35.17 C ATOM 0 H THR D 49 17.115 9.517 9.029 1.00 30.96 H new ATOM 0 HA THR D 49 16.323 9.086 11.616 1.00 33.90 H new ATOM 0 HB THR D 49 14.473 7.844 10.854 1.00 34.18 H new ATOM 0 HG1 THR D 49 14.093 7.893 8.661 1.00 36.50 H new ATOM 0 HG21 THR D 49 13.162 9.641 10.079 1.00 35.17 H new ATOM 0 HG22 THR D 49 14.076 10.122 11.279 1.00 35.17 H new ATOM 0 HG23 THR D 49 14.476 10.476 9.787 1.00 35.17 H new ATOM 3403 N ASP D 50 18.149 7.436 9.908 1.00 37.30 N ATOM 3404 CA ASP D 50 19.031 6.339 9.639 1.00 39.55 C ATOM 3405 C ASP D 50 20.051 6.117 10.792 1.00 39.34 C ATOM 3406 O ASP D 50 21.237 5.878 10.566 1.00 39.82 O ATOM 3407 CB ASP D 50 19.710 6.754 8.334 1.00 40.37 C ATOM 3408 CG ASP D 50 20.876 5.919 7.994 1.00 44.70 C ATOM 3409 OD1 ASP D 50 20.693 4.687 7.826 1.00 49.14 O ATOM 3410 OD2 ASP D 50 21.980 6.514 7.882 1.00 50.90 O ATOM 0 H ASP D 50 18.379 8.150 9.488 1.00 37.30 H new ATOM 0 HA ASP D 50 18.570 5.488 9.567 1.00 39.55 H new ATOM 0 HB2 ASP D 50 19.065 6.707 7.611 1.00 40.37 H new ATOM 0 HB3 ASP D 50 19.992 7.680 8.403 1.00 40.37 H new ATOM 3411 N THR D 51 19.579 6.193 12.029 1.00 39.35 N ATOM 3412 CA THR D 51 20.452 6.177 13.210 1.00 39.58 C ATOM 3413 C THR D 51 21.018 4.766 13.531 1.00 39.51 C ATOM 3414 O THR D 51 20.355 3.758 13.238 1.00 39.01 O ATOM 3415 CB THR D 51 19.699 6.737 14.456 1.00 39.47 C ATOM 3416 OG1 THR D 51 18.580 5.893 14.761 1.00 40.10 O ATOM 3417 CG2 THR D 51 19.182 8.137 14.203 1.00 38.80 C ATOM 0 H THR D 51 18.742 6.256 12.214 1.00 39.35 H new ATOM 0 HA THR D 51 21.207 6.747 12.997 1.00 39.58 H new ATOM 0 HB THR D 51 20.326 6.759 15.196 1.00 39.47 H new ATOM 0 HG1 THR D 51 18.842 5.229 15.203 1.00 40.10 H new ATOM 0 HG21 THR D 51 18.719 8.459 14.992 1.00 38.80 H new ATOM 0 HG22 THR D 51 19.926 8.726 14.002 1.00 38.80 H new ATOM 0 HG23 THR D 51 18.568 8.125 13.452 1.00 38.80 H new ATOM 3418 N ALA D 52 22.220 4.711 14.136 1.00 39.32 N ATOM 3419 CA ALA D 52 22.899 3.427 14.503 1.00 39.16 C ATOM 3420 C ALA D 52 22.539 2.889 15.894 1.00 39.11 C ATOM 3421 O ALA D 52 23.017 1.815 16.296 1.00 39.64 O ATOM 3422 CB ALA D 52 24.423 3.545 14.356 1.00 38.41 C ATOM 0 H ALA D 52 22.671 5.412 14.348 1.00 39.32 H new ATOM 0 HA ALA D 52 22.559 2.775 13.870 1.00 39.16 H new ATOM 0 HB1 ALA D 52 24.838 2.703 14.599 1.00 38.41 H new ATOM 0 HB2 ALA D 52 24.644 3.760 13.436 1.00 38.41 H new ATOM 0 HB3 ALA D 52 24.751 4.247 14.940 1.00 38.41 H new ATOM 3423 N VAL D 53 21.755 3.674 16.639 1.00 38.30 N ATOM 3424 CA VAL D 53 20.980 3.202 17.793 1.00 37.05 C ATOM 3425 C VAL D 53 19.488 3.521 17.501 1.00 36.16 C ATOM 3426 O VAL D 53 19.189 4.263 16.562 1.00 35.71 O ATOM 3427 CB VAL D 53 21.468 3.798 19.197 1.00 37.61 C ATOM 3428 CG1 VAL D 53 22.982 4.102 19.197 1.00 37.69 C ATOM 3429 CG2 VAL D 53 20.659 5.033 19.635 1.00 35.79 C ATOM 0 H VAL D 53 21.657 4.514 16.484 1.00 38.30 H new ATOM 0 HA VAL D 53 21.116 2.247 17.896 1.00 37.05 H new ATOM 0 HB VAL D 53 21.301 3.104 19.853 1.00 37.61 H new ATOM 0 HG11 VAL D 53 23.240 4.460 20.061 1.00 37.69 H new ATOM 0 HG12 VAL D 53 23.476 3.285 19.025 1.00 37.69 H new ATOM 0 HG13 VAL D 53 23.182 4.752 18.505 1.00 37.69 H new ATOM 0 HG21 VAL D 53 20.993 5.353 20.487 1.00 35.79 H new ATOM 0 HG22 VAL D 53 20.750 5.732 18.969 1.00 35.79 H new ATOM 0 HG23 VAL D 53 19.724 4.792 19.725 1.00 35.79 H new ATOM 3430 N PRO D 54 18.555 2.968 18.292 1.00 35.05 N ATOM 3431 CA PRO D 54 17.130 3.208 17.983 1.00 34.29 C ATOM 3432 C PRO D 54 16.718 4.690 17.839 1.00 33.46 C ATOM 3433 O PRO D 54 17.013 5.513 18.718 1.00 32.07 O ATOM 3434 CB PRO D 54 16.402 2.563 19.161 1.00 34.23 C ATOM 3435 CG PRO D 54 17.360 1.522 19.668 1.00 34.61 C ATOM 3436 CD PRO D 54 18.737 1.975 19.366 1.00 35.09 C ATOM 0 HA PRO D 54 16.913 2.840 17.112 1.00 34.29 H new ATOM 0 HB2 PRO D 54 16.193 3.216 19.848 1.00 34.23 H new ATOM 0 HB3 PRO D 54 15.562 2.165 18.883 1.00 34.23 H new ATOM 0 HG2 PRO D 54 17.247 1.395 20.623 1.00 34.61 H new ATOM 0 HG3 PRO D 54 17.185 0.667 19.246 1.00 34.61 H new ATOM 0 HD2 PRO D 54 19.161 2.367 20.145 1.00 35.09 H new ATOM 0 HD3 PRO D 54 19.299 1.238 19.078 1.00 35.09 H new ATOM 3437 N TYR D 55 16.001 4.997 16.753 1.00 32.58 N ATOM 3438 CA TYR D 55 15.600 6.383 16.428 1.00 30.91 C ATOM 3439 C TYR D 55 14.489 6.899 17.343 1.00 30.20 C ATOM 3440 O TYR D 55 13.485 6.214 17.525 1.00 30.60 O ATOM 3441 CB TYR D 55 15.125 6.421 14.983 1.00 30.97 C ATOM 3442 CG TYR D 55 14.542 7.752 14.629 1.00 32.22 C ATOM 3443 CD1 TYR D 55 15.346 8.899 14.615 1.00 31.61 C ATOM 3444 CD2 TYR D 55 13.176 7.879 14.323 1.00 31.62 C ATOM 3445 CE1 TYR D 55 14.794 10.145 14.287 1.00 32.80 C ATOM 3446 CE2 TYR D 55 12.618 9.110 13.998 1.00 33.27 C ATOM 3447 CZ TYR D 55 13.427 10.237 13.988 1.00 33.25 C ATOM 3448 OH TYR D 55 12.879 11.444 13.663 1.00 34.05 O ATOM 0 H TYR D 55 15.732 4.413 16.182 1.00 32.58 H new ATOM 0 HA TYR D 55 16.369 6.959 16.560 1.00 30.91 H new ATOM 0 HB2 TYR D 55 15.869 6.225 14.392 1.00 30.97 H new ATOM 0 HB3 TYR D 55 14.461 5.728 14.842 1.00 30.97 H new ATOM 0 HD1 TYR D 55 16.250 8.834 14.824 1.00 31.61 H new ATOM 0 HD2 TYR D 55 12.634 7.123 14.338 1.00 31.62 H new ATOM 0 HE1 TYR D 55 15.330 10.905 14.268 1.00 32.80 H new ATOM 0 HE2 TYR D 55 11.714 9.177 13.790 1.00 33.27 H new ATOM 0 HH TYR D 55 12.059 11.347 13.509 1.00 34.05 H new ATOM 3449 N LEU D 56 14.654 8.089 17.920 1.00 27.86 N ATOM 3450 CA LEU D 56 13.613 8.713 18.766 1.00 26.07 C ATOM 3451 C LEU D 56 12.777 9.725 17.964 1.00 26.05 C ATOM 3452 O LEU D 56 13.339 10.633 17.369 1.00 24.08 O ATOM 3453 CB LEU D 56 14.254 9.437 19.957 1.00 25.06 C ATOM 3454 CG LEU D 56 13.317 10.194 20.906 1.00 26.19 C ATOM 3455 CD1 LEU D 56 12.349 9.237 21.589 1.00 26.72 C ATOM 3456 CD2 LEU D 56 14.089 10.979 21.929 1.00 24.83 C ATOM 0 H LEU D 56 15.367 8.562 17.837 1.00 27.86 H new ATOM 0 HA LEU D 56 13.033 8.003 19.084 1.00 26.07 H new ATOM 0 HB2 LEU D 56 14.744 8.782 20.478 1.00 25.06 H new ATOM 0 HB3 LEU D 56 14.904 10.068 19.610 1.00 25.06 H new ATOM 0 HG LEU D 56 12.805 10.822 20.372 1.00 26.19 H new ATOM 0 HD11 LEU D 56 11.767 9.735 22.184 1.00 26.72 H new ATOM 0 HD12 LEU D 56 11.814 8.784 20.918 1.00 26.72 H new ATOM 0 HD13 LEU D 56 12.849 8.582 22.101 1.00 26.72 H new ATOM 0 HD21 LEU D 56 13.471 11.446 22.513 1.00 24.83 H new ATOM 0 HD22 LEU D 56 14.637 10.375 22.455 1.00 24.83 H new ATOM 0 HD23 LEU D 56 14.658 11.624 21.480 1.00 24.83 H new ATOM 3457 N ASP D 57 11.452 9.565 17.967 1.00 26.34 N ATOM 3458 CA ASP D 57 10.540 10.488 17.269 1.00 27.49 C ATOM 3459 C ASP D 57 9.923 11.461 18.278 1.00 26.19 C ATOM 3460 O ASP D 57 9.236 11.048 19.206 1.00 26.26 O ATOM 3461 CB ASP D 57 9.461 9.685 16.518 1.00 28.89 C ATOM 3462 CG ASP D 57 8.510 10.556 15.747 1.00 33.07 C ATOM 3463 OD1 ASP D 57 7.736 11.320 16.367 1.00 38.16 O ATOM 3464 OD2 ASP D 57 8.497 10.447 14.507 1.00 38.86 O ATOM 0 H ASP D 57 11.053 8.920 18.372 1.00 26.34 H new ATOM 0 HA ASP D 57 11.032 11.008 16.614 1.00 27.49 H new ATOM 0 HB2 ASP D 57 9.892 9.066 15.908 1.00 28.89 H new ATOM 0 HB3 ASP D 57 8.960 9.152 17.155 1.00 28.89 H new ATOM 3465 N VAL D 58 10.223 12.755 18.106 1.00 25.68 N ATOM 3466 CA VAL D 58 9.687 13.845 18.922 1.00 23.33 C ATOM 3467 C VAL D 58 8.856 14.830 18.075 1.00 23.72 C ATOM 3468 O VAL D 58 8.503 15.922 18.546 1.00 23.85 O ATOM 3469 CB VAL D 58 10.800 14.605 19.690 1.00 23.90 C ATOM 3470 CG1 VAL D 58 11.476 13.685 20.700 1.00 22.22 C ATOM 3471 CG2 VAL D 58 11.833 15.210 18.722 1.00 22.32 C ATOM 0 H VAL D 58 10.760 13.027 17.492 1.00 25.68 H new ATOM 0 HA VAL D 58 9.103 13.434 19.578 1.00 23.33 H new ATOM 0 HB VAL D 58 10.385 15.337 20.172 1.00 23.90 H new ATOM 0 HG11 VAL D 58 12.168 14.174 21.171 1.00 22.22 H new ATOM 0 HG12 VAL D 58 10.818 13.363 21.336 1.00 22.22 H new ATOM 0 HG13 VAL D 58 11.872 12.931 20.236 1.00 22.22 H new ATOM 0 HG21 VAL D 58 12.515 15.678 19.228 1.00 22.32 H new ATOM 0 HG22 VAL D 58 12.245 14.501 18.203 1.00 22.32 H new ATOM 0 HG23 VAL D 58 11.391 15.832 18.124 1.00 22.32 H new ATOM 3472 N GLY D 59 8.536 14.448 16.833 1.00 22.19 N ATOM 3473 CA GLY D 59 7.697 15.277 15.997 1.00 21.46 C ATOM 3474 C GLY D 59 8.551 16.237 15.202 1.00 20.24 C ATOM 3475 O GLY D 59 9.748 16.014 15.084 1.00 19.17 O ATOM 0 H GLY D 59 8.798 13.715 16.467 1.00 22.19 H new ATOM 0 HA2 GLY D 59 7.176 14.722 15.396 1.00 21.46 H new ATOM 0 HA3 GLY D 59 7.067 15.770 16.545 1.00 21.46 H new ATOM 3476 N ARG D 60 7.930 17.274 14.641 1.00 19.12 N ATOM 3477 CA ARG D 60 8.628 18.254 13.798 1.00 19.49 C ATOM 3478 C ARG D 60 9.095 19.379 14.716 1.00 18.16 C ATOM 3479 O ARG D 60 8.284 20.090 15.302 1.00 18.44 O ATOM 3480 CB ARG D 60 7.752 18.833 12.679 1.00 19.96 C ATOM 3481 CG ARG D 60 8.602 19.517 11.527 1.00 23.40 C ATOM 3482 CD ARG D 60 7.782 20.494 10.635 1.00 29.45 C ATOM 3483 NE ARG D 60 7.386 21.700 11.375 1.00 31.74 N ATOM 3484 CZ ARG D 60 6.151 21.951 11.821 1.00 32.06 C ATOM 3485 NH1 ARG D 60 5.914 23.068 12.507 1.00 28.06 N ATOM 3486 NH2 ARG D 60 5.147 21.096 11.560 1.00 30.70 N ATOM 0 H ARG D 60 7.090 17.432 14.737 1.00 19.12 H new ATOM 0 HA ARG D 60 9.365 17.808 13.353 1.00 19.49 H new ATOM 0 HB2 ARG D 60 7.210 18.124 12.298 1.00 19.96 H new ATOM 0 HB3 ARG D 60 7.142 19.486 13.056 1.00 19.96 H new ATOM 0 HG2 ARG D 60 9.342 20.001 11.927 1.00 23.40 H new ATOM 0 HG3 ARG D 60 8.986 18.825 10.966 1.00 23.40 H new ATOM 0 HD2 ARG D 60 8.310 20.747 9.861 1.00 29.45 H new ATOM 0 HD3 ARG D 60 6.990 20.043 10.303 1.00 29.45 H new ATOM 0 HE ARG D 60 7.994 22.288 11.533 1.00 31.74 H new ATOM 0 HH11 ARG D 60 6.553 23.622 12.660 1.00 28.06 H new ATOM 0 HH12 ARG D 60 5.122 23.235 12.796 1.00 28.06 H new ATOM 0 HH21 ARG D 60 5.297 20.383 11.104 1.00 30.70 H new ATOM 0 HH22 ARG D 60 4.354 21.262 11.849 1.00 30.70 H new ATOM 3487 N ILE D 61 10.406 19.489 14.878 1.00 15.49 N ATOM 3488 CA ILE D 61 10.985 20.638 15.544 1.00 13.85 C ATOM 3489 C ILE D 61 11.506 21.580 14.458 1.00 13.29 C ATOM 3490 O ILE D 61 12.227 21.148 13.576 1.00 13.43 O ATOM 3491 CB ILE D 61 12.154 20.209 16.445 1.00 14.85 C ATOM 3492 CG1 ILE D 61 11.737 19.048 17.379 1.00 12.94 C ATOM 3493 CG2 ILE D 61 12.683 21.415 17.231 1.00 12.40 C ATOM 3494 CD1 ILE D 61 10.487 19.383 18.292 1.00 13.15 C ATOM 0 H ILE D 61 10.977 18.906 14.608 1.00 15.49 H new ATOM 0 HA ILE D 61 10.318 21.072 16.099 1.00 13.85 H new ATOM 0 HB ILE D 61 12.875 19.877 15.887 1.00 14.85 H new ATOM 0 HG12 ILE D 61 11.534 18.267 16.840 1.00 12.94 H new ATOM 0 HG13 ILE D 61 12.488 18.814 17.946 1.00 12.94 H new ATOM 0 HG21 ILE D 61 13.420 21.135 17.796 1.00 12.40 H new ATOM 0 HG22 ILE D 61 12.991 22.095 16.612 1.00 12.40 H new ATOM 0 HG23 ILE D 61 11.973 21.779 17.783 1.00 12.40 H new ATOM 0 HD11 ILE D 61 10.279 18.617 18.850 1.00 13.15 H new ATOM 0 HD12 ILE D 61 10.692 20.146 18.854 1.00 13.15 H new ATOM 0 HD13 ILE D 61 9.723 19.591 17.732 1.00 13.15 H new ATOM 3495 N ASP D 62 11.162 22.864 14.529 1.00 12.83 N ATOM 3496 CA ASP D 62 11.564 23.815 13.507 1.00 12.34 C ATOM 3497 C ASP D 62 12.876 24.524 13.770 1.00 11.79 C ATOM 3498 O ASP D 62 13.553 24.897 12.820 1.00 10.24 O ATOM 3499 CB ASP D 62 10.467 24.849 13.254 1.00 13.01 C ATOM 3500 CG ASP D 62 9.223 24.216 12.704 1.00 16.11 C ATOM 3501 OD1 ASP D 62 9.327 23.528 11.664 1.00 16.64 O ATOM 3502 OD2 ASP D 62 8.162 24.366 13.320 1.00 17.89 O ATOM 0 H ASP D 62 10.694 23.202 15.166 1.00 12.83 H new ATOM 0 HA ASP D 62 11.706 23.271 12.717 1.00 12.34 H new ATOM 0 HB2 ASP D 62 10.258 25.308 14.082 1.00 13.01 H new ATOM 0 HB3 ASP D 62 10.791 25.519 12.632 1.00 13.01 H new ATOM 3503 N ALA D 63 13.168 24.817 15.042 1.00 11.62 N ATOM 3504 CA ALA D 63 14.388 25.497 15.422 1.00 10.17 C ATOM 3505 C ALA D 63 14.887 25.067 16.793 1.00 10.04 C ATOM 3506 O ALA D 63 14.130 24.529 17.611 1.00 10.33 O ATOM 3507 CB ALA D 63 14.175 27.051 15.378 1.00 11.07 C ATOM 0 H ALA D 63 12.655 24.622 15.704 1.00 11.62 H new ATOM 0 HA ALA D 63 15.071 25.247 14.780 1.00 10.17 H new ATOM 0 HB1 ALA D 63 14.997 27.498 15.634 1.00 11.07 H new ATOM 0 HB2 ALA D 63 13.928 27.319 14.479 1.00 11.07 H new ATOM 0 HB3 ALA D 63 13.468 27.298 15.994 1.00 11.07 H new ATOM 3508 N ILE D 64 16.155 25.359 17.061 1.00 9.93 N ATOM 3509 CA ILE D 64 16.767 25.093 18.341 1.00 9.48 C ATOM 3510 C ILE D 64 17.239 26.461 18.842 1.00 10.07 C ATOM 3511 O ILE D 64 17.985 27.180 18.132 1.00 8.90 O ATOM 3512 CB ILE D 64 18.053 24.216 18.184 1.00 10.63 C ATOM 3513 CG1 ILE D 64 17.753 22.901 17.455 1.00 9.80 C ATOM 3514 CG2 ILE D 64 18.799 23.990 19.542 1.00 9.68 C ATOM 3515 CD1 ILE D 64 16.865 22.019 18.200 1.00 13.07 C ATOM 0 H ILE D 64 16.686 25.723 16.491 1.00 9.93 H new ATOM 0 HA ILE D 64 16.142 24.636 18.925 1.00 9.48 H new ATOM 0 HB ILE D 64 18.667 24.717 17.625 1.00 10.63 H new ATOM 0 HG12 ILE D 64 17.353 23.100 16.594 1.00 9.80 H new ATOM 0 HG13 ILE D 64 18.587 22.438 17.280 1.00 9.80 H new ATOM 0 HG21 ILE D 64 19.586 23.443 19.392 1.00 9.68 H new ATOM 0 HG22 ILE D 64 19.067 24.846 19.911 1.00 9.68 H new ATOM 0 HG23 ILE D 64 18.207 23.541 20.166 1.00 9.68 H new ATOM 0 HD11 ILE D 64 16.713 21.207 17.691 1.00 13.07 H new ATOM 0 HD12 ILE D 64 17.271 21.794 19.052 1.00 13.07 H new ATOM 0 HD13 ILE D 64 16.019 22.467 18.354 1.00 13.07 H new ATOM 3516 N GLY D 65 16.880 26.794 20.082 1.00 9.00 N ATOM 3517 CA GLY D 65 17.377 28.055 20.657 1.00 7.71 C ATOM 3518 C GLY D 65 18.217 27.718 21.866 1.00 8.49 C ATOM 3519 O GLY D 65 18.094 26.600 22.437 1.00 9.94 O ATOM 0 H GLY D 65 16.370 26.327 20.594 1.00 9.00 H new ATOM 0 HA2 GLY D 65 17.903 28.541 20.003 1.00 7.71 H new ATOM 0 HA3 GLY D 65 16.636 28.628 20.908 1.00 7.71 H new ATOM 3520 N GLU D 66 19.068 28.657 22.278 1.00 8.27 N ATOM 3521 CA GLU D 66 19.881 28.434 23.485 1.00 8.40 C ATOM 3522 C GLU D 66 20.337 29.714 24.146 1.00 8.44 C ATOM 3523 O GLU D 66 20.791 30.621 23.459 1.00 8.45 O ATOM 3524 CB GLU D 66 21.073 27.457 23.204 1.00 9.21 C ATOM 3525 CG GLU D 66 22.001 27.045 24.444 1.00 7.30 C ATOM 3526 CD GLU D 66 23.036 25.948 24.120 1.00 10.58 C ATOM 3527 OE1 GLU D 66 23.217 25.638 22.917 1.00 9.19 O ATOM 3528 OE2 GLU D 66 23.684 25.372 25.061 1.00 11.55 O ATOM 0 H GLU D 66 19.192 29.413 21.888 1.00 8.27 H new ATOM 0 HA GLU D 66 19.296 28.004 24.129 1.00 8.40 H new ATOM 0 HB2 GLU D 66 20.709 26.644 22.819 1.00 9.21 H new ATOM 0 HB3 GLU D 66 21.639 27.862 22.528 1.00 9.21 H new ATOM 0 HG2 GLU D 66 22.468 27.833 24.761 1.00 7.30 H new ATOM 0 HG3 GLU D 66 21.436 26.738 25.170 1.00 7.30 H new ATOM 3529 N CYS D 67 20.229 29.773 25.501 1.00 8.42 N ATOM 3530 CA CYS D 67 20.700 30.916 26.296 1.00 8.78 C ATOM 3531 C CYS D 67 21.807 30.461 27.244 1.00 9.40 C ATOM 3532 O CYS D 67 21.764 29.318 27.747 1.00 8.63 O ATOM 3533 CB CYS D 67 19.543 31.503 27.130 1.00 8.67 C ATOM 3534 SG CYS D 67 18.230 32.158 26.048 1.00 11.94 S ATOM 0 H CYS D 67 19.879 29.145 25.973 1.00 8.42 H new ATOM 0 HA CYS D 67 21.037 31.594 25.690 1.00 8.78 H new ATOM 0 HB2 CYS D 67 19.177 30.817 27.710 1.00 8.67 H new ATOM 0 HB3 CYS D 67 19.878 32.210 27.703 1.00 8.67 H new ATOM 0 HG CYS D 67 17.343 32.606 26.721 1.00 11.94 H new ATOM 3535 N TRP D 68 22.791 31.350 27.434 1.00 8.26 N ATOM 3536 CA TRP D 68 23.906 31.175 28.339 1.00 9.30 C ATOM 3537 C TRP D 68 23.876 32.315 29.341 1.00 9.56 C ATOM 3538 O TRP D 68 23.665 33.467 28.941 1.00 10.48 O ATOM 3539 CB TRP D 68 25.215 31.332 27.564 1.00 8.36 C ATOM 3540 CG TRP D 68 25.705 30.212 26.758 1.00 9.98 C ATOM 3541 CD1 TRP D 68 26.756 29.386 27.072 1.00 10.84 C ATOM 3542 CD2 TRP D 68 25.282 29.843 25.435 1.00 11.59 C ATOM 3543 NE1 TRP D 68 26.973 28.503 26.065 1.00 8.42 N ATOM 3544 CE2 TRP D 68 26.089 28.746 25.042 1.00 10.84 C ATOM 3545 CE3 TRP D 68 24.248 30.288 24.566 1.00 10.13 C ATOM 3546 CZ2 TRP D 68 25.943 28.101 23.792 1.00 11.42 C ATOM 3547 CZ3 TRP D 68 24.101 29.633 23.309 1.00 12.58 C ATOM 3548 CH2 TRP D 68 24.959 28.561 22.945 1.00 9.40 C ATOM 0 H TRP D 68 22.817 32.101 27.015 1.00 8.26 H new ATOM 0 HA TRP D 68 23.847 30.304 28.761 1.00 9.30 H new ATOM 0 HB2 TRP D 68 25.115 32.095 26.974 1.00 8.36 H new ATOM 0 HB3 TRP D 68 25.908 31.557 28.204 1.00 8.36 H new ATOM 0 HD1 TRP D 68 27.248 29.426 27.860 1.00 10.84 H new ATOM 0 HE1 TRP D 68 27.572 27.886 26.067 1.00 8.42 H new ATOM 0 HE3 TRP D 68 23.684 30.986 24.811 1.00 10.13 H new ATOM 0 HZ2 TRP D 68 26.492 27.391 23.550 1.00 11.42 H new ATOM 0 HZ3 TRP D 68 23.436 29.910 22.721 1.00 12.58 H new ATOM 0 HH2 TRP D 68 24.854 28.159 22.113 1.00 9.40 H new ATOM 3549 N PHE D 69 24.081 32.023 30.632 1.00 9.98 N ATOM 3550 CA PHE D 69 24.124 33.094 31.675 1.00 10.30 C ATOM 3551 C PHE D 69 25.360 32.801 32.505 1.00 11.05 C ATOM 3552 O PHE D 69 25.609 31.635 32.855 1.00 11.37 O ATOM 3553 CB PHE D 69 22.864 33.107 32.585 1.00 9.71 C ATOM 3554 CG PHE D 69 21.569 33.020 31.817 1.00 10.01 C ATOM 3555 CD1 PHE D 69 20.947 34.193 31.347 1.00 7.41 C ATOM 3556 CD2 PHE D 69 21.022 31.788 31.500 1.00 6.05 C ATOM 3557 CE1 PHE D 69 19.793 34.147 30.642 1.00 9.91 C ATOM 3558 CE2 PHE D 69 19.807 31.723 30.762 1.00 9.53 C ATOM 3559 CZ PHE D 69 19.215 32.903 30.321 1.00 11.84 C ATOM 0 H PHE D 69 24.197 31.226 30.933 1.00 9.98 H new ATOM 0 HA PHE D 69 24.148 33.967 31.253 1.00 10.30 H new ATOM 0 HB2 PHE D 69 22.914 32.364 33.206 1.00 9.71 H new ATOM 0 HB3 PHE D 69 22.864 33.920 33.115 1.00 9.71 H new ATOM 0 HD1 PHE D 69 21.338 35.018 31.525 1.00 7.41 H new ATOM 0 HD2 PHE D 69 21.447 31.006 31.768 1.00 6.05 H new ATOM 0 HE1 PHE D 69 19.382 34.936 30.370 1.00 9.91 H new ATOM 0 HE2 PHE D 69 19.413 30.901 30.576 1.00 9.53 H new ATOM 0 HZ PHE D 69 18.436 32.870 29.813 1.00 11.84 H new ATOM 3560 N ALA D 70 26.134 33.857 32.772 1.00 12.43 N ATOM 3561 CA ALA D 70 27.409 33.768 33.492 1.00 13.98 C ATOM 3562 C ALA D 70 27.295 33.261 34.916 1.00 13.56 C ATOM 3563 O ALA D 70 28.235 32.639 35.409 1.00 15.00 O ATOM 3564 CB ALA D 70 28.145 35.124 33.472 1.00 13.89 C ATOM 0 H ALA D 70 25.929 34.658 32.536 1.00 12.43 H new ATOM 0 HA ALA D 70 27.924 33.101 33.012 1.00 13.98 H new ATOM 0 HB1 ALA D 70 28.984 35.044 33.952 1.00 13.89 H new ATOM 0 HB2 ALA D 70 28.322 35.383 32.554 1.00 13.89 H new ATOM 0 HB3 ALA D 70 27.593 35.799 33.897 1.00 13.89 H new ATOM 3565 N SER D 71 26.166 33.520 35.572 1.00 13.69 N ATOM 3566 CA SER D 71 26.017 33.276 36.988 1.00 14.82 C ATOM 3567 C SER D 71 24.527 33.275 37.318 1.00 15.37 C ATOM 3568 O SER D 71 23.694 33.741 36.507 1.00 14.01 O ATOM 3569 CB SER D 71 26.705 34.390 37.791 1.00 15.03 C ATOM 3570 OG SER D 71 26.026 35.608 37.534 1.00 13.53 O ATOM 0 H SER D 71 25.463 33.845 35.197 1.00 13.69 H new ATOM 0 HA SER D 71 26.422 32.425 37.218 1.00 14.82 H new ATOM 0 HB2 SER D 71 26.685 34.185 38.739 1.00 15.03 H new ATOM 0 HB3 SER D 71 27.638 34.463 37.537 1.00 15.03 H new ATOM 0 HG SER D 71 26.219 36.168 38.130 1.00 13.53 H new ATOM 3571 N GLU D 72 24.160 32.735 38.490 1.00 15.78 N ATOM 3572 CA GLU D 72 22.777 32.876 38.925 1.00 16.55 C ATOM 3573 C GLU D 72 22.352 34.337 39.126 1.00 15.20 C ATOM 3574 O GLU D 72 21.199 34.665 38.858 1.00 13.77 O ATOM 3575 CB GLU D 72 22.379 32.002 40.139 1.00 19.40 C ATOM 3576 CG GLU D 72 23.303 31.901 41.319 1.00 26.81 C ATOM 3577 CD GLU D 72 22.929 30.695 42.234 1.00 34.36 C ATOM 3578 OE1 GLU D 72 21.980 30.819 43.055 1.00 38.05 O ATOM 3579 OE2 GLU D 72 23.591 29.621 42.126 1.00 37.07 O ATOM 0 H GLU D 72 24.677 32.302 39.023 1.00 15.78 H new ATOM 0 HA GLU D 72 22.272 32.523 38.176 1.00 16.55 H new ATOM 0 HB2 GLU D 72 21.527 32.331 40.466 1.00 19.40 H new ATOM 0 HB3 GLU D 72 22.229 31.102 39.811 1.00 19.40 H new ATOM 0 HG2 GLU D 72 24.217 31.802 41.009 1.00 26.81 H new ATOM 0 HG3 GLU D 72 23.265 32.723 41.833 1.00 26.81 H new ATOM 3580 N GLU D 73 23.286 35.210 39.505 1.00 14.22 N ATOM 3581 CA GLU D 73 22.950 36.633 39.643 1.00 14.83 C ATOM 3582 C GLU D 73 22.562 37.242 38.291 1.00 14.90 C ATOM 3583 O GLU D 73 21.618 38.024 38.213 1.00 14.55 O ATOM 3584 CB GLU D 73 24.119 37.413 40.211 1.00 14.91 C ATOM 3585 CG GLU D 73 24.299 37.168 41.726 1.00 15.68 C ATOM 3586 CD GLU D 73 25.125 35.918 42.060 1.00 19.77 C ATOM 3587 OE1 GLU D 73 25.633 35.218 41.128 1.00 18.80 O ATOM 3588 OE2 GLU D 73 25.267 35.659 43.286 1.00 16.00 O ATOM 0 H GLU D 73 24.103 35.008 39.684 1.00 14.22 H new ATOM 0 HA GLU D 73 22.196 36.691 40.250 1.00 14.83 H new ATOM 0 HB2 GLU D 73 24.932 37.161 39.745 1.00 14.91 H new ATOM 0 HB3 GLU D 73 23.983 38.360 40.052 1.00 14.91 H new ATOM 0 HG2 GLU D 73 24.728 37.943 42.121 1.00 15.68 H new ATOM 0 HG3 GLU D 73 23.424 37.087 42.138 1.00 15.68 H new ATOM 3589 N GLN D 74 23.307 36.880 37.246 1.00 14.29 N ATOM 3590 CA GLN D 74 23.015 37.439 35.918 1.00 14.57 C ATOM 3591 C GLN D 74 21.632 36.936 35.437 1.00 13.65 C ATOM 3592 O GLN D 74 20.834 37.726 34.877 1.00 12.37 O ATOM 3593 CB GLN D 74 24.136 37.113 34.916 1.00 13.75 C ATOM 3594 CG GLN D 74 25.441 37.858 35.106 1.00 17.83 C ATOM 3595 CD GLN D 74 25.218 39.323 35.289 1.00 25.11 C ATOM 3596 OE1 GLN D 74 24.714 39.982 34.269 1.00 32.59 O flip ATOM 3597 NE2 GLN D 74 25.471 39.857 36.360 1.00 25.12 N flip ATOM 0 H GLN D 74 23.967 36.330 37.277 1.00 14.29 H new ATOM 0 HA GLN D 74 22.979 38.406 35.980 1.00 14.57 H new ATOM 0 HB2 GLN D 74 24.319 36.161 34.962 1.00 13.75 H new ATOM 0 HB3 GLN D 74 23.808 37.296 34.022 1.00 13.75 H new ATOM 0 HG2 GLN D 74 25.908 37.502 35.878 1.00 17.83 H new ATOM 0 HG3 GLN D 74 26.013 37.711 34.337 1.00 17.83 H new ATOM 0 HE21 GLN D 74 25.800 39.393 37.005 1.00 25.12 H new ATOM 0 HE22 GLN D 74 25.320 40.697 36.468 1.00 25.12 H new ATOM 3598 N TYR D 75 21.333 35.647 35.690 1.00 13.26 N ATOM 3599 CA TYR D 75 20.077 35.072 35.310 1.00 14.16 C ATOM 3600 C TYR D 75 18.941 35.886 35.966 1.00 14.54 C ATOM 3601 O TYR D 75 17.941 36.177 35.315 1.00 15.12 O ATOM 3602 CB TYR D 75 19.983 33.529 35.621 1.00 14.96 C ATOM 3603 CG TYR D 75 18.631 32.930 35.214 1.00 16.79 C ATOM 3604 CD1 TYR D 75 18.343 32.664 33.866 1.00 16.17 C ATOM 3605 CD2 TYR D 75 17.621 32.673 36.156 1.00 20.01 C ATOM 3606 CE1 TYR D 75 17.087 32.166 33.452 1.00 17.81 C ATOM 3607 CE2 TYR D 75 16.340 32.152 35.745 1.00 20.43 C ATOM 3608 CZ TYR D 75 16.095 31.897 34.377 1.00 19.23 C ATOM 3609 OH TYR D 75 14.873 31.383 33.903 1.00 15.60 O ATOM 0 H TYR D 75 21.866 35.101 36.087 1.00 13.26 H new ATOM 0 HA TYR D 75 19.989 35.126 34.346 1.00 14.16 H new ATOM 0 HB2 TYR D 75 20.694 33.064 35.153 1.00 14.96 H new ATOM 0 HB3 TYR D 75 20.126 33.384 36.569 1.00 14.96 H new ATOM 0 HD1 TYR D 75 18.999 32.820 33.226 1.00 16.17 H new ATOM 0 HD2 TYR D 75 17.780 32.841 37.057 1.00 20.01 H new ATOM 0 HE1 TYR D 75 16.926 32.018 32.548 1.00 17.81 H new ATOM 0 HE2 TYR D 75 15.679 31.985 36.377 1.00 20.43 H new ATOM 0 HH TYR D 75 14.342 31.285 34.546 1.00 15.60 H new ATOM 3610 N GLN D 76 19.093 36.267 37.235 1.00 12.99 N ATOM 3611 CA GLN D 76 18.039 37.049 37.898 1.00 13.86 C ATOM 3612 C GLN D 76 17.912 38.435 37.311 1.00 12.69 C ATOM 3613 O GLN D 76 16.819 38.928 37.201 1.00 13.84 O ATOM 3614 CB GLN D 76 18.219 37.133 39.432 1.00 12.75 C ATOM 3615 CG GLN D 76 18.034 35.781 40.139 1.00 17.70 C ATOM 3616 CD GLN D 76 16.682 35.155 39.833 1.00 21.47 C ATOM 3617 OE1 GLN D 76 15.676 35.856 39.733 1.00 24.59 O ATOM 3618 NE2 GLN D 76 16.663 33.832 39.625 1.00 25.10 N ATOM 0 H GLN D 76 19.779 36.090 37.722 1.00 12.99 H new ATOM 0 HA GLN D 76 17.215 36.565 37.731 1.00 13.86 H new ATOM 0 HB2 GLN D 76 19.105 37.476 39.629 1.00 12.75 H new ATOM 0 HB3 GLN D 76 17.582 37.769 39.792 1.00 12.75 H new ATOM 0 HG2 GLN D 76 18.739 35.175 39.864 1.00 17.70 H new ATOM 0 HG3 GLN D 76 18.123 35.904 41.097 1.00 17.70 H new ATOM 0 HE21 GLN D 76 17.387 33.374 39.704 1.00 25.10 H new ATOM 0 HE22 GLN D 76 15.927 33.441 39.412 1.00 25.10 H new ATOM 3619 N VAL D 77 19.028 39.056 36.940 1.00 12.57 N ATOM 3620 CA VAL D 77 18.989 40.387 36.323 1.00 12.69 C ATOM 3621 C VAL D 77 18.160 40.274 35.030 1.00 13.14 C ATOM 3622 O VAL D 77 17.228 41.034 34.792 1.00 10.46 O ATOM 3623 CB VAL D 77 20.422 40.916 36.018 1.00 13.27 C ATOM 3624 CG1 VAL D 77 20.403 42.135 35.034 1.00 12.98 C ATOM 3625 CG2 VAL D 77 21.152 41.265 37.334 1.00 11.64 C ATOM 0 H VAL D 77 19.817 38.728 37.035 1.00 12.57 H new ATOM 0 HA VAL D 77 18.584 41.023 36.933 1.00 12.69 H new ATOM 0 HB VAL D 77 20.912 40.208 35.571 1.00 13.27 H new ATOM 0 HG11 VAL D 77 21.311 42.433 34.871 1.00 12.98 H new ATOM 0 HG12 VAL D 77 19.995 41.868 34.195 1.00 12.98 H new ATOM 0 HG13 VAL D 77 19.891 42.860 35.426 1.00 12.98 H new ATOM 0 HG21 VAL D 77 22.042 41.593 37.133 1.00 11.64 H new ATOM 0 HG22 VAL D 77 20.655 41.950 37.808 1.00 11.64 H new ATOM 0 HG23 VAL D 77 21.218 40.472 37.888 1.00 11.64 H new ATOM 3626 N TYR D 78 18.505 39.276 34.229 1.00 12.54 N ATOM 3627 CA TYR D 78 17.699 38.916 33.044 1.00 12.80 C ATOM 3628 C TYR D 78 16.207 38.704 33.320 1.00 13.22 C ATOM 3629 O TYR D 78 15.371 39.350 32.677 1.00 12.30 O ATOM 3630 CB TYR D 78 18.372 37.706 32.397 1.00 11.94 C ATOM 3631 CG TYR D 78 17.639 36.928 31.286 1.00 12.41 C ATOM 3632 CD1 TYR D 78 17.804 37.278 29.954 1.00 10.41 C ATOM 3633 CD2 TYR D 78 16.889 35.766 31.588 1.00 11.74 C ATOM 3634 CE1 TYR D 78 17.229 36.524 28.941 1.00 10.77 C ATOM 3635 CE2 TYR D 78 16.346 34.990 30.598 1.00 10.87 C ATOM 3636 CZ TYR D 78 16.525 35.374 29.267 1.00 12.13 C ATOM 3637 OH TYR D 78 15.962 34.598 28.279 1.00 11.19 O ATOM 0 H TYR D 78 19.203 38.787 34.345 1.00 12.54 H new ATOM 0 HA TYR D 78 17.686 39.668 32.432 1.00 12.80 H new ATOM 0 HB2 TYR D 78 19.218 38.007 32.030 1.00 11.94 H new ATOM 0 HB3 TYR D 78 18.578 37.076 33.105 1.00 11.94 H new ATOM 0 HD1 TYR D 78 18.307 38.029 29.737 1.00 10.41 H new ATOM 0 HD2 TYR D 78 16.762 35.524 32.477 1.00 11.74 H new ATOM 0 HE1 TYR D 78 17.315 36.787 28.053 1.00 10.77 H new ATOM 0 HE2 TYR D 78 15.867 34.221 30.808 1.00 10.87 H new ATOM 0 HH TYR D 78 15.141 34.505 28.429 1.00 11.19 H new ATOM 3638 N MET D 79 15.844 37.813 34.254 1.00 13.94 N ATOM 3639 CA MET D 79 14.427 37.574 34.571 1.00 15.01 C ATOM 3640 C MET D 79 13.672 38.873 34.969 1.00 15.52 C ATOM 3641 O MET D 79 12.511 39.060 34.610 1.00 15.89 O ATOM 3642 CB MET D 79 14.278 36.505 35.658 1.00 15.46 C ATOM 3643 CG MET D 79 14.531 35.074 35.151 1.00 16.46 C ATOM 3644 SD MET D 79 13.740 34.724 33.554 1.00 24.17 S ATOM 3645 CE MET D 79 12.029 34.607 34.101 1.00 22.35 C ATOM 0 H MET D 79 16.398 37.340 34.712 1.00 13.94 H new ATOM 0 HA MET D 79 14.014 37.248 33.756 1.00 15.01 H new ATOM 0 HB2 MET D 79 14.897 36.699 36.379 1.00 15.46 H new ATOM 0 HB3 MET D 79 13.384 36.555 36.030 1.00 15.46 H new ATOM 0 HG2 MET D 79 15.487 34.931 35.069 1.00 16.46 H new ATOM 0 HG3 MET D 79 14.206 34.442 35.811 1.00 16.46 H new ATOM 0 HE1 MET D 79 11.458 34.417 33.340 1.00 22.35 H new ATOM 0 HE2 MET D 79 11.946 33.894 34.753 1.00 22.35 H new ATOM 0 HE3 MET D 79 11.760 35.447 34.505 1.00 22.35 H new ATOM 3646 N GLU D 80 14.360 39.799 35.616 1.00 16.36 N ATOM 3647 CA AGLU D 80 13.740 41.036 36.135 0.50 16.66 C ATOM 3648 CA BGLU D 80 13.689 41.012 36.108 0.50 16.94 C ATOM 3649 C GLU D 80 13.629 42.127 35.088 1.00 17.32 C ATOM 3650 O GLU D 80 12.891 43.100 35.269 1.00 17.94 O ATOM 3651 CB AGLU D 80 14.550 41.580 37.316 0.50 16.84 C ATOM 3652 CB BGLU D 80 14.358 41.501 37.385 0.50 17.29 C ATOM 3653 CG AGLU D 80 14.588 40.686 38.561 0.50 17.18 C ATOM 3654 CG BGLU D 80 14.191 40.536 38.554 0.50 18.95 C ATOM 3655 CD AGLU D 80 13.313 40.745 39.383 0.50 18.90 C ATOM 3656 CD BGLU D 80 15.156 40.818 39.665 0.50 21.06 C ATOM 3657 OE1AGLU D 80 12.405 41.546 39.038 0.50 16.60 O ATOM 3658 OE1BGLU D 80 16.213 41.417 39.370 0.50 20.03 O ATOM 3659 OE2AGLU D 80 13.240 39.982 40.376 0.50 17.26 O ATOM 3660 OE2BGLU D 80 14.850 40.460 40.829 0.50 23.70 O ATOM 0 H AGLU D 80 15.203 39.739 35.773 0.50 16.36 H new ATOM 0 H BGLU D 80 15.202 39.755 35.783 0.50 16.36 H new ATOM 0 HA AGLU D 80 12.843 40.792 36.413 0.50 16.94 H new ATOM 0 HA BGLU D 80 12.770 40.761 36.291 0.50 16.94 H new ATOM 0 HB2AGLU D 80 15.461 41.733 37.020 0.50 17.29 H new ATOM 0 HB2BGLU D 80 15.304 41.637 37.217 0.50 17.29 H new ATOM 0 HB3AGLU D 80 14.185 42.443 37.568 0.50 17.29 H new ATOM 0 HB3BGLU D 80 13.987 42.363 37.629 0.50 17.29 H new ATOM 0 HG2AGLU D 80 14.747 39.769 38.288 0.50 18.95 H new ATOM 0 HG2BGLU D 80 13.284 40.595 38.893 0.50 18.95 H new ATOM 0 HG3AGLU D 80 15.337 40.950 39.118 0.50 18.95 H new ATOM 0 HG3BGLU D 80 14.318 39.627 38.241 0.50 18.95 H new ATOM 3661 N SER D 81 14.387 41.988 34.007 1.00 15.51 N ATOM 3662 CA SER D 81 14.517 43.029 32.999 1.00 15.93 C ATOM 3663 C SER D 81 13.250 43.304 32.184 1.00 15.88 C ATOM 3664 O SER D 81 12.617 42.381 31.683 1.00 14.63 O ATOM 3665 CB SER D 81 15.639 42.597 32.033 1.00 15.32 C ATOM 3666 OG SER D 81 15.657 43.420 30.906 1.00 21.02 O ATOM 0 H SER D 81 14.844 41.280 33.837 1.00 15.51 H new ATOM 0 HA SER D 81 14.709 43.855 33.470 1.00 15.93 H new ATOM 0 HB2 SER D 81 16.496 42.639 32.485 1.00 15.32 H new ATOM 0 HB3 SER D 81 15.505 41.675 31.765 1.00 15.32 H new ATOM 0 HG SER D 81 16.439 43.697 30.774 1.00 21.02 H new ATOM 3667 N ASP D 82 12.913 44.582 31.997 1.00 16.45 N ATOM 3668 CA ASP D 82 11.765 44.940 31.147 1.00 17.74 C ATOM 3669 C ASP D 82 12.025 44.591 29.695 1.00 17.02 C ATOM 3670 O ASP D 82 11.111 44.134 28.996 1.00 16.66 O ATOM 3671 CB ASP D 82 11.449 46.442 31.263 1.00 18.86 C ATOM 3672 CG ASP D 82 10.898 46.813 32.637 1.00 23.31 C ATOM 3673 OD1 ASP D 82 10.280 45.942 33.320 1.00 25.37 O ATOM 3674 OD2 ASP D 82 11.115 47.974 33.029 1.00 28.82 O ATOM 0 H ASP D 82 13.327 45.250 32.346 1.00 16.45 H new ATOM 0 HA ASP D 82 11.003 44.427 31.459 1.00 17.74 H new ATOM 0 HB2 ASP D 82 12.255 46.954 31.091 1.00 18.86 H new ATOM 0 HB3 ASP D 82 10.805 46.689 30.581 1.00 18.86 H new ATOM 3675 N ILE D 83 13.242 44.824 29.211 1.00 15.92 N ATOM 3676 CA ILE D 83 13.485 44.529 27.798 1.00 16.16 C ATOM 3677 C ILE D 83 13.419 43.013 27.534 1.00 15.67 C ATOM 3678 O ILE D 83 12.963 42.579 26.474 1.00 14.53 O ATOM 3679 CB ILE D 83 14.804 45.159 27.234 1.00 17.51 C ATOM 3680 CG1 ILE D 83 14.905 44.944 25.711 1.00 19.16 C ATOM 3681 CG2 ILE D 83 15.989 44.523 27.805 1.00 17.34 C ATOM 3682 CD1 ILE D 83 13.866 45.748 24.859 1.00 22.21 C ATOM 0 H ILE D 83 13.910 45.136 29.654 1.00 15.92 H new ATOM 0 HA ILE D 83 12.768 44.960 27.307 1.00 16.16 H new ATOM 0 HB ILE D 83 14.771 46.101 27.463 1.00 17.51 H new ATOM 0 HG12 ILE D 83 15.798 45.188 25.422 1.00 19.16 H new ATOM 0 HG13 ILE D 83 14.795 43.999 25.523 1.00 19.16 H new ATOM 0 HG21 ILE D 83 16.786 44.934 27.437 1.00 17.34 H new ATOM 0 HG22 ILE D 83 15.984 44.634 28.769 1.00 17.34 H new ATOM 0 HG23 ILE D 83 15.985 43.577 27.589 1.00 17.34 H new ATOM 0 HD11 ILE D 83 14.000 45.555 23.918 1.00 22.21 H new ATOM 0 HD12 ILE D 83 12.967 45.490 25.117 1.00 22.21 H new ATOM 0 HD13 ILE D 83 13.986 46.698 25.014 1.00 22.21 H new ATOM 3683 N ARG D 84 13.849 42.219 28.506 1.00 14.41 N ATOM 3684 CA ARG D 84 13.675 40.760 28.457 1.00 15.15 C ATOM 3685 C ARG D 84 12.200 40.380 28.308 1.00 14.84 C ATOM 3686 O ARG D 84 11.819 39.555 27.471 1.00 15.04 O ATOM 3687 CB ARG D 84 14.235 40.149 29.732 1.00 16.00 C ATOM 3688 CG ARG D 84 14.563 38.666 29.577 1.00 17.26 C ATOM 3689 CD ARG D 84 13.492 37.731 29.941 1.00 18.51 C ATOM 3690 NE ARG D 84 12.830 37.979 31.225 1.00 17.22 N ATOM 3691 CZ ARG D 84 11.624 37.502 31.498 1.00 22.50 C ATOM 3692 NH1 ARG D 84 11.004 36.772 30.581 1.00 17.21 N ATOM 3693 NH2 ARG D 84 11.024 37.757 32.656 1.00 20.80 N ATOM 0 H ARG D 84 14.249 42.503 29.212 1.00 14.41 H new ATOM 0 HA ARG D 84 14.151 40.418 27.684 1.00 15.15 H new ATOM 0 HB2 ARG D 84 15.037 40.629 29.991 1.00 16.00 H new ATOM 0 HB3 ARG D 84 13.592 40.261 30.450 1.00 16.00 H new ATOM 0 HG2 ARG D 84 14.812 38.502 28.654 1.00 17.26 H new ATOM 0 HG3 ARG D 84 15.341 38.466 30.120 1.00 17.26 H new ATOM 0 HD2 ARG D 84 12.820 37.749 29.242 1.00 18.51 H new ATOM 0 HD3 ARG D 84 13.861 36.834 29.956 1.00 18.51 H new ATOM 0 HE ARG D 84 13.237 38.449 31.820 1.00 17.22 H new ATOM 0 HH11 ARG D 84 11.385 36.616 29.826 1.00 17.21 H new ATOM 0 HH12 ARG D 84 10.221 36.455 30.741 1.00 17.21 H new ATOM 0 HH21 ARG D 84 11.419 38.241 33.247 1.00 20.80 H new ATOM 0 HH22 ARG D 84 10.241 37.438 32.814 1.00 20.80 H new ATOM 3694 N LYS D 85 11.354 40.996 29.118 1.00 14.68 N ATOM 3695 CA LYS D 85 9.902 40.761 29.004 1.00 14.34 C ATOM 3696 C LYS D 85 9.329 41.078 27.627 1.00 14.16 C ATOM 3697 O LYS D 85 8.481 40.308 27.111 1.00 14.86 O ATOM 3698 CB LYS D 85 9.152 41.525 30.109 1.00 15.38 C ATOM 3699 CG LYS D 85 9.432 40.928 31.457 1.00 15.58 C ATOM 3700 CD LYS D 85 8.800 41.772 32.580 1.00 18.86 C ATOM 3701 CE LYS D 85 9.392 41.346 33.922 1.00 22.15 C ATOM 3702 NZ LYS D 85 8.948 42.262 35.025 1.00 24.05 N ATOM 0 H LYS D 85 11.585 41.548 29.736 1.00 14.68 H new ATOM 0 HA LYS D 85 9.768 39.808 29.123 1.00 14.34 H new ATOM 0 HB2 LYS D 85 9.420 42.457 30.102 1.00 15.38 H new ATOM 0 HB3 LYS D 85 8.198 41.503 29.933 1.00 15.38 H new ATOM 0 HG2 LYS D 85 9.083 40.024 31.492 1.00 15.58 H new ATOM 0 HG3 LYS D 85 10.390 40.867 31.594 1.00 15.58 H new ATOM 0 HD2 LYS D 85 8.968 42.715 32.425 1.00 18.86 H new ATOM 0 HD3 LYS D 85 7.837 41.653 32.586 1.00 18.86 H new ATOM 0 HE2 LYS D 85 9.121 40.437 34.124 1.00 22.15 H new ATOM 0 HE3 LYS D 85 10.360 41.348 33.867 1.00 22.15 H new ATOM 0 HZ1 LYS D 85 9.305 41.994 35.795 1.00 24.05 H new ATOM 0 HZ2 LYS D 85 9.215 43.092 34.847 1.00 24.05 H new ATOM 0 HZ3 LYS D 85 8.060 42.243 35.087 1.00 24.05 H new ATOM 3703 N ALA D 86 9.801 42.171 27.010 1.00 13.08 N ATOM 3704 CA ALA D 86 9.379 42.547 25.654 1.00 13.57 C ATOM 3705 C ALA D 86 9.905 41.549 24.596 1.00 13.50 C ATOM 3706 O ALA D 86 9.233 41.231 23.619 1.00 15.12 O ATOM 3707 CB ALA D 86 9.886 43.961 25.332 1.00 14.56 C ATOM 0 H ALA D 86 10.370 42.710 27.364 1.00 13.08 H new ATOM 0 HA ALA D 86 8.410 42.528 25.624 1.00 13.57 H new ATOM 0 HB1 ALA D 86 9.607 44.209 24.437 1.00 14.56 H new ATOM 0 HB2 ALA D 86 9.517 44.591 25.971 1.00 14.56 H new ATOM 0 HB3 ALA D 86 10.854 43.978 25.385 1.00 14.56 H new ATOM 3708 N TRP D 87 11.140 41.097 24.758 1.00 12.70 N ATOM 3709 CA TRP D 87 11.718 40.072 23.892 1.00 12.27 C ATOM 3710 C TRP D 87 10.841 38.788 23.961 1.00 12.51 C ATOM 3711 O TRP D 87 10.546 38.189 22.941 1.00 12.11 O ATOM 3712 CB TRP D 87 13.161 39.793 24.382 1.00 11.85 C ATOM 3713 CG TRP D 87 14.007 38.867 23.529 1.00 12.89 C ATOM 3714 CD1 TRP D 87 14.194 38.932 22.169 1.00 9.44 C ATOM 3715 CD2 TRP D 87 14.854 37.777 24.004 1.00 11.85 C ATOM 3716 NE1 TRP D 87 15.075 37.929 21.759 1.00 10.72 N ATOM 3717 CE2 TRP D 87 15.491 37.216 22.866 1.00 13.26 C ATOM 3718 CE3 TRP D 87 15.121 37.227 25.274 1.00 11.25 C ATOM 3719 CZ2 TRP D 87 16.357 36.111 22.958 1.00 11.77 C ATOM 3720 CZ3 TRP D 87 15.988 36.130 25.373 1.00 7.68 C ATOM 3721 CH2 TRP D 87 16.629 35.608 24.210 1.00 12.64 C ATOM 0 H TRP D 87 11.671 41.375 25.375 1.00 12.70 H new ATOM 0 HA TRP D 87 11.745 40.366 22.968 1.00 12.27 H new ATOM 0 HB2 TRP D 87 13.624 40.642 24.457 1.00 11.85 H new ATOM 0 HB3 TRP D 87 13.110 39.418 25.275 1.00 11.85 H new ATOM 0 HD1 TRP D 87 13.793 39.553 21.605 1.00 9.44 H new ATOM 0 HE1 TRP D 87 15.319 37.780 20.948 1.00 10.72 H new ATOM 0 HE3 TRP D 87 14.727 37.587 26.036 1.00 11.25 H new ATOM 0 HZ2 TRP D 87 16.734 35.732 22.197 1.00 11.77 H new ATOM 0 HZ3 TRP D 87 16.146 35.740 26.202 1.00 7.68 H new ATOM 0 HH2 TRP D 87 17.242 34.915 24.300 1.00 12.64 H new ATOM 3722 N PHE D 88 10.405 38.400 25.160 1.00 12.60 N ATOM 3723 CA PHE D 88 9.553 37.208 25.309 1.00 13.57 C ATOM 3724 C PHE D 88 8.182 37.398 24.614 1.00 14.67 C ATOM 3725 O PHE D 88 7.595 36.440 24.088 1.00 14.19 O ATOM 3726 CB PHE D 88 9.398 36.817 26.797 1.00 15.15 C ATOM 3727 CG PHE D 88 10.492 35.906 27.329 1.00 13.20 C ATOM 3728 CD1 PHE D 88 11.839 36.206 27.137 1.00 13.72 C ATOM 3729 CD2 PHE D 88 10.165 34.785 28.088 1.00 16.24 C ATOM 3730 CE1 PHE D 88 12.850 35.377 27.687 1.00 16.80 C ATOM 3731 CE2 PHE D 88 11.166 33.949 28.646 1.00 17.74 C ATOM 3732 CZ PHE D 88 12.497 34.230 28.436 1.00 15.43 C ATOM 0 H PHE D 88 10.587 38.806 25.896 1.00 12.60 H new ATOM 0 HA PHE D 88 9.995 36.470 24.861 1.00 13.57 H new ATOM 0 HB2 PHE D 88 9.379 37.626 27.332 1.00 15.15 H new ATOM 0 HB3 PHE D 88 8.541 36.378 26.916 1.00 15.15 H new ATOM 0 HD1 PHE D 88 12.078 36.957 26.643 1.00 13.72 H new ATOM 0 HD2 PHE D 88 9.269 34.580 28.232 1.00 16.24 H new ATOM 0 HE1 PHE D 88 13.746 35.588 27.555 1.00 16.80 H new ATOM 0 HE2 PHE D 88 10.922 33.210 29.155 1.00 17.74 H new ATOM 0 HZ PHE D 88 13.156 33.673 28.782 1.00 15.43 H new ATOM 3733 N GLU D 89 7.696 38.636 24.565 1.00 14.69 N ATOM 3734 CA GLU D 89 6.462 38.928 23.874 1.00 16.09 C ATOM 3735 C GLU D 89 6.687 38.644 22.395 1.00 15.78 C ATOM 3736 O GLU D 89 5.790 38.108 21.740 1.00 17.57 O ATOM 3737 CB GLU D 89 6.027 40.401 24.071 1.00 16.11 C ATOM 3738 CG GLU D 89 5.503 40.723 25.458 1.00 20.85 C ATOM 3739 CD GLU D 89 4.392 39.763 25.855 1.00 26.13 C ATOM 3740 OE1 GLU D 89 3.410 39.660 25.099 1.00 29.69 O ATOM 3741 OE2 GLU D 89 4.525 39.062 26.883 1.00 32.50 O ATOM 0 H GLU D 89 8.073 39.318 24.929 1.00 14.69 H new ATOM 0 HA GLU D 89 5.752 38.374 24.234 1.00 16.09 H new ATOM 0 HB2 GLU D 89 6.784 40.978 23.882 1.00 16.11 H new ATOM 0 HB3 GLU D 89 5.339 40.613 23.421 1.00 16.11 H new ATOM 0 HG2 GLU D 89 6.227 40.670 26.102 1.00 20.85 H new ATOM 0 HG3 GLU D 89 5.171 41.634 25.479 1.00 20.85 H new ATOM 3742 N HIS D 90 7.860 39.000 21.859 1.00 15.05 N ATOM 3743 CA HIS D 90 8.167 38.606 20.468 1.00 14.00 C ATOM 3744 C HIS D 90 8.181 37.077 20.336 1.00 14.17 C ATOM 3745 O HIS D 90 7.638 36.528 19.361 1.00 14.25 O ATOM 3746 CB HIS D 90 9.440 39.238 19.906 1.00 14.28 C ATOM 3747 CG HIS D 90 9.723 38.819 18.495 1.00 14.08 C ATOM 3748 ND1 HIS D 90 10.716 37.922 18.164 1.00 13.26 N ATOM 3749 CD2 HIS D 90 9.080 39.117 17.334 1.00 15.77 C ATOM 3750 CE1 HIS D 90 10.702 37.716 16.853 1.00 16.01 C ATOM 3751 NE2 HIS D 90 9.710 38.417 16.330 1.00 13.91 N ATOM 0 H HIS D 90 8.472 39.451 22.261 1.00 15.05 H new ATOM 0 HA HIS D 90 7.452 38.963 19.918 1.00 14.00 H new ATOM 0 HB2 HIS D 90 9.360 40.204 19.942 1.00 14.28 H new ATOM 0 HB3 HIS D 90 10.192 38.995 20.468 1.00 14.28 H new ATOM 0 HD1 HIS D 90 11.259 37.554 18.720 1.00 13.26 H new ATOM 0 HD2 HIS D 90 8.351 39.687 17.237 1.00 15.77 H new ATOM 0 HE1 HIS D 90 11.290 37.171 16.382 1.00 16.01 H new ATOM 0 HE2 HIS D 90 9.494 38.433 15.498 1.00 13.91 H new ATOM 3752 N GLY D 91 8.745 36.396 21.337 1.00 13.53 N ATOM 3753 CA GLY D 91 8.697 34.928 21.371 1.00 14.90 C ATOM 3754 C GLY D 91 7.281 34.409 21.207 1.00 14.97 C ATOM 3755 O GLY D 91 7.057 33.404 20.514 1.00 13.24 O ATOM 0 H GLY D 91 9.156 36.759 22.000 1.00 13.53 H new ATOM 0 HA2 GLY D 91 9.257 34.569 20.665 1.00 14.90 H new ATOM 0 HA3 GLY D 91 9.063 34.611 22.212 1.00 14.90 H new ATOM 3756 N LYS D 92 6.312 35.048 21.868 1.00 14.83 N ATOM 3757 CA LYS D 92 4.930 34.511 21.786 1.00 17.47 C ATOM 3758 C LYS D 92 4.366 34.600 20.383 1.00 17.65 C ATOM 3759 O LYS D 92 3.437 33.841 20.007 1.00 18.07 O ATOM 3760 CB LYS D 92 3.982 35.218 22.758 1.00 18.12 C ATOM 3761 CG LYS D 92 4.332 34.976 24.218 1.00 21.63 C ATOM 3762 CD LYS D 92 3.602 35.988 25.125 1.00 27.52 C ATOM 3763 CE LYS D 92 3.971 35.806 26.590 1.00 30.40 C ATOM 3764 NZ LYS D 92 3.122 36.733 27.430 1.00 36.46 N ATOM 0 H LYS D 92 6.414 35.755 22.347 1.00 14.83 H new ATOM 0 HA LYS D 92 4.995 33.576 22.036 1.00 17.47 H new ATOM 0 HB2 LYS D 92 3.999 36.172 22.581 1.00 18.12 H new ATOM 0 HB3 LYS D 92 3.075 34.915 22.594 1.00 18.12 H new ATOM 0 HG2 LYS D 92 4.086 34.072 24.469 1.00 21.63 H new ATOM 0 HG3 LYS D 92 5.291 35.054 24.343 1.00 21.63 H new ATOM 0 HD2 LYS D 92 3.823 36.890 24.846 1.00 27.52 H new ATOM 0 HD3 LYS D 92 2.643 35.885 25.018 1.00 27.52 H new ATOM 0 HE2 LYS D 92 3.829 34.885 26.859 1.00 30.40 H new ATOM 0 HE3 LYS D 92 4.912 35.999 26.725 1.00 30.40 H new ATOM 0 HZ1 LYS D 92 3.157 36.478 28.282 1.00 36.46 H new ATOM 0 HZ2 LYS D 92 3.429 37.565 27.357 1.00 36.46 H new ATOM 0 HZ3 LYS D 92 2.279 36.703 27.146 1.00 36.46 H new ATOM 3765 N TYR D 93 4.899 35.544 19.617 1.00 17.04 N ATOM 3766 CA TYR D 93 4.452 35.770 18.272 1.00 17.99 C ATOM 3767 C TYR D 93 4.955 34.667 17.320 1.00 17.58 C ATOM 3768 O TYR D 93 4.199 34.249 16.447 1.00 18.14 O ATOM 3769 CB TYR D 93 4.864 37.169 17.786 1.00 18.30 C ATOM 3770 CG TYR D 93 4.565 37.423 16.320 1.00 22.31 C ATOM 3771 CD1 TYR D 93 3.245 37.513 15.864 1.00 24.05 C ATOM 3772 CD2 TYR D 93 5.601 37.520 15.378 1.00 23.46 C ATOM 3773 CE1 TYR D 93 2.973 37.727 14.516 1.00 25.56 C ATOM 3774 CE2 TYR D 93 5.332 37.739 14.017 1.00 25.38 C ATOM 3775 CZ TYR D 93 4.012 37.835 13.611 1.00 27.82 C ATOM 3776 OH TYR D 93 3.725 38.044 12.288 1.00 31.94 O ATOM 0 H TYR D 93 5.531 36.068 19.873 1.00 17.04 H new ATOM 0 HA TYR D 93 3.483 35.730 18.268 1.00 17.99 H new ATOM 0 HB2 TYR D 93 4.405 37.836 18.321 1.00 18.30 H new ATOM 0 HB3 TYR D 93 5.815 37.288 17.939 1.00 18.30 H new ATOM 0 HD1 TYR D 93 2.543 37.429 16.468 1.00 24.05 H new ATOM 0 HD2 TYR D 93 6.483 37.438 15.661 1.00 23.46 H new ATOM 0 HE1 TYR D 93 2.093 37.797 14.224 1.00 25.56 H new ATOM 0 HE2 TYR D 93 6.025 37.818 13.402 1.00 25.38 H new ATOM 0 HH TYR D 93 4.440 38.091 11.850 1.00 31.94 H new ATOM 3777 N PHE D 94 6.214 34.214 17.459 1.00 16.02 N ATOM 3778 CA PHE D 94 6.787 33.308 16.450 1.00 14.82 C ATOM 3779 C PHE D 94 7.046 31.905 16.957 1.00 14.33 C ATOM 3780 O PHE D 94 7.514 31.067 16.196 1.00 13.84 O ATOM 3781 CB PHE D 94 8.047 33.923 15.785 1.00 14.31 C ATOM 3782 CG PHE D 94 9.346 33.674 16.530 1.00 14.98 C ATOM 3783 CD1 PHE D 94 9.668 34.406 17.686 1.00 13.28 C ATOM 3784 CD2 PHE D 94 10.259 32.731 16.051 1.00 12.95 C ATOM 3785 CE1 PHE D 94 10.880 34.174 18.368 1.00 14.79 C ATOM 3786 CE2 PHE D 94 11.481 32.459 16.731 1.00 16.68 C ATOM 3787 CZ PHE D 94 11.785 33.179 17.900 1.00 16.00 C ATOM 0 H PHE D 94 6.738 34.413 18.111 1.00 16.02 H new ATOM 0 HA PHE D 94 6.103 33.210 15.769 1.00 14.82 H new ATOM 0 HB2 PHE D 94 8.130 33.566 14.887 1.00 14.31 H new ATOM 0 HB3 PHE D 94 7.917 34.880 15.698 1.00 14.31 H new ATOM 0 HD1 PHE D 94 9.076 35.049 18.004 1.00 13.28 H new ATOM 0 HD2 PHE D 94 10.064 32.269 15.268 1.00 12.95 H new ATOM 0 HE1 PHE D 94 11.089 34.672 19.125 1.00 14.79 H new ATOM 0 HE2 PHE D 94 12.069 31.815 16.407 1.00 16.68 H new ATOM 0 HZ PHE D 94 12.572 33.007 18.365 1.00 16.00 H new ATOM 3788 N ILE D 95 6.784 31.658 18.249 1.00 13.53 N ATOM 3789 CA ILE D 95 6.989 30.330 18.830 1.00 13.02 C ATOM 3790 C ILE D 95 5.644 29.780 19.290 1.00 12.99 C ATOM 3791 O ILE D 95 5.062 30.263 20.282 1.00 13.20 O ATOM 3792 CB ILE D 95 7.978 30.309 20.022 1.00 12.43 C ATOM 3793 CG1 ILE D 95 9.291 31.015 19.651 1.00 12.54 C ATOM 3794 CG2 ILE D 95 8.211 28.860 20.507 1.00 11.72 C ATOM 3795 CD1 ILE D 95 10.300 31.183 20.819 1.00 18.59 C ATOM 0 H ILE D 95 6.488 32.247 18.801 1.00 13.53 H new ATOM 0 HA ILE D 95 7.385 29.781 18.135 1.00 13.02 H new ATOM 0 HB ILE D 95 7.589 30.801 20.762 1.00 12.43 H new ATOM 0 HG12 ILE D 95 9.721 30.515 18.940 1.00 12.54 H new ATOM 0 HG13 ILE D 95 9.081 31.892 19.294 1.00 12.54 H new ATOM 0 HG21 ILE D 95 8.832 28.864 21.252 1.00 11.72 H new ATOM 0 HG22 ILE D 95 7.368 28.474 20.791 1.00 11.72 H new ATOM 0 HG23 ILE D 95 8.580 28.331 19.782 1.00 11.72 H new ATOM 0 HD11 ILE D 95 11.095 31.636 20.497 1.00 18.59 H new ATOM 0 HD12 ILE D 95 9.893 31.708 21.525 1.00 18.59 H new ATOM 0 HD13 ILE D 95 10.543 30.310 21.165 1.00 18.59 H new ATOM 3796 N GLY D 96 5.161 28.780 18.566 1.00 13.61 N ATOM 3797 CA GLY D 96 3.891 28.148 18.874 1.00 14.30 C ATOM 3798 C GLY D 96 3.947 27.185 20.041 1.00 15.28 C ATOM 3799 O GLY D 96 2.995 27.119 20.832 1.00 16.74 O ATOM 0 H GLY D 96 5.562 28.449 17.881 1.00 13.61 H new ATOM 0 HA2 GLY D 96 3.236 28.837 19.067 1.00 14.30 H new ATOM 0 HA3 GLY D 96 3.579 27.672 18.089 1.00 14.30 H new ATOM 3800 N GLN D 97 5.014 26.395 20.115 1.00 14.91 N ATOM 3801 CA GLN D 97 5.235 25.443 21.209 1.00 15.43 C ATOM 3802 C GLN D 97 6.732 25.448 21.503 1.00 15.09 C ATOM 3803 O GLN D 97 7.528 25.548 20.557 1.00 14.92 O ATOM 3804 CB GLN D 97 4.799 24.023 20.823 1.00 16.42 C ATOM 3805 CG GLN D 97 3.264 23.865 20.494 1.00 18.69 C ATOM 3806 CD GLN D 97 3.026 22.605 19.722 1.00 23.31 C ATOM 3807 OE1 GLN D 97 3.360 22.632 18.438 1.00 27.65 O flip ATOM 3808 NE2 GLN D 97 2.572 21.591 20.274 1.00 20.97 N flip ATOM 0 H GLN D 97 5.640 26.394 19.525 1.00 14.91 H new ATOM 0 HA GLN D 97 4.710 25.705 21.982 1.00 15.43 H new ATOM 0 HB2 GLN D 97 5.313 23.740 20.050 1.00 16.42 H new ATOM 0 HB3 GLN D 97 5.024 23.421 21.549 1.00 16.42 H new ATOM 0 HG2 GLN D 97 2.750 23.850 21.317 1.00 18.69 H new ATOM 0 HG3 GLN D 97 2.956 24.629 19.982 1.00 18.69 H new ATOM 0 HE21 GLN D 97 2.367 21.611 21.109 1.00 20.97 H new ATOM 0 HE22 GLN D 97 2.463 20.868 19.822 1.00 20.97 H new ATOM 3809 N LEU D 98 7.087 25.331 22.791 1.00 13.86 N ATOM 3810 CA LEU D 98 8.468 25.417 23.299 1.00 13.71 C ATOM 3811 C LEU D 98 8.725 24.303 24.304 1.00 14.06 C ATOM 3812 O LEU D 98 7.858 23.995 25.131 1.00 14.44 O ATOM 3813 CB LEU D 98 8.669 26.790 23.936 1.00 14.00 C ATOM 3814 CG LEU D 98 9.995 27.174 24.550 1.00 15.31 C ATOM 3815 CD1 LEU D 98 11.078 27.162 23.487 1.00 18.25 C ATOM 3816 CD2 LEU D 98 9.895 28.578 25.115 1.00 16.57 C ATOM 0 H LEU D 98 6.511 25.195 23.415 1.00 13.86 H new ATOM 0 HA LEU D 98 9.100 25.309 22.571 1.00 13.71 H new ATOM 0 HB2 LEU D 98 8.468 27.451 23.255 1.00 14.00 H new ATOM 0 HB3 LEU D 98 7.997 26.883 24.629 1.00 14.00 H new ATOM 0 HG LEU D 98 10.214 26.541 25.251 1.00 15.31 H new ATOM 0 HD11 LEU D 98 11.927 27.409 23.887 1.00 18.25 H new ATOM 0 HD12 LEU D 98 11.147 26.273 23.106 1.00 18.25 H new ATOM 0 HD13 LEU D 98 10.853 27.796 22.788 1.00 18.25 H new ATOM 0 HD21 LEU D 98 10.744 28.829 25.511 1.00 16.57 H new ATOM 0 HD22 LEU D 98 9.674 29.199 24.403 1.00 16.57 H new ATOM 0 HD23 LEU D 98 9.202 28.605 25.793 1.00 16.57 H new ATOM 3817 N LYS D 99 9.889 23.679 24.206 1.00 13.60 N ATOM 3818 CA LYS D 99 10.417 22.770 25.229 1.00 14.39 C ATOM 3819 C LYS D 99 11.778 23.254 25.746 1.00 13.31 C ATOM 3820 O LYS D 99 12.773 23.221 24.985 1.00 13.69 O ATOM 3821 CB LYS D 99 10.552 21.337 24.648 1.00 15.14 C ATOM 3822 CG LYS D 99 11.416 20.339 25.508 1.00 16.25 C ATOM 3823 CD LYS D 99 10.643 19.935 26.772 1.00 18.18 C ATOM 3824 CE LYS D 99 11.530 19.313 27.873 1.00 16.69 C ATOM 3825 NZ LYS D 99 10.533 18.930 28.897 1.00 22.02 N ATOM 0 H LYS D 99 10.411 23.770 23.529 1.00 13.60 H new ATOM 0 HA LYS D 99 9.795 22.758 25.973 1.00 14.39 H new ATOM 0 HB2 LYS D 99 9.664 20.963 24.541 1.00 15.14 H new ATOM 0 HB3 LYS D 99 10.942 21.399 23.762 1.00 15.14 H new ATOM 0 HG2 LYS D 99 11.631 19.551 24.985 1.00 16.25 H new ATOM 0 HG3 LYS D 99 12.257 20.755 25.753 1.00 16.25 H new ATOM 0 HD2 LYS D 99 10.196 20.717 27.132 1.00 18.18 H new ATOM 0 HD3 LYS D 99 9.951 19.300 26.529 1.00 18.18 H new ATOM 0 HE2 LYS D 99 12.028 18.547 27.548 1.00 16.69 H new ATOM 0 HE3 LYS D 99 12.178 19.947 28.218 1.00 16.69 H new ATOM 0 HZ1 LYS D 99 10.619 19.459 29.608 1.00 22.02 H new ATOM 0 HZ2 LYS D 99 9.714 19.016 28.561 1.00 22.02 H new ATOM 0 HZ3 LYS D 99 10.666 18.084 29.139 1.00 22.02 H new ATOM 3826 N PRO D 100 11.854 23.682 27.024 1.00 13.46 N ATOM 3827 CA PRO D 100 13.156 24.080 27.598 1.00 12.29 C ATOM 3828 C PRO D 100 13.872 22.912 28.264 1.00 11.99 C ATOM 3829 O PRO D 100 13.207 22.062 28.912 1.00 10.66 O ATOM 3830 CB PRO D 100 12.777 25.124 28.664 1.00 13.01 C ATOM 3831 CG PRO D 100 11.252 25.399 28.455 1.00 14.72 C ATOM 3832 CD PRO D 100 10.749 24.088 27.909 1.00 13.08 C ATOM 0 HA PRO D 100 13.761 24.410 26.915 1.00 12.29 H new ATOM 0 HB2 PRO D 100 12.952 24.790 29.558 1.00 13.01 H new ATOM 0 HB3 PRO D 100 13.296 25.936 28.558 1.00 13.01 H new ATOM 0 HG2 PRO D 100 10.812 25.636 29.286 1.00 14.72 H new ATOM 0 HG3 PRO D 100 11.099 26.129 27.835 1.00 14.72 H new ATOM 0 HD2 PRO D 100 10.589 23.439 28.612 1.00 13.08 H new ATOM 0 HD3 PRO D 100 9.915 24.192 27.425 1.00 13.08 H new ATOM 3833 N PHE D 101 15.199 22.843 28.098 1.00 10.82 N ATOM 3834 CA PHE D 101 16.015 21.894 28.890 1.00 12.08 C ATOM 3835 C PHE D 101 17.034 22.704 29.665 1.00 12.40 C ATOM 3836 O PHE D 101 17.843 23.379 29.045 1.00 14.18 O ATOM 3837 CB PHE D 101 16.817 20.935 28.005 1.00 12.34 C ATOM 3838 CG PHE D 101 15.991 20.055 27.090 1.00 13.70 C ATOM 3839 CD1 PHE D 101 15.313 18.938 27.582 1.00 13.57 C ATOM 3840 CD2 PHE D 101 15.937 20.320 25.719 1.00 15.41 C ATOM 3841 CE1 PHE D 101 14.544 18.113 26.702 1.00 12.39 C ATOM 3842 CE2 PHE D 101 15.217 19.478 24.826 1.00 16.13 C ATOM 3843 CZ PHE D 101 14.514 18.388 25.317 1.00 15.59 C ATOM 0 H PHE D 101 15.645 23.326 27.543 1.00 10.82 H new ATOM 0 HA PHE D 101 15.412 21.381 29.451 1.00 12.08 H new ATOM 0 HB2 PHE D 101 17.430 21.455 27.462 1.00 12.34 H new ATOM 0 HB3 PHE D 101 17.357 20.366 28.576 1.00 12.34 H new ATOM 0 HD1 PHE D 101 15.362 18.729 28.487 1.00 13.57 H new ATOM 0 HD2 PHE D 101 16.382 21.064 25.382 1.00 15.41 H new ATOM 0 HE1 PHE D 101 14.063 17.394 27.043 1.00 12.39 H new ATOM 0 HE2 PHE D 101 15.218 19.659 23.914 1.00 16.13 H new ATOM 0 HZ PHE D 101 14.028 17.844 24.740 1.00 15.59 H new ATOM 3844 N VAL D 102 17.064 22.598 30.992 1.00 11.70 N ATOM 3845 CA VAL D 102 18.141 23.205 31.741 1.00 12.08 C ATOM 3846 C VAL D 102 19.248 22.160 31.819 1.00 11.93 C ATOM 3847 O VAL D 102 19.017 21.031 32.321 1.00 14.16 O ATOM 3848 CB VAL D 102 17.678 23.713 33.147 1.00 11.45 C ATOM 3849 CG1 VAL D 102 18.883 24.142 33.983 1.00 10.97 C ATOM 3850 CG2 VAL D 102 16.734 24.896 32.968 1.00 13.97 C ATOM 0 H VAL D 102 16.477 22.184 31.465 1.00 11.70 H new ATOM 0 HA VAL D 102 18.464 24.006 31.299 1.00 12.08 H new ATOM 0 HB VAL D 102 17.221 22.993 33.608 1.00 11.45 H new ATOM 0 HG11 VAL D 102 18.581 24.454 34.850 1.00 10.97 H new ATOM 0 HG12 VAL D 102 19.480 23.387 34.102 1.00 10.97 H new ATOM 0 HG13 VAL D 102 19.354 24.858 33.529 1.00 10.97 H new ATOM 0 HG21 VAL D 102 16.445 25.214 33.838 1.00 13.97 H new ATOM 0 HG22 VAL D 102 17.195 25.610 32.500 1.00 13.97 H new ATOM 0 HG23 VAL D 102 15.961 24.618 32.452 1.00 13.97 H new ATOM 3851 N THR D 103 20.427 22.485 31.300 1.00 11.86 N ATOM 3852 CA THR D 103 21.481 21.470 31.193 1.00 11.78 C ATOM 3853 C THR D 103 22.492 21.551 32.315 1.00 13.98 C ATOM 3854 O THR D 103 22.522 22.563 33.053 1.00 14.58 O ATOM 3855 CB THR D 103 22.168 21.476 29.801 1.00 12.03 C ATOM 3856 OG1 THR D 103 22.816 22.741 29.585 1.00 10.41 O ATOM 3857 CG2 THR D 103 21.104 21.240 28.701 1.00 9.32 C ATOM 0 H THR D 103 20.638 23.266 31.009 1.00 11.86 H new ATOM 0 HA THR D 103 21.033 20.615 31.287 1.00 11.78 H new ATOM 0 HB THR D 103 22.831 20.769 29.766 1.00 12.03 H new ATOM 0 HG1 THR D 103 22.266 23.363 29.712 1.00 10.41 H new ATOM 0 HG21 THR D 103 21.532 21.244 27.831 1.00 9.32 H new ATOM 0 HG22 THR D 103 20.673 20.383 28.846 1.00 9.32 H new ATOM 0 HG23 THR D 103 20.439 21.946 28.737 1.00 9.32 H new ATOM 3858 N GLU D 104 23.319 20.505 32.433 1.00 12.65 N ATOM 3859 CA GLU D 104 24.403 20.452 33.409 1.00 14.80 C ATOM 3860 C GLU D 104 25.642 19.938 32.705 1.00 15.62 C ATOM 3861 O GLU D 104 25.562 18.930 31.972 1.00 15.63 O ATOM 3862 CB GLU D 104 24.022 19.511 34.573 1.00 14.64 C ATOM 3863 CG GLU D 104 25.167 19.223 35.556 1.00 19.02 C ATOM 3864 CD GLU D 104 24.855 18.141 36.608 1.00 26.20 C ATOM 3865 OE1 GLU D 104 23.675 17.761 36.733 1.00 27.32 O ATOM 3866 OE2 GLU D 104 25.795 17.721 37.347 1.00 28.07 O ATOM 0 H GLU D 104 23.262 19.802 31.941 1.00 12.65 H new ATOM 0 HA GLU D 104 24.569 21.334 33.776 1.00 14.80 H new ATOM 0 HB2 GLU D 104 23.281 19.902 35.062 1.00 14.64 H new ATOM 0 HB3 GLU D 104 23.707 18.671 34.205 1.00 14.64 H new ATOM 0 HG2 GLU D 104 25.949 18.950 35.051 1.00 19.02 H new ATOM 0 HG3 GLU D 104 25.398 20.046 36.015 1.00 19.02 H new ATOM 3867 N GLU D 105 26.781 20.589 32.927 1.00 16.82 N ATOM 3868 CA GLU D 105 28.033 20.145 32.310 1.00 18.75 C ATOM 3869 C GLU D 105 28.576 18.880 32.981 1.00 20.06 C ATOM 3870 O GLU D 105 28.310 18.631 34.158 1.00 19.69 O ATOM 3871 CB GLU D 105 29.099 21.227 32.376 1.00 18.87 C ATOM 3872 CG GLU D 105 28.742 22.516 31.677 1.00 20.03 C ATOM 3873 CD GLU D 105 28.480 22.374 30.180 1.00 22.85 C ATOM 3874 OE1 GLU D 105 29.148 21.546 29.487 1.00 24.80 O ATOM 3875 OE2 GLU D 105 27.605 23.131 29.696 1.00 20.81 O ATOM 0 H GLU D 105 26.853 21.285 33.427 1.00 16.82 H new ATOM 0 HA GLU D 105 27.827 19.951 31.382 1.00 18.75 H new ATOM 0 HB2 GLU D 105 29.287 21.421 33.308 1.00 18.87 H new ATOM 0 HB3 GLU D 105 29.918 20.880 31.988 1.00 18.87 H new ATOM 0 HG2 GLU D 105 27.952 22.891 32.098 1.00 20.03 H new ATOM 0 HG3 GLU D 105 29.462 23.152 31.809 1.00 20.03 H new ATOM 3876 N LEU D 106 29.335 18.092 32.212 1.00 21.75 N ATOM 3877 CA LEU D 106 29.878 16.798 32.686 1.00 23.72 C ATOM 3878 C LEU D 106 31.395 16.801 32.687 1.00 25.46 C ATOM 3879 O LEU D 106 32.022 16.082 33.469 1.00 25.29 O ATOM 3880 CB LEU D 106 29.380 15.641 31.842 1.00 22.72 C ATOM 3881 CG LEU D 106 27.889 15.388 32.036 1.00 25.60 C ATOM 3882 CD1 LEU D 106 27.366 14.379 30.995 1.00 24.04 C ATOM 3883 CD2 LEU D 106 27.609 14.947 33.493 1.00 24.96 C ATOM 0 H LEU D 106 29.552 18.286 31.403 1.00 21.75 H new ATOM 0 HA LEU D 106 29.561 16.681 33.595 1.00 23.72 H new ATOM 0 HB2 LEU D 106 29.556 15.826 30.906 1.00 22.72 H new ATOM 0 HB3 LEU D 106 29.875 14.839 32.071 1.00 22.72 H new ATOM 0 HG LEU D 106 27.401 16.213 31.888 1.00 25.60 H new ATOM 0 HD11 LEU D 106 26.418 14.232 31.135 1.00 24.04 H new ATOM 0 HD12 LEU D 106 27.510 14.731 30.103 1.00 24.04 H new ATOM 0 HD13 LEU D 106 27.841 13.539 31.091 1.00 24.04 H new ATOM 0 HD21 LEU D 106 26.659 14.789 33.606 1.00 24.96 H new ATOM 0 HD22 LEU D 106 28.097 14.131 33.684 1.00 24.96 H new ATOM 0 HD23 LEU D 106 27.895 15.645 34.103 1.00 24.96 H new ATOM 3884 N VAL D 107 31.978 17.601 31.801 1.00 26.64 N ATOM 3885 CA VAL D 107 33.422 17.786 31.771 1.00 27.19 C ATOM 3886 C VAL D 107 33.733 19.277 31.792 1.00 28.41 C ATOM 3887 O VAL D 107 32.881 20.104 31.436 1.00 27.95 O ATOM 3888 CB VAL D 107 34.069 17.077 30.570 1.00 27.68 C ATOM 3889 CG1 VAL D 107 33.997 15.554 30.764 1.00 28.77 C ATOM 3890 CG2 VAL D 107 33.397 17.473 29.266 1.00 27.29 C ATOM 3891 OXT VAL D 107 34.829 19.689 32.178 1.00 28.83 O ATOM 0 H VAL D 107 31.550 18.049 31.204 1.00 26.64 H new ATOM 0 HA VAL D 107 33.809 17.374 32.559 1.00 27.19 H new ATOM 0 HB VAL D 107 34.998 17.352 30.520 1.00 27.68 H new ATOM 0 HG11 VAL D 107 34.406 15.111 30.004 1.00 28.77 H new ATOM 0 HG12 VAL D 107 34.470 15.308 31.574 1.00 28.77 H new ATOM 0 HG13 VAL D 107 33.069 15.280 30.836 1.00 28.77 H new ATOM 0 HG21 VAL D 107 33.825 17.012 28.528 1.00 27.29 H new ATOM 0 HG22 VAL D 107 32.459 17.230 29.298 1.00 27.29 H new ATOM 0 HG23 VAL D 107 33.478 18.431 29.138 1.00 27.29 H new TER 3892 VAL D 107 HETATM 3893 CAF 4ML A 201 25.714 10.211 18.708 1.00 21.03 C HETATM 3894 CAE 4ML A 201 25.266 10.877 19.785 1.00 19.29 C HETATM 3895 CAJ 4ML A 201 26.327 11.192 20.550 1.00 19.81 C HETATM 3896 OAC 4ML A 201 26.243 11.747 21.639 1.00 17.19 O HETATM 3897 OAH 4ML A 201 27.514 10.741 20.076 1.00 17.63 O HETATM 3898 CAK 4ML A 201 27.248 10.251 18.775 1.00 21.62 C HETATM 3899 CAA 4ML A 201 27.698 11.245 17.682 1.00 18.34 C HETATM 3900 CAG 4ML A 201 27.917 8.913 18.582 1.00 22.37 C HETATM 3901 CAI 4ML A 201 27.010 7.886 19.237 1.00 25.37 C HETATM 3902 OAD 4ML A 201 25.790 8.151 19.245 1.00 30.64 O HETATM 3903 OAB 4ML A 201 27.554 6.923 19.787 1.00 22.96 O HETATM 0 HAGA 4ML A 201 28.036 8.718 17.639 1.00 22.37 H new HETATM 0 HAAB 4ML A 201 27.394 10.933 16.815 1.00 18.34 H new HETATM 0 HAAA 4ML A 201 27.317 12.119 17.862 1.00 18.34 H new HETATM 0 HAG 4ML A 201 28.798 8.905 18.987 1.00 22.37 H new HETATM 0 HAF 4ML A 201 25.174 9.788 18.022 1.00 21.03 H new HETATM 0 HAE 4ML A 201 24.340 11.093 19.977 1.00 19.29 H new HETATM 0 HAA 4ML A 201 28.666 11.309 17.681 1.00 18.34 H new HETATM 3904 CAF 4ML A 202 24.118 9.386 11.565 1.00 35.81 C HETATM 3905 CAE 4ML A 202 23.875 8.300 12.308 1.00 36.48 C HETATM 3906 CAJ 4ML A 202 23.641 8.654 13.587 1.00 37.57 C HETATM 3907 OAC 4ML A 202 23.404 7.826 14.485 1.00 37.70 O HETATM 3908 OAH 4ML A 202 23.710 10.015 13.790 1.00 34.58 O HETATM 3909 CAK 4ML A 202 24.013 10.607 12.493 1.00 34.93 C HETATM 3910 CAA 4ML A 202 22.845 11.460 11.986 1.00 33.49 C HETATM 3911 CAG 4ML A 202 25.325 11.433 12.494 1.00 32.61 C HETATM 3912 CAI 4ML A 202 26.566 10.743 13.109 1.00 32.08 C HETATM 3913 OAD 4ML A 202 27.088 9.810 12.447 1.00 29.71 O HETATM 3914 OAB 4ML A 202 27.019 11.214 14.193 1.00 26.74 O HETATM 0 HAGA 4ML A 202 25.533 11.675 11.578 1.00 32.61 H new HETATM 0 HAAB 4ML A 202 23.020 11.739 11.073 1.00 33.49 H new HETATM 0 HAAA 4ML A 202 22.027 10.939 12.014 1.00 33.49 H new HETATM 0 HAG 4ML A 202 25.165 12.259 12.977 1.00 32.61 H new HETATM 0 HAF 4ML A 202 24.322 9.400 10.617 1.00 35.81 H new HETATM 0 HAE 4ML A 202 23.868 7.389 11.974 1.00 36.48 H new HETATM 0 HAA 4ML A 202 22.748 12.243 12.550 1.00 33.49 H new HETATM 3915 CAF 4ML B 201 -9.583 14.674 18.526 1.00 22.60 C HETATM 3916 CAE 4ML B 201 -10.224 15.141 17.437 1.00 20.75 C HETATM 3917 CAJ 4ML B 201 -10.421 14.104 16.611 1.00 16.53 C HETATM 3918 OAC 4ML B 201 -10.912 14.192 15.513 1.00 14.63 O HETATM 3919 OAH 4ML B 201 -10.005 12.927 17.084 1.00 17.01 O HETATM 3920 CAK 4ML B 201 -9.532 13.148 18.418 1.00 20.46 C HETATM 3921 CAA 4ML B 201 -10.462 12.614 19.532 1.00 18.19 C HETATM 3922 CAG 4ML B 201 -8.162 12.490 18.525 1.00 22.69 C HETATM 3923 CAI 4ML B 201 -7.191 13.403 17.842 1.00 22.75 C HETATM 3924 OAD 4ML B 201 -6.280 12.884 17.224 1.00 20.27 O HETATM 3925 OAB 4ML B 201 -7.452 14.617 17.932 1.00 25.71 O HETATM 0 HAGA 4ML B 201 -7.915 12.358 19.454 1.00 22.69 H new HETATM 0 HAAB 4ML B 201 -10.139 12.916 20.396 1.00 18.19 H new HETATM 0 HAAA 4ML B 201 -11.362 12.946 19.389 1.00 18.19 H new HETATM 0 HAG 4ML B 201 -8.166 11.616 18.105 1.00 22.69 H new HETATM 0 HAF 4ML B 201 -9.219 15.209 19.249 1.00 22.60 H new HETATM 0 HAE 4ML B 201 -10.494 16.059 17.280 1.00 20.75 H new HETATM 0 HAA 4ML B 201 -10.469 11.644 19.511 1.00 18.19 H new HETATM 3926 CAF 4ML B 202 -8.294 15.909 25.633 1.00 29.62 C HETATM 3927 CAE 4ML B 202 -7.274 16.075 24.792 1.00 31.19 C HETATM 3928 CAJ 4ML B 202 -7.692 16.549 23.589 1.00 33.54 C HETATM 3929 OAC 4ML B 202 -6.927 16.777 22.632 1.00 33.35 O HETATM 3930 OAH 4ML B 202 -9.060 16.685 23.512 1.00 30.19 O HETATM 3931 CAK 4ML B 202 -9.576 16.312 24.851 1.00 31.24 C HETATM 3932 CAA 4ML B 202 -10.250 17.547 25.487 1.00 28.73 C HETATM 3933 CAG 4ML B 202 -10.556 15.115 24.792 1.00 28.85 C HETATM 3934 CAI 4ML B 202 -9.916 13.870 24.139 1.00 27.88 C HETATM 3935 OAD 4ML B 202 -10.480 13.352 23.118 1.00 26.14 O HETATM 3936 OAB 4ML B 202 -8.881 13.427 24.693 1.00 25.26 O HETATM 0 HAGA 4ML B 202 -10.848 14.893 25.690 1.00 28.85 H new HETATM 0 HAAB 4ML B 202 -10.496 17.345 26.403 1.00 28.73 H new HETATM 0 HAAA 4ML B 202 -9.632 18.295 25.476 1.00 28.73 H new HETATM 0 HAG 4ML B 202 -11.347 15.371 24.292 1.00 28.85 H new HETATM 0 HAF 4ML B 202 -8.246 15.598 26.551 1.00 29.62 H new HETATM 0 HAE 4ML B 202 -6.349 15.882 25.011 1.00 31.19 H new HETATM 0 HAA 4ML B 202 -11.045 17.778 24.982 1.00 28.73 H new HETATM 3937 CAF 4ML C 201 -29.781 28.123 13.081 1.00 28.58 C HETATM 3938 CAE 4ML C 201 -29.154 27.826 14.216 1.00 26.46 C HETATM 3939 CAJ 4ML C 201 -30.033 27.233 15.031 1.00 26.19 C HETATM 3940 OAC 4ML C 201 -29.811 26.885 16.182 1.00 25.62 O HETATM 3941 OAH 4ML C 201 -31.269 27.120 14.521 1.00 23.46 O HETATM 3942 CAK 4ML C 201 -31.177 27.544 13.182 1.00 26.97 C HETATM 3943 CAA 4ML C 201 -31.209 26.318 12.287 1.00 27.80 C HETATM 3944 CAG 4ML C 201 -32.362 28.360 12.744 1.00 28.21 C HETATM 3945 CAI 4ML C 201 -32.451 29.704 13.388 1.00 28.43 C HETATM 3946 OAD 4ML C 201 -31.626 30.526 13.025 1.00 32.92 O HETATM 3947 OAB 4ML C 201 -33.369 29.898 14.180 1.00 25.25 O HETATM 0 HAGA 4ML C 201 -32.325 28.475 11.782 1.00 28.21 H new HETATM 0 HAAB 4ML C 201 -31.009 26.578 11.374 1.00 27.80 H new HETATM 0 HAAA 4ML C 201 -30.548 25.677 12.592 1.00 27.80 H new HETATM 0 HAG 4ML C 201 -33.173 27.865 12.939 1.00 28.21 H new HETATM 0 HAF 4ML C 201 -29.414 28.617 12.331 1.00 28.58 H new HETATM 0 HAE 4ML C 201 -28.223 28.008 14.417 1.00 26.46 H new HETATM 0 HAA 4ML C 201 -32.090 25.914 12.322 1.00 27.80 H new HETATM 3948 CAF 4ML C 202 -29.703 29.773 6.367 0.50 25.13 C HETATM 3949 CAE 4ML C 202 -30.042 30.820 7.112 0.50 26.58 C HETATM 3950 CAJ 4ML C 202 -29.211 30.965 8.159 0.50 26.17 C HETATM 3951 OAC 4ML C 202 -29.323 31.887 8.981 0.50 26.44 O HETATM 3952 OAH 4ML C 202 -28.241 30.001 8.217 0.50 25.58 O HETATM 3953 CAK 4ML C 202 -28.508 29.124 7.070 0.50 25.74 C HETATM 3954 CAA 4ML C 202 -27.298 28.937 6.153 0.50 24.77 C HETATM 3955 CAG 4ML C 202 -29.021 27.783 7.508 0.50 22.92 C HETATM 3956 CAI 4ML C 202 -30.206 27.402 6.624 0.50 21.07 C HETATM 3957 OAD 4ML C 202 -30.155 26.330 6.038 0.50 21.18 O HETATM 3958 OAB 4ML C 202 -31.163 28.181 6.577 0.50 25.37 O HETATM 0 HAGA 4ML C 202 -28.321 27.116 7.438 0.50 22.92 H new HETATM 0 HAAB 4ML C 202 -27.542 28.368 5.406 0.50 24.77 H new HETATM 0 HAAA 4ML C 202 -27.008 29.800 5.820 0.50 24.77 H new HETATM 0 HAG 4ML C 202 -29.292 27.814 8.439 0.50 22.92 H new HETATM 0 HAF 4ML C 202 -30.127 29.480 5.545 0.50 25.13 H new HETATM 0 HAE 4ML C 202 -30.793 31.405 6.924 0.50 26.58 H new HETATM 0 HAA 4ML C 202 -26.575 28.524 6.651 0.50 24.77 H new HETATM 3959 CAF 4ML D 201 12.985 31.048 24.492 1.00 21.46 C HETATM 3960 CAE 4ML D 201 13.232 30.387 23.363 1.00 19.64 C HETATM 3961 CAJ 4ML D 201 13.884 31.199 22.520 1.00 21.91 C HETATM 3962 OAC 4ML D 201 14.220 30.882 21.395 1.00 21.90 O HETATM 3963 OAH 4ML D 201 14.162 32.432 23.015 1.00 19.73 O HETATM 3964 CAK 4ML D 201 13.717 32.378 24.388 1.00 22.39 C HETATM 3965 CAA 4ML D 201 14.902 32.213 25.348 1.00 22.75 C HETATM 3966 CAG 4ML D 201 13.008 33.646 24.794 1.00 24.45 C HETATM 3967 CAI 4ML D 201 11.572 33.698 24.351 1.00 23.37 C HETATM 3968 OAD 4ML D 201 11.286 34.579 23.571 1.00 20.09 O HETATM 3969 OAB 4ML D 201 10.801 32.871 24.828 1.00 30.17 O HETATM 0 HAGA 4ML D 201 13.045 33.734 25.759 1.00 24.45 H new HETATM 0 HAAB 4ML D 201 14.572 32.043 26.244 1.00 22.75 H new HETATM 0 HAAA 4ML D 201 15.451 31.467 25.060 1.00 22.75 H new HETATM 0 HAG 4ML D 201 13.482 34.406 24.422 1.00 24.45 H new HETATM 0 HAF 4ML D 201 12.444 30.741 25.236 1.00 21.46 H new HETATM 0 HAE 4ML D 201 12.981 29.468 23.181 1.00 19.64 H new HETATM 0 HAA 4ML D 201 15.434 33.024 25.348 1.00 22.75 H new HETATM 3970 O HOH A 108 26.034 21.063 22.940 1.00 10.16 O HETATM 3971 O HOH A 109 35.736 18.427 21.734 1.00 14.32 O HETATM 3972 O HOH A 110 38.917 15.169 16.633 1.00 25.70 O HETATM 3973 O HOH A 111 35.256 25.485 9.137 1.00 10.47 O HETATM 3974 O HOH A 112 21.752 -0.741 30.656 1.00 26.26 O HETATM 3975 O HOH A 113 20.754 -4.634 32.692 1.00 22.04 O HETATM 3976 O HOH A 114 29.662 18.918 29.507 1.00 19.61 O HETATM 3977 O HOH A 115 29.582 26.916 18.239 1.00 13.80 O HETATM 3978 O HOH A 116 22.444 3.383 41.257 1.00 15.31 O HETATM 3979 O HOH A 117 41.455 15.470 17.104 1.00 40.42 O HETATM 3980 O HOH A 118 38.149 20.279 4.265 1.00 15.57 O HETATM 3981 O HOH A 119 25.706 19.169 24.801 1.00 12.67 O HETATM 3982 O HOH A 120 12.913 15.828 28.893 1.00 20.81 O HETATM 3983 O HOH A 121 16.812 -1.325 36.162 1.00 41.97 O HETATM 3984 O HOH A 122 32.877 27.211 9.564 1.00 22.64 O HETATM 3985 O HOH A 123 17.667 1.557 36.478 1.00 38.42 O HETATM 3986 O HOH A 124 24.757 20.817 6.990 1.00 42.23 O HETATM 3987 O HOH A 125 37.795 18.791 19.956 1.00 17.31 O HETATM 3988 O HOH A 126 27.559 8.779 38.392 1.00 25.33 O HETATM 3989 O HOH A 127 9.052 16.700 27.503 1.00 24.50 O HETATM 3990 O HOH A 128 33.268 8.014 33.861 1.00 17.89 O HETATM 3991 O HOH A 129 27.676 25.779 21.609 1.00 17.70 O HETATM 3992 O HOH A 130 17.160 12.619 33.363 1.00 22.00 O HETATM 3993 O HOH A 131 23.006 -1.123 27.944 1.00 30.51 O HETATM 3994 O HOH A 132 41.199 12.646 3.984 1.00 41.50 O HETATM 3995 O HOH A 133 39.251 8.953 18.510 1.00 36.18 O HETATM 3996 O HOH A 134 36.749 15.742 21.949 1.00 26.11 O HETATM 3997 O HOH A 135 40.231 11.524 26.284 1.00 34.37 O HETATM 3998 O HOH A 136 33.016 22.357 3.133 1.00 17.90 O HETATM 3999 O HOH A 137 37.523 23.142 3.922 1.00 15.30 O HETATM 4000 O HOH A 138 10.838 21.250 30.293 1.00 21.68 O HETATM 4001 O HOH A 146 24.753 26.412 8.530 1.00 20.87 O HETATM 4002 O HOH A 147 33.888 0.698 21.498 1.00 29.92 O HETATM 4003 O HOH A 149 38.731 16.014 24.000 1.00 24.55 O HETATM 4004 O HOH A 153 20.007 -0.472 24.719 1.00 47.96 O HETATM 4005 O HOH A 172 9.449 9.680 28.493 1.00 24.79 O HETATM 4006 O HOH A 177 17.201 24.751 6.655 1.00 47.55 O HETATM 4007 O HOH A 178 30.014 2.731 34.090 1.00 47.44 O HETATM 4008 O HOH A 180 35.290 27.182 21.056 1.00 33.80 O HETATM 4009 O HOH A 182 10.836 8.784 33.274 1.00 48.64 O HETATM 4010 O HOH A 183 20.932 1.195 22.428 1.00 32.49 O HETATM 4011 O HOH A 194 15.290 5.221 30.202 1.00 48.14 O HETATM 4012 O HOH A 195 24.226 -1.739 32.759 1.00 38.13 O HETATM 4013 O HOH A 197 38.330 13.871 29.142 1.00 43.23 O HETATM 4014 O HOH A 200 41.980 11.126 0.947 1.00 44.97 O HETATM 4015 O HOH A 204 44.177 11.235 16.724 1.00 40.72 O HETATM 4016 O HOH A 215 41.165 15.848 22.129 1.00 29.96 O HETATM 4017 O HOH A 220 34.592 38.315 15.013 1.00 36.09 O HETATM 4018 O HOH A 221 28.527 31.997 14.146 1.00 26.89 O HETATM 4019 O HOH A 223 13.600 17.331 35.589 1.00 32.81 O HETATM 4020 O HOH A 227 40.041 18.461 4.962 1.00 20.99 O HETATM 4021 O HOH A 228 35.605 22.420 2.183 1.00 7.94 O HETATM 4022 O HOH A 230 36.339 19.039 11.532 1.00 10.47 O HETATM 4023 O HOH A 233 43.514 13.270 15.631 1.00 30.46 O HETATM 4024 O HOH A 241 37.865 7.809 7.535 1.00 28.32 O HETATM 4025 O HOH A 244 25.530 24.505 21.654 1.00 12.47 O HETATM 4026 O HOH A 253 20.259 -2.850 34.677 1.00 21.35 O HETATM 4027 O HOH A 260 19.814 13.319 32.981 1.00 21.97 O HETATM 4028 O HOH A 266 33.346 20.239 24.402 1.00 30.49 O HETATM 4029 O HOH A 270 36.428 5.397 19.468 1.00 33.64 O HETATM 4030 O HOH A 271 24.874 21.659 9.859 1.00 33.82 O HETATM 4031 O HOH A 273 31.062 18.514 27.029 1.00 20.49 O HETATM 4032 O HOH A 275 26.052 4.458 44.889 1.00 23.98 O HETATM 4033 O HOH A 277 25.156 10.207 39.833 1.00 39.28 O HETATM 4034 O HOH A 284 38.050 7.024 20.351 1.00 28.35 O HETATM 4035 O HOH A 285 40.884 15.301 11.346 1.00 25.86 O HETATM 4036 O HOH A 288 37.075 13.594 2.882 1.00 32.98 O HETATM 4037 O HOH A 291 29.592 25.260 23.660 1.00 16.75 O HETATM 4038 O HOH A 293 23.141 0.722 35.805 1.00 20.11 O HETATM 4039 O HOH A 303 14.792 14.781 31.562 1.00 22.21 O HETATM 4040 O HOH A 319 35.801 20.106 23.617 1.00 30.97 O HETATM 4041 O HOH A 329 22.641 22.343 7.423 1.00 41.45 O HETATM 4042 O HOH A 332 32.927 19.970 26.912 1.00 23.98 O HETATM 4043 O HOH A 335 23.506 6.802 43.045 1.00 38.84 O HETATM 4044 O HOH A 338 19.734 -1.543 27.083 1.00 50.67 O HETATM 4045 O HOH A 339 39.715 14.320 2.954 1.00 30.45 O HETATM 4046 O HOH A 340 38.588 18.241 -1.107 1.00 30.21 O HETATM 4047 O HOH A 346 2.188 25.750 28.675 1.00 32.31 O HETATM 4048 O HOH A 351 27.820 -2.046 22.347 1.00 31.82 O HETATM 4049 O HOH A 352 18.911 -4.511 30.451 1.00 32.75 O HETATM 4050 O HOH A 357 30.498 -0.397 25.438 1.00 30.93 O HETATM 4051 O HOH A 359 32.158 2.043 29.108 1.00 31.05 O HETATM 4052 O HOH A 364 24.485 33.175 16.359 1.00 19.10 O HETATM 4053 O HOH A 370 26.773 3.067 38.583 1.00 44.53 O HETATM 4054 O HOH A 371 21.192 23.874 5.205 1.00 33.16 O HETATM 4055 O HOH A 374 32.527 0.290 24.532 1.00 39.65 O HETATM 4056 O HOH A 376 38.261 16.004 19.794 1.00 28.01 O HETATM 4057 O HOH A 383 42.106 7.955 18.328 1.00 36.05 O HETATM 4058 O HOH A 388 28.179 1.374 14.983 1.00 48.97 O HETATM 4059 O HOH A 390 34.878 14.056 0.953 1.00 45.50 O HETATM 4060 O HOH A 391 23.335 10.905 38.099 1.00 46.67 O HETATM 4061 O HOH A 393 40.059 9.458 23.070 1.00 28.34 O HETATM 4062 O HOH A 396 32.253 8.734 39.290 1.00 47.75 O HETATM 4063 O HOH A 400 31.629 27.652 22.515 1.00 30.85 O HETATM 4064 O HOH A 405 38.743 3.825 9.200 1.00 48.43 O HETATM 4065 O HOH A 411 20.112 15.004 35.907 1.00 38.26 O HETATM 4066 O HOH A 423 19.676 -0.840 20.624 1.00 41.51 O HETATM 4067 O HOH A 424 32.411 32.001 8.379 1.00 43.44 O HETATM 4068 O HOH A 425 23.991 -3.063 20.425 1.00 33.32 O HETATM 4069 O HOH A 429 35.781 8.147 32.895 1.00 35.43 O HETATM 4070 O HOH A 431 12.743 19.897 36.241 1.00 33.14 O HETATM 4071 O HOH A 451 30.286 29.441 18.223 1.00 26.97 O HETATM 4072 O HOH A 459 10.367 16.067 30.684 1.00 36.72 O HETATM 4073 O HOH A 464 14.468 8.335 35.467 1.00 37.34 O HETATM 4074 O HOH A 465 30.941 26.435 20.273 1.00 35.22 O HETATM 4075 O HOH A 467 30.363 10.966 36.536 1.00 53.54 O HETATM 4076 O HOH A 472 32.862 9.395 35.675 1.00 35.11 O HETATM 4077 O HOH A 474 28.313 24.888 7.523 1.00 34.43 O HETATM 4078 O HOH A 478 24.386 3.489 42.956 1.00 32.63 O HETATM 4079 O HOH A 483 26.608 31.317 13.115 1.00 31.01 O HETATM 4080 O HOH A 484 25.047 23.795 11.217 1.00 33.72 O HETATM 4081 O HOH A 485 25.935 23.985 8.589 1.00 32.98 O HETATM 4082 O HOH A 486 30.851 0.188 31.353 1.00 33.30 O HETATM 4083 O HOH A 487 37.588 6.628 28.129 1.00 43.17 O HETATM 4084 O HOH A 488 38.863 7.186 26.115 1.00 40.65 O HETATM 4085 O HOH A 489 14.395 23.464 35.909 1.00 39.81 O HETATM 4086 O HOH A 490 8.870 30.858 28.214 1.00 30.84 O HETATM 4087 O HOH A 492 19.543 33.667 7.577 1.00 42.30 O HETATM 4088 O HOH A 494 30.176 38.216 10.105 1.00 37.72 O HETATM 4089 O HOH A 495 23.055 32.537 6.521 1.00 44.40 O HETATM 4090 O HOH A 513 3.075 18.434 23.805 1.00 37.85 O HETATM 4091 O HOH B 108 -18.469 15.067 12.556 1.00 9.24 O HETATM 4092 O HOH B 109 -8.467 8.143 -1.071 1.00 33.55 O HETATM 4093 O HOH B 110 -20.486 14.858 14.482 1.00 11.54 O HETATM 4094 O HOH B 111 -11.635 24.190 24.358 1.00 14.05 O HETATM 4095 O HOH B 112 -3.316 24.697 11.074 1.00 16.32 O HETATM 4096 O HOH B 113 -13.769 25.783 5.658 1.00 21.98 O HETATM 4097 O HOH B 114 -14.741 27.737 8.467 1.00 14.60 O HETATM 4098 O HOH B 115 -4.989 1.650 30.166 1.00 53.12 O HETATM 4099 O HOH B 116 -8.878 0.773 18.446 1.00 26.35 O HETATM 4100 O HOH B 117 -0.128 18.701 14.211 1.00 23.22 O HETATM 4101 O HOH B 118 -8.579 13.363 -1.059 1.00 21.77 O HETATM 4102 O HOH B 119 -15.868 -0.573 14.560 1.00 26.11 O HETATM 4103 O HOH B 120 -26.283 11.456 19.075 1.00 15.00 O HETATM 4104 O HOH B 121 -18.063 5.026 15.562 1.00 17.47 O HETATM 4105 O HOH B 122 -28.870 10.557 18.910 1.00 40.24 O HETATM 4106 O HOH B 123 -23.691 15.425 15.702 1.00 13.53 O HETATM 4107 O HOH B 124 -18.319 2.887 17.535 1.00 20.42 O HETATM 4108 O HOH B 126 -7.843 7.561 3.310 1.00 13.47 O HETATM 4109 O HOH B 127 -8.227 30.881 9.270 1.00 27.06 O HETATM 4110 O HOH B 128 -24.866 5.999 28.426 1.00 21.61 O HETATM 4111 O HOH B 129 -19.761 7.707 10.676 1.00 24.94 O HETATM 4112 O HOH B 130 -2.943 27.475 6.088 1.00 38.10 O HETATM 4113 O HOH B 131 -15.523 3.896 15.261 1.00 19.17 O HETATM 4114 O HOH B 132 -12.682 3.501 34.247 1.00 18.77 O HETATM 4115 O HOH B 133 -17.942 9.711 10.365 1.00 25.37 O HETATM 4116 O HOH B 134 -21.351 8.257 34.068 1.00 18.58 O HETATM 4117 O HOH B 135 -7.732 -1.426 18.742 1.00 31.61 O HETATM 4118 O HOH B 136 0.271 11.038 -0.309 1.00 22.88 O HETATM 4119 O HOH B 137 -12.692 21.197 4.418 1.00 16.57 O HETATM 4120 O HOH B 138 -16.627 4.587 39.225 1.00 29.10 O HETATM 4121 O HOH B 139 -4.773 1.306 12.561 1.00 40.30 O HETATM 4122 O HOH B 140 -23.638 39.121 9.170 1.00 32.55 O HETATM 4123 O HOH B 141 -14.835 -0.005 26.386 1.00 28.13 O HETATM 4124 O HOH B 142 -3.893 27.619 17.198 1.00 32.91 O HETATM 4125 O HOH B 143 2.670 28.319 3.440 1.00 24.07 O HETATM 4126 O HOH B 144 -23.898 4.743 14.929 1.00 39.96 O HETATM 4127 O HOH B 145 -15.894 33.747 6.182 1.00 32.71 O HETATM 4128 O HOH B 146 0.518 29.574 6.715 1.00 46.79 O HETATM 4129 O HOH B 147 -33.168 12.057 17.147 1.00 53.32 O HETATM 4130 O HOH B 148 -6.306 0.795 14.249 1.00 39.40 O HETATM 4131 O HOH B 156 -21.116 18.313 29.895 1.00 36.84 O HETATM 4132 O HOH B 157 -14.610 7.476 36.602 1.00 37.82 O HETATM 4133 O HOH B 158 -17.873 1.749 11.970 1.00 34.70 O HETATM 4134 O HOH B 159 -3.091 7.941 -1.270 1.00 28.42 O HETATM 4135 O HOH B 163 -23.388 24.050 30.902 1.00 40.92 O HETATM 4136 O HOH B 169 -14.853 24.601 2.175 1.00 42.46 O HETATM 4137 O HOH B 170 -13.411 28.649 5.260 1.00 26.99 O HETATM 4138 O HOH B 171 -10.317 31.500 4.408 1.00 49.63 O HETATM 4139 O HOH B 173 -34.249 14.931 21.678 1.00 33.26 O HETATM 4140 O HOH B 176 -32.323 16.107 18.268 1.00 15.17 O HETATM 4141 O HOH B 179 -3.246 7.959 3.425 1.00 30.28 O HETATM 4142 O HOH B 181 -15.008 35.763 16.122 1.00 29.97 O HETATM 4143 O HOH B 185 -7.922 28.258 10.292 1.00 33.16 O HETATM 4144 O HOH B 190 -15.283 -0.668 20.515 1.00 36.26 O HETATM 4145 O HOH B 191 -14.602 14.579 32.366 1.00 53.63 O HETATM 4146 O HOH B 199 -24.363 3.182 17.725 1.00 33.24 O HETATM 4147 O HOH B 208 -8.242 15.676 -5.379 1.00 30.76 O HETATM 4148 O HOH B 212 -2.936 2.579 16.599 1.00 39.67 O HETATM 4149 O HOH B 213 -3.988 30.000 14.333 1.00 37.46 O HETATM 4150 O HOH B 219 -31.327 12.357 23.442 1.00 22.87 O HETATM 4151 O HOH B 224 -18.488 4.574 25.861 1.00 10.66 O HETATM 4152 O HOH B 226 -17.819 1.062 32.632 1.00 13.41 O HETATM 4153 O HOH B 229 -3.542 13.330 -1.242 1.00 16.57 O HETATM 4154 O HOH B 231 -19.726 3.102 33.665 1.00 17.68 O HETATM 4155 O HOH B 234 -21.324 6.082 35.440 1.00 15.86 O HETATM 4156 O HOH B 235 -14.793 1.758 20.679 1.00 19.79 O HETATM 4157 O HOH B 238 -7.553 1.992 29.356 1.00 25.43 O HETATM 4158 O HOH B 245 -4.167 15.674 -7.359 1.00 13.85 O HETATM 4159 O HOH B 248 -12.048 10.251 -2.105 1.00 55.00 O HETATM 4160 O HOH B 250 -3.880 24.878 6.987 1.00 19.20 O HETATM 4161 O HOH B 254 -35.636 20.341 28.969 1.00 31.99 O HETATM 4162 O HOH B 257 -11.720 23.890 4.287 1.00 18.73 O HETATM 4163 O HOH B 258 -13.570 0.975 34.665 1.00 36.66 O HETATM 4164 O HOH B 261 -22.688 15.692 26.297 1.00 30.64 O HETATM 4165 O HOH B 267 -1.895 7.648 7.354 1.00 30.69 O HETATM 4166 O HOH B 269 -19.893 7.423 13.219 1.00 23.88 O HETATM 4167 O HOH B 278 -17.383 31.941 3.537 1.00 37.71 O HETATM 4168 O HOH B 280 -24.521 11.348 13.838 1.00 14.91 O HETATM 4169 O HOH B 297 -6.868 2.374 16.773 1.00 32.27 O HETATM 4170 O HOH B 305 -12.158 17.466 -0.444 1.00 51.17 O HETATM 4171 O HOH B 308 -34.474 14.874 18.092 1.00 19.96 O HETATM 4172 O HOH B 309 -9.739 8.301 1.327 1.00 25.80 O HETATM 4173 O HOH B 311 -25.166 13.289 15.688 1.00 18.13 O HETATM 4174 O HOH B 313 -19.795 4.968 13.638 1.00 26.97 O HETATM 4175 O HOH B 315 -10.054 3.088 34.030 1.00 32.85 O HETATM 4176 O HOH B 323 -26.518 8.237 28.023 1.00 23.61 O HETATM 4177 O HOH B 324 -5.557 6.949 2.265 1.00 21.31 O HETATM 4178 O HOH B 325 -15.822 1.776 13.371 1.00 29.26 O HETATM 4179 O HOH B 327 0.276 23.637 2.166 1.00 20.35 O HETATM 4180 O HOH B 342 -9.043 -2.208 20.962 1.00 37.26 O HETATM 4181 O HOH B 344 -19.170 28.255 1.060 1.00 25.48 O HETATM 4182 O HOH B 350 -12.836 5.083 36.441 1.00 37.96 O HETATM 4183 O HOH B 355 -1.922 29.392 7.705 1.00 35.05 O HETATM 4184 O HOH B 358 -14.156 4.250 38.506 1.00 36.47 O HETATM 4185 O HOH B 360 -9.230 0.512 14.271 1.00 26.10 O HETATM 4186 O HOH B 361 -8.384 1.646 31.986 1.00 32.12 O HETATM 4187 O HOH B 363 -1.840 8.712 1.332 1.00 26.60 O HETATM 4188 O HOH B 365 -4.567 1.324 25.201 1.00 35.06 O HETATM 4189 O HOH B 366 -7.108 26.459 2.821 1.00 42.11 O HETATM 4190 O HOH B 372 -25.550 16.235 29.016 1.00 19.07 O HETATM 4191 O HOH B 373 -11.961 7.041 1.146 1.00 30.82 O HETATM 4192 O HOH B 375 -5.125 6.795 -0.322 1.00 28.11 O HETATM 4193 O HOH B 386 -16.453 26.690 1.687 1.00 25.23 O HETATM 4194 O HOH B 389 -13.720 32.703 7.489 1.00 34.57 O HETATM 4195 O HOH B 392 -36.437 14.610 22.526 1.00 38.33 O HETATM 4196 O HOH B 394 -20.043 5.291 9.222 1.00 42.70 O HETATM 4197 O HOH B 395 -32.472 16.625 21.038 1.00 17.62 O HETATM 4198 O HOH B 398 -25.792 9.840 17.125 1.00 34.97 O HETATM 4199 O HOH B 402 -17.198 37.729 13.500 1.00 22.39 O HETATM 4200 O HOH B 403 -15.720 1.736 17.665 1.00 29.52 O HETATM 4201 O HOH B 406 -9.502 30.051 12.920 1.00 38.07 O HETATM 4202 O HOH B 407 -23.180 38.432 6.405 1.00 38.24 O HETATM 4203 O HOH B 408 -16.143 14.800 30.555 1.00 44.77 O HETATM 4204 O HOH B 420 -27.037 14.153 29.202 1.00 29.59 O HETATM 4205 O HOH B 421 3.457 17.213 12.746 1.00 38.65 O HETATM 4206 O HOH B 426 -5.039 3.851 17.694 1.00 32.69 O HETATM 4207 O HOH B 428 -7.781 -0.095 27.643 1.00 41.43 O HETATM 4208 O HOH B 432 -11.082 35.259 13.002 1.00 45.81 O HETATM 4209 O HOH B 433 -19.519 38.245 6.195 1.00 51.95 O HETATM 4210 O HOH B 436 -8.396 5.029 4.010 1.00 29.95 O HETATM 4211 O HOH B 438 -1.373 26.621 4.344 1.00 24.68 O HETATM 4212 O HOH B 439 -14.153 15.847 30.188 1.00 41.56 O HETATM 4213 O HOH B 446 -11.766 0.053 10.861 1.00 27.74 O HETATM 4214 O HOH B 448 -0.406 5.911 15.508 1.00 27.72 O HETATM 4215 O HOH B 450 -13.710 20.817 1.474 1.00 45.42 O HETATM 4216 O HOH B 455 -13.795 2.368 11.569 1.00 39.87 O HETATM 4217 O HOH B 461 -7.502 30.049 5.053 1.00 41.93 O HETATM 4218 O HOH B 463 -28.720 8.977 29.861 1.00 37.75 O HETATM 4219 O HOH B 470 -38.255 16.267 24.403 1.00 39.89 O HETATM 4220 O HOH B 473 -12.883 17.689 30.054 1.00 36.07 O HETATM 4221 O HOH B 475 0.397 10.073 4.727 1.00 39.01 O HETATM 4222 O HOH B 476 -4.271 8.357 26.509 1.00 21.96 O HETATM 4223 O HOH B 479 -10.168 16.065 -2.283 1.00 33.05 O HETATM 4224 O HOH B 480 -0.257 10.730 21.469 1.00 30.05 O HETATM 4225 O HOH B 481 -30.341 14.295 24.330 1.00 25.14 O HETATM 4226 O HOH B 482 -27.402 31.217 4.697 1.00 44.42 O HETATM 4227 O HOH B 496 -31.934 12.727 21.105 1.00 31.83 O HETATM 4228 O HOH B 497 -24.069 12.517 30.095 1.00 33.42 O HETATM 4229 O HOH B 498 -23.220 15.003 28.811 1.00 23.45 O HETATM 4230 O HOH B 499 -22.434 19.167 31.851 1.00 39.88 O HETATM 4231 O HOH B 500 1.816 16.830 9.286 1.00 35.18 O HETATM 4232 O HOH B 502 -13.718 2.011 9.189 1.00 38.39 O HETATM 4233 O HOH B 503 -16.979 37.105 5.778 1.00 41.57 O HETATM 4234 O HOH B 504 -4.678 11.085 29.679 1.00 42.20 O HETATM 4235 O HOH B 505 2.398 11.742 13.956 1.00 32.79 O HETATM 4236 O HOH B 506 0.202 7.492 12.511 1.00 37.37 O HETATM 4237 O HOH B 507 -30.791 15.379 29.024 1.00 44.69 O HETATM 4238 O HOH B 515 -31.403 9.021 29.678 1.00 40.52 O HETATM 4239 O HOH B 516 4.102 16.095 7.849 1.00 28.18 O HETATM 4240 O HOH B 517 -1.362 5.265 28.267 1.00 38.66 O HETATM 4241 O HOH B 518 2.331 9.719 23.341 1.00 38.40 O HETATM 4242 O HOH B 519 1.358 6.200 20.658 1.00 35.91 O HETATM 4243 O HOH B 520 -38.587 19.232 24.613 1.00 37.51 O HETATM 4244 O HOH C 108 -26.182 20.210 19.011 1.00 9.08 O HETATM 4245 O HOH C 109 -39.645 17.807 11.064 1.00 17.05 O HETATM 4246 O HOH C 110 -20.148 29.939 7.304 1.00 18.58 O HETATM 4247 O HOH C 111 -18.242 38.403 28.475 1.00 31.74 O HETATM 4248 O HOH C 112 -37.453 18.492 15.930 1.00 18.75 O HETATM 4249 O HOH C 113 -42.844 24.718 2.763 1.00 11.79 O HETATM 4250 O HOH C 114 -22.510 15.635 6.545 1.00 16.65 O HETATM 4251 O HOH C 115 -39.682 25.209 27.435 1.00 21.81 O HETATM 4252 O HOH C 116 -9.650 29.425 25.348 1.00 26.00 O HETATM 4253 O HOH C 117 -35.811 15.951 5.788 1.00 15.47 O HETATM 4254 O HOH C 118 -33.560 13.301 -3.665 1.00 13.05 O HETATM 4255 O HOH C 119 -27.216 13.514 17.610 1.00 17.60 O HETATM 4256 O HOH C 120 -43.822 33.258 8.810 1.00 20.17 O HETATM 4257 O HOH C 121 -29.972 38.217 16.995 1.00 18.22 O HETATM 4258 O HOH C 122 -31.862 19.303 21.231 1.00 10.66 O HETATM 4259 O HOH C 123 -31.111 25.518 8.536 1.00 18.42 O HETATM 4260 O HOH C 125 -13.163 28.999 25.371 1.00 22.51 O HETATM 4261 O HOH C 126 -24.685 19.211 1.364 1.00 29.29 O HETATM 4262 O HOH C 127 -44.058 22.314 18.917 1.00 29.92 O HETATM 4263 O HOH C 128 -14.029 32.503 26.520 1.00 41.20 O HETATM 4264 O HOH C 129 -24.549 18.492 3.984 1.00 16.64 O HETATM 4265 O HOH C 130 -37.561 34.816 9.609 1.00 22.76 O HETATM 4266 O HOH C 131 -25.123 40.468 17.542 1.00 31.79 O HETATM 4267 O HOH C 132 -31.825 37.776 30.105 1.00 19.08 O HETATM 4268 O HOH C 133 -35.461 16.690 16.041 1.00 18.82 O HETATM 4269 O HOH C 134 -14.831 30.415 6.855 1.00 23.26 O HETATM 4270 O HOH C 135 -26.235 11.726 11.874 1.00 25.01 O HETATM 4271 O HOH C 136 -20.718 37.274 28.445 1.00 31.88 O HETATM 4272 O HOH C 137 -15.725 34.434 28.178 1.00 38.89 O HETATM 4273 O HOH C 138 -15.553 31.420 9.734 1.00 17.94 O HETATM 4274 O HOH C 139 -39.260 32.256 24.444 1.00 35.21 O HETATM 4275 O HOH C 140 -41.663 33.731 15.914 1.00 24.11 O HETATM 4276 O HOH C 141 -16.291 26.281 29.987 1.00 33.00 O HETATM 4277 O HOH C 142 -26.240 39.302 30.350 1.00 29.03 O HETATM 4278 O HOH C 143 -23.044 27.825 27.205 1.00 15.95 O HETATM 4279 O HOH C 144 -34.589 34.671 8.833 1.00 29.76 O HETATM 4280 O HOH C 145 -24.023 15.553 4.149 1.00 33.22 O HETATM 4281 O HOH C 146 -43.229 31.029 3.401 1.00 22.11 O HETATM 4282 O HOH C 152 -37.156 13.146 7.219 1.00 40.19 O HETATM 4283 O HOH C 154 -1.531 24.555 22.224 1.00 24.81 O HETATM 4284 O HOH C 161 -19.847 30.702 29.599 1.00 44.87 O HETATM 4285 O HOH C 165 -39.540 23.946 -7.381 1.00 29.36 O HETATM 4286 O HOH C 166 -31.196 10.893 12.476 1.00 39.94 O HETATM 4287 O HOH C 168 -19.200 33.338 33.109 1.00 44.21 O HETATM 4288 O HOH C 174 -38.944 32.734 29.600 1.00 36.89 O HETATM 4289 O HOH C 175 -42.213 34.919 10.268 1.00 35.28 O HETATM 4290 O HOH C 184 -34.175 33.217 32.807 1.00 28.64 O HETATM 4291 O HOH C 189 -24.535 40.577 21.061 1.00 29.32 O HETATM 4292 O HOH C 192 -36.251 25.075 30.127 1.00 27.49 O HETATM 4293 O HOH C 193 -38.810 28.561 29.015 1.00 30.94 O HETATM 4294 O HOH C 203 -31.820 39.705 25.089 1.00 33.77 O HETATM 4295 O HOH C 205 -42.186 25.968 23.487 1.00 32.31 O HETATM 4296 O HOH C 207 -9.031 19.435 30.509 1.00 41.90 O HETATM 4297 O HOH C 209 -37.770 12.786 11.172 1.00 36.38 O HETATM 4298 O HOH C 210 -42.270 22.983 13.661 1.00 40.26 O HETATM 4299 O HOH C 211 -37.274 14.046 -0.851 1.00 32.50 O HETATM 4300 O HOH C 217 -20.986 10.904 9.464 1.00 30.30 O HETATM 4301 O HOH C 218 -42.184 20.023 23.592 1.00 38.73 O HETATM 4302 O HOH C 222 -37.213 38.082 16.446 1.00 28.08 O HETATM 4303 O HOH C 225 -25.736 18.205 17.066 1.00 9.26 O HETATM 4304 O HOH C 236 -12.159 29.260 22.038 1.00 15.35 O HETATM 4305 O HOH C 237 -18.462 11.172 7.803 1.00 14.34 O HETATM 4306 O HOH C 242 -29.521 40.127 19.468 1.00 43.28 O HETATM 4307 O HOH C 243 -16.057 28.326 23.289 1.00 12.60 O HETATM 4308 O HOH C 247 -23.482 37.624 20.425 1.00 21.97 O HETATM 4309 O HOH C 251 -29.813 18.613 23.710 1.00 17.94 O HETATM 4310 O HOH C 252 -15.488 35.386 22.598 1.00 18.08 O HETATM 4311 O HOH C 262 -22.299 14.304 2.653 1.00 16.12 O HETATM 4312 O HOH C 264 -38.850 27.794 -3.738 1.00 20.21 O HETATM 4313 O HOH C 265 -17.948 28.431 25.980 1.00 17.21 O HETATM 4314 O HOH C 268 -22.600 37.341 24.143 1.00 22.82 O HETATM 4315 O HOH C 274 -39.278 18.929 19.551 1.00 23.48 O HETATM 4316 O HOH C 279 -31.765 10.730 3.423 1.00 27.60 O HETATM 4317 O HOH C 281 -16.827 36.053 26.969 1.00 26.98 O HETATM 4318 O HOH C 283 -20.101 35.122 29.461 1.00 50.66 O HETATM 4319 O HOH C 287 -37.422 26.565 28.177 1.00 18.27 O HETATM 4320 O HOH C 289 -18.097 34.995 21.816 1.00 24.31 O HETATM 4321 O HOH C 298 -27.357 39.812 32.336 1.00 53.41 O HETATM 4322 O HOH C 299 -24.687 29.593 27.979 1.00 39.74 O HETATM 4323 O HOH C 302 -39.875 41.291 11.267 1.00 47.19 O HETATM 4324 O HOH C 304 -36.408 14.582 14.400 1.00 28.46 O HETATM 4325 O HOH C 307 -32.560 22.431 -2.109 1.00 25.63 O HETATM 4326 O HOH C 316 -22.764 37.640 26.231 1.00 29.14 O HETATM 4327 O HOH C 320 -38.841 16.945 18.186 1.00 32.56 O HETATM 4328 O HOH C 321 -28.152 41.783 23.344 1.00 28.99 O HETATM 4329 O HOH C 326 -21.935 18.637 1.628 1.00 28.74 O HETATM 4330 O HOH C 328 -29.793 13.524 19.277 1.00 29.50 O HETATM 4331 O HOH C 330 -32.439 39.285 22.119 1.00 24.28 O HETATM 4332 O HOH C 331 -25.644 46.428 26.363 1.00 28.34 O HETATM 4333 O HOH C 333 -15.397 29.841 26.362 1.00 24.03 O HETATM 4334 O HOH C 334 -20.662 38.803 22.283 1.00 41.70 O HETATM 4335 O HOH C 336 -34.228 32.569 6.560 1.00 45.74 O HETATM 4336 O HOH C 348 -13.917 24.495 30.742 1.00 32.63 O HETATM 4337 O HOH C 349 -31.992 22.658 30.119 1.00 40.71 O HETATM 4338 O HOH C 362 -42.295 19.937 21.053 1.00 22.10 O HETATM 4339 O HOH C 367 -31.350 14.517 -2.620 1.00 25.04 O HETATM 4340 O HOH C 368 -39.605 15.692 7.897 1.00 25.62 O HETATM 4341 O HOH C 369 -23.280 40.726 28.603 1.00 31.97 O HETATM 4342 O HOH C 377 -20.629 29.776 27.404 1.00 26.99 O HETATM 4343 O HOH C 379 -23.051 26.224 29.884 1.00 36.12 O HETATM 4344 O HOH C 380 -36.051 33.071 4.737 1.00 24.51 O HETATM 4345 O HOH C 382 -38.745 17.689 13.851 1.00 30.71 O HETATM 4346 O HOH C 384 -20.662 34.992 32.530 1.00 34.71 O HETATM 4347 O HOH C 385 -27.163 27.961 32.196 1.00 42.08 O HETATM 4348 O HOH C 401 -30.192 28.260 1.915 1.00 25.03 O HETATM 4349 O HOH C 404 -37.092 34.426 32.857 1.00 37.51 O HETATM 4350 O HOH C 409 -37.569 26.353 32.527 1.00 37.76 O HETATM 4351 O HOH C 410 -41.721 28.302 27.405 1.00 42.45 O HETATM 4352 O HOH C 416 -33.207 38.526 27.594 1.00 42.85 O HETATM 4353 O HOH C 417 -14.102 36.026 20.434 1.00 38.72 O HETATM 4354 O HOH C 418 1.700 18.751 19.343 1.00 41.17 O HETATM 4355 O HOH C 419 -43.361 26.235 21.235 1.00 25.54 O HETATM 4356 O HOH C 422 -7.917 21.799 29.561 1.00 44.87 O HETATM 4357 O HOH C 427 -28.590 11.738 14.120 1.00 29.44 O HETATM 4358 O HOH C 430 -43.025 40.192 10.756 1.00 43.62 O HETATM 4359 O HOH C 437 -30.209 39.852 31.074 1.00 42.80 O HETATM 4360 O HOH C 440 -36.552 27.333 -5.158 1.00 26.07 O HETATM 4361 O HOH C 441 -14.447 6.483 3.054 1.00 23.73 O HETATM 4362 O HOH C 443 -17.241 31.314 29.853 1.00 44.20 O HETATM 4363 O HOH C 444 1.560 18.488 16.784 1.00 30.21 O HETATM 4364 O HOH C 449 -26.642 28.860 29.064 1.00 26.16 O HETATM 4365 O HOH C 452 -30.147 39.995 14.820 1.00 34.22 O HETATM 4366 O HOH C 453 -5.773 29.922 18.401 1.00 32.28 O HETATM 4367 O HOH C 454 -37.706 30.614 0.888 1.00 33.03 O HETATM 4368 O HOH C 462 -10.163 21.974 31.177 1.00 49.03 O HETATM 4369 O HOH C 468 -41.865 17.172 2.691 1.00 30.89 O HETATM 4370 O HOH C 469 -33.122 24.996 -2.078 1.00 46.89 O HETATM 4371 O HOH C 471 -33.365 40.479 17.953 1.00 41.35 O HETATM 4372 O HOH C 501 -14.596 9.673 1.580 1.00 27.31 O HETATM 4373 O HOH C 508 -29.309 14.077 0.777 1.00 44.60 O HETATM 4374 O HOH C 509 -25.163 12.769 6.386 1.00 32.95 O HETATM 4375 O HOH C 524 -3.739 24.234 28.688 1.00 38.81 O HETATM 4376 O HOH D 108 24.718 42.760 34.507 1.00 23.66 O HETATM 4377 O HOH D 109 22.782 26.486 20.309 1.00 9.49 O HETATM 4378 O HOH D 110 6.406 30.722 2.150 1.00 27.01 O HETATM 4379 O HOH D 111 25.362 41.172 31.926 1.00 39.23 O HETATM 4380 O HOH D 112 20.747 27.193 18.689 1.00 15.56 O HETATM 4381 O HOH D 113 22.799 38.313 21.619 1.00 18.68 O HETATM 4382 O HOH D 114 26.403 35.452 19.620 1.00 22.27 O HETATM 4383 O HOH D 115 24.575 36.218 21.593 1.00 16.51 O HETATM 4384 O HOH D 116 12.121 17.335 14.142 1.00 16.13 O HETATM 4385 O HOH D 117 24.508 37.423 44.890 1.00 24.28 O HETATM 4386 O HOH D 118 23.646 40.398 26.489 1.00 13.40 O HETATM 4387 O HOH D 119 27.519 27.846 19.937 1.00 18.64 O HETATM 4388 O HOH D 120 21.951 32.755 16.240 1.00 13.89 O HETATM 4389 O HOH D 121 14.442 38.565 9.431 1.00 22.00 O HETATM 4390 O HOH D 122 30.393 25.631 28.919 1.00 42.80 O HETATM 4391 O HOH D 123 19.380 45.159 18.308 1.00 23.50 O HETATM 4392 O HOH D 124 27.568 33.380 41.280 1.00 12.38 O HETATM 4393 O HOH D 125 16.109 15.491 6.465 1.00 27.64 O HETATM 4394 O HOH D 126 2.853 24.941 16.774 1.00 17.08 O HETATM 4395 O HOH D 128 22.216 30.917 13.808 1.00 15.43 O HETATM 4396 O HOH D 129 28.047 37.860 30.539 1.00 32.02 O HETATM 4397 O HOH D 130 1.630 32.145 23.023 1.00 32.38 O HETATM 4398 O HOH D 131 18.359 40.305 40.029 1.00 28.82 O HETATM 4399 O HOH D 132 30.710 32.031 25.026 1.00 38.91 O HETATM 4400 O HOH D 133 0.443 26.373 16.224 1.00 27.93 O HETATM 4401 O HOH D 134 6.701 18.021 18.195 1.00 34.35 O HETATM 4402 O HOH D 135 2.893 31.347 20.854 1.00 22.53 O HETATM 4403 O HOH D 136 -0.965 30.006 14.998 1.00 27.89 O HETATM 4404 O HOH D 137 8.481 37.374 33.234 1.00 27.18 O HETATM 4405 O HOH D 138 8.708 45.307 29.068 1.00 24.32 O HETATM 4406 O HOH D 139 12.929 24.240 10.250 1.00 22.26 O HETATM 4407 O HOH D 140 0.397 26.728 19.816 1.00 50.43 O HETATM 4408 O HOH D 141 15.731 32.066 29.221 1.00 15.80 O HETATM 4409 O HOH D 142 8.773 35.645 31.379 1.00 37.58 O HETATM 4410 O HOH D 144 1.413 33.262 12.950 1.00 34.40 O HETATM 4411 O HOH D 148 29.717 34.343 39.922 1.00 28.44 O HETATM 4412 O HOH D 150 27.411 30.623 17.937 1.00 35.28 O HETATM 4413 O HOH D 151 3.112 38.833 21.360 1.00 25.80 O HETATM 4414 O HOH D 155 18.366 43.272 24.013 1.00 24.78 O HETATM 4415 O HOH D 160 6.482 43.511 27.662 1.00 38.15 O HETATM 4416 O HOH D 162 10.523 44.285 34.820 1.00 41.33 O HETATM 4417 O HOH D 164 10.277 41.219 37.658 1.00 44.74 O HETATM 4418 O HOH D 167 12.514 29.377 4.007 1.00 35.05 O HETATM 4419 O HOH D 186 7.815 42.893 22.057 1.00 23.40 O HETATM 4420 O HOH D 187 -2.798 26.646 9.276 1.00 28.30 O HETATM 4421 O HOH D 188 12.141 37.491 38.778 1.00 37.86 O HETATM 4422 O HOH D 196 0.363 34.950 19.920 1.00 41.63 O HETATM 4423 O HOH D 198 12.234 40.325 8.817 1.00 31.96 O HETATM 4424 O HOH D 206 4.764 16.892 15.085 1.00 43.02 O HETATM 4425 O HOH D 214 13.670 17.179 7.581 1.00 48.77 O HETATM 4426 O HOH D 216 31.700 28.256 31.527 1.00 38.08 O HETATM 4427 O HOH D 232 3.542 24.762 12.674 1.00 19.41 O HETATM 4428 O HOH D 239 22.726 25.096 33.403 1.00 16.71 O HETATM 4429 O HOH D 240 1.472 20.411 11.924 1.00 38.81 O HETATM 4430 O HOH D 249 17.114 43.781 35.597 1.00 13.12 O HETATM 4431 O HOH D 255 29.208 26.888 25.385 1.00 19.18 O HETATM 4432 O HOH D 256 25.327 23.096 30.930 1.00 17.22 O HETATM 4433 O HOH D 259 16.248 12.833 12.917 1.00 19.66 O HETATM 4434 O HOH D 263 26.995 22.736 34.719 1.00 25.98 O HETATM 4435 O HOH D 272 22.206 40.270 18.136 1.00 22.82 O HETATM 4436 O HOH D 276 12.479 44.374 38.892 1.00 34.85 O HETATM 4437 O HOH D 282 15.989 40.649 10.186 1.00 25.08 O HETATM 4438 O HOH D 286 10.693 17.119 10.842 1.00 39.25 O HETATM 4439 O HOH D 290 26.316 31.541 39.883 1.00 27.96 O HETATM 4440 O HOH D 292 26.821 37.397 23.264 1.00 34.07 O HETATM 4441 O HOH D 294 6.692 38.740 28.439 1.00 19.15 O HETATM 4442 O HOH D 295 11.982 19.559 11.377 1.00 17.29 O HETATM 4443 O HOH D 296 -0.736 28.071 16.976 1.00 45.92 O HETATM 4444 O HOH D 300 23.837 39.717 23.681 1.00 24.71 O HETATM 4445 O HOH D 301 2.368 22.574 9.234 1.00 21.15 O HETATM 4446 O HOH D 306 21.128 43.256 16.295 1.00 33.21 O HETATM 4447 O HOH D 310 11.335 13.772 15.428 1.00 19.73 O HETATM 4448 O HOH D 312 5.210 33.073 3.642 1.00 35.25 O HETATM 4449 O HOH D 314 25.352 24.502 33.042 1.00 25.29 O HETATM 4450 O HOH D 317 24.964 32.994 19.077 1.00 15.51 O HETATM 4451 O HOH D 318 11.533 14.516 11.944 1.00 31.44 O HETATM 4452 O HOH D 322 30.471 31.901 34.392 1.00 29.34 O HETATM 4453 O HOH D 337 0.013 30.520 22.075 1.00 43.33 O HETATM 4454 O HOH D 341 5.743 19.453 16.393 1.00 30.66 O HETATM 4455 O HOH D 343 6.764 38.997 33.315 1.00 40.98 O HETATM 4456 O HOH D 345 6.481 36.155 28.777 1.00 35.13 O HETATM 4457 O HOH D 347 21.783 25.457 36.006 1.00 23.58 O HETATM 4458 O HOH D 353 1.700 34.212 15.596 1.00 24.22 O HETATM 4459 O HOH D 356 25.652 40.327 29.668 1.00 25.23 O HETATM 4460 O HOH D 378 8.450 44.583 37.812 1.00 38.89 O HETATM 4461 O HOH D 381 18.837 14.803 7.078 1.00 44.87 O HETATM 4462 O HOH D 387 12.980 31.395 35.692 1.00 28.18 O HETATM 4463 O HOH D 397 14.820 24.418 7.131 1.00 37.74 O HETATM 4464 O HOH D 399 26.809 38.375 18.997 1.00 34.26 O HETATM 4465 O HOH D 412 4.779 23.458 8.747 1.00 49.86 O HETATM 4466 O HOH D 413 15.275 44.295 16.221 1.00 34.02 O HETATM 4467 O HOH D 414 24.376 39.768 19.526 1.00 25.57 O HETATM 4468 O HOH D 415 1.282 32.166 6.476 1.00 29.67 O HETATM 4469 O HOH D 434 25.539 36.231 31.795 1.00 14.79 O HETATM 4470 O HOH D 435 27.414 37.556 38.281 1.00 27.86 O HETATM 4471 O HOH D 442 22.454 22.649 35.734 1.00 33.27 O HETATM 4472 O HOH D 445 15.645 43.214 13.815 1.00 20.66 O HETATM 4473 O HOH D 447 10.953 22.209 10.130 1.00 23.17 O HETATM 4474 O HOH D 456 29.768 29.325 23.776 1.00 31.55 O HETATM 4475 O HOH D 457 21.211 42.764 13.842 1.00 41.20 O HETATM 4476 O HOH D 458 3.380 20.525 16.336 1.00 25.00 O HETATM 4477 O HOH D 460 28.530 41.412 33.148 1.00 31.14 O HETATM 4478 O HOH D 466 15.881 37.393 7.347 1.00 29.05 O HETATM 4479 O HOH D 477 14.253 31.417 31.242 1.00 19.48 O HETATM 4480 O HOH D 491 0.850 30.308 18.633 1.00 34.13 O HETATM 4481 O HOH D 493 15.065 38.199 4.784 1.00 40.67 O HETATM 4482 O HOH D 510 28.390 25.530 30.786 1.00 30.25 O HETATM 4483 O HOH D 512 22.189 39.686 13.157 1.00 34.34 O HETATM 4484 O HOH D 514 14.368 9.511 6.769 1.00 45.76 O HETATM 4485 O HOH D 521 0.073 32.212 16.831 1.00 42.38 O HETATM 4486 O HOH D 522 29.727 32.073 38.120 1.00 38.03 O HETATM 4487 O HOH D 523 32.823 18.756 35.877 1.00 37.57 O CONECT 3893 3894 3898 CONECT 3894 3893 3895 CONECT 3895 3894 3896 3897 CONECT 3896 3895 CONECT 3897 3895 3898 CONECT 3898 3893 3897 3899 3900 CONECT 3899 3898 CONECT 3900 3898 3901 CONECT 3901 3900 3902 3903 CONECT 3902 3901 CONECT 3903 3901 CONECT 3904 3905 3909 CONECT 3905 3904 3906 CONECT 3906 3905 3907 3908 CONECT 3907 3906 CONECT 3908 3906 3909 CONECT 3909 3904 3908 3910 3911 CONECT 3910 3909 CONECT 3911 3909 3912 CONECT 3912 3911 3913 3914 CONECT 3913 3912 CONECT 3914 3912 CONECT 3915 3916 3920 CONECT 3916 3915 3917 CONECT 3917 3916 3918 3919 CONECT 3918 3917 CONECT 3919 3917 3920 CONECT 3920 3915 3919 3921 3922 CONECT 3921 3920 CONECT 3922 3920 3923 CONECT 3923 3922 3924 3925 CONECT 3924 3923 CONECT 3925 3923 CONECT 3926 3927 3931 CONECT 3927 3926 3928 CONECT 3928 3927 3929 3930 CONECT 3929 3928 CONECT 3930 3928 3931 CONECT 3931 3926 3930 3932 3933 CONECT 3932 3931 CONECT 3933 3931 3934 CONECT 3934 3933 3935 3936 CONECT 3935 3934 CONECT 3936 3934 CONECT 3937 3938 3942 CONECT 3938 3937 3939 CONECT 3939 3938 3940 3941 CONECT 3940 3939 CONECT 3941 3939 3942 CONECT 3942 3937 3941 3943 3944 CONECT 3943 3942 CONECT 3944 3942 3945 CONECT 3945 3944 3946 3947 CONECT 3946 3945 CONECT 3947 3945 CONECT 3948 3949 3953 CONECT 3949 3948 3950 CONECT 3950 3949 3951 3952 CONECT 3951 3950 CONECT 3952 3950 3953 CONECT 3953 3948 3952 3954 3955 CONECT 3954 3953 CONECT 3955 3953 3956 CONECT 3956 3955 3957 3958 CONECT 3957 3956 CONECT 3958 3956 CONECT 3959 3960 3964 CONECT 3960 3959 3961 CONECT 3961 3960 3962 3963 CONECT 3962 3961 CONECT 3963 3961 3964 CONECT 3964 3959 3963 3965 3966 CONECT 3965 3964 CONECT 3966 3964 3967 CONECT 3967 3966 3968 3969 CONECT 3968 3967 CONECT 3969 3967 END