USER MOD reduce.3.24.130724 H: found=0, std=0, add=1348, rem=0, adj=61 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER PROTEIN BINDING 10-APR-18 6G8W TITLE CRYSTAL STRUCTURES OF THE SINGLE PDZ DOMAINS FROM GRASP65 AND THEIR TITLE 2 INTERACTION WITH THE GOLGIN GM130 COMPND MOL_ID: 1; COMPND 2 MOLECULE: GOLGI REASSEMBLY-STACKING PROTEIN 1; COMPND 3 CHAIN: A, B; COMPND 4 SYNONYM: GOLGI PERIPHERAL MEMBRANE PROTEIN P65,GOLGI PHOSPHOPROTEIN COMPND 5 5,GOLPH5,GOLGI REASSEMBLY-STACKING PROTEIN OF 65 KDA,GRASP65; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: GORASP1, GOLPH5, GRASP65; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS PDZ2 DOMAIN STRUCTURE, GOLGI STACKING, GRASP FAMILY, GOLGINS, GOLGI KEYWDS 2 APPARATUS, YEAST HOMOLOG OF GRASP65, VESICLE TRANSPORT, PROTEIN KEYWDS 3 BINDING EXPDTA X-RAY DIFFRACTION AUTHOR C.M.JURK,Y.ROSKE,U.HEINEMANN REVDAT 1 24-APR-19 6G8W 0 JRNL AUTH C.M.JURK,Y.ROSKE,U.HEINEMANN JRNL TITL CRYSTAL STRUCTURES OF THE SINGLE PDZ DOMAINS FROM GRASP65 JRNL TITL 2 AND THEIR INTERACTION WITH THE GOLGIN GM130 JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. 2.12 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.8.0189 REMARK 3 AUTHORS : MURSHUDOV,SKUBAK,LEBEDEV,PANNU,STEINER, REMARK 3 : NICHOLLS,WINN,LONG,VAGIN REMARK 3 REMARK 3 REFINEMENT TARGET : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.12 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 26.85 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 99.4 REMARK 3 NUMBER OF REFLECTIONS : 10222 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) : 0.188 REMARK 3 R VALUE (WORKING SET) : 0.186 REMARK 3 FREE R VALUE : 0.235 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 538 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) : 2.12 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.18 REMARK 3 REFLECTION IN BIN (WORKING SET) : 744 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 100.0 REMARK 3 BIN R VALUE (WORKING SET) : 0.2930 REMARK 3 BIN FREE R VALUE SET COUNT : 39 REMARK 3 BIN FREE R VALUE : 0.2560 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1370 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 24 REMARK 3 SOLVENT ATOMS : 94 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 32.95 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 3.41000 REMARK 3 B22 (A**2) : -1.34000 REMARK 3 B33 (A**2) : -0.45000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : -1.97000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.238 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.195 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.177 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 7.298 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.960 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.934 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 1433 ; 0.020 ; 0.019 REMARK 3 BOND LENGTHS OTHERS (A): 1282 ; 0.002 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 1941 ; 1.979 ; 1.970 REMARK 3 BOND ANGLES OTHERS (DEGREES): 2984 ; 1.143 ; 3.000 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 179 ; 6.663 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 59 ;34.690 ;23.898 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 211 ;15.222 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 6 ;11.986 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 209 ; 0.106 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1589 ; 0.009 ; 0.021 REMARK 3 GENERAL PLANES OTHERS (A): 285 ; 0.002 ; 0.020 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): 716 ; 3.355 ; 3.082 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): 715 ; 3.356 ; 3.080 REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 889 ; 5.090 ; 4.576 REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): 890 ; 5.088 ; 4.579 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 716 ; 4.063 ; 3.562 REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): 716 ; 4.061 ; 3.562 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE OTHER ATOMS (A**2): 1051 ; 6.299 ; 5.126 REMARK 3 LONG RANGE B REFINED ATOMS (A**2): 1567 ; 8.959 ;37.231 REMARK 3 LONG RANGE B OTHER ATOMS (A**2): 1568 ; 8.957 ;37.249 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 : NULL 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 6G8W COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 10-APR-18. REMARK 100 THE DEPOSITION ID IS D_1200009593. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 25-MAY-11 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : BESSY REMARK 200 BEAMLINE : 14.1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.91841 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : PIXEL REMARK 200 DETECTOR MANUFACTURER : DECTRIS PILATUS3 6M REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : XSCALE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 10762 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.120 REMARK 200 RESOLUTION RANGE LOW (A) : 26.850 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.3 REMARK 200 DATA REDUNDANCY : 4.100 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 15.7800 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.12 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.18 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 4.10 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 2.970 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: 3RLE REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 46.25 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.29 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 1.4M NA/K PHOSPHATE PH 8.2, VAPOR REMARK 280 DIFFUSION, SITTING DROP, TEMPERATURE 293.15K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 1 2 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,Y,-Z REMARK 290 3555 X+1/2,Y+1/2,Z REMARK 290 4555 -X+1/2,Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 3 1.000000 0.000000 0.000000 25.41250 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 41.30650 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 25.41250 REMARK 290 SMTRY2 4 0.000000 1.000000 0.000000 41.30650 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 1690 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 10590 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: 13.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 375 REMARK 375 SPECIAL POSITION REMARK 375 THE FOLLOWING ATOMS ARE FOUND TO BE WITHIN 0.15 ANGSTROMS REMARK 375 OF A SYMMETRY RELATED ATOM AND ARE ASSUMED TO BE ON SPECIAL REMARK 375 POSITIONS. REMARK 375 REMARK 375 ATOM RES CSSEQI REMARK 375 HOH A 339 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 342 LIES ON A SPECIAL POSITION. REMARK 375 HOH B 407 LIES ON A SPECIAL POSITION. REMARK 375 HOH B 450 LIES ON A SPECIAL POSITION. REMARK 375 HOH B 451 LIES ON A SPECIAL POSITION. 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 ALA A 108 REMARK 465 ILE A 142 REMARK 465 LEU A 143 REMARK 465 GLN A 144 REMARK 465 GLU A 145 REMARK 465 ALA B 108 REMARK 465 SER B 109 REMARK 465 ASP B 140 REMARK 465 GLN B 141 REMARK 465 ILE B 142 REMARK 465 LEU B 143 REMARK 465 GLN B 144 REMARK 465 GLU B 145 REMARK 465 SER B 146 REMARK 465 GLU B 147 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 NE2 HIS A 156 O HOH A 301 2.08 REMARK 500 O HOH B 440 O HOH B 442 2.14 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 OH TYR A 132 OH TYR A 132 2455 1.39 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 ASP A 140 CB - CG - OD1 ANGL. DEV. = 6.2 DEGREES 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 GLU A 110 54.92 -97.01 REMARK 500 LEU A 116 -134.21 -107.20 REMARK 500 TYR A 132 -15.64 63.79 REMARK 500 LEU B 116 -126.68 -103.86 REMARK 500 TYR B 132 -15.69 64.26 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue EDO B 301 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue EDO B 302 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue EDO B 303 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue EDO B 304 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residues EDO B 305 and EDO B REMARK 800 306 DBREF 6G8W A 108 204 UNP Q9BQQ3 GORS1_HUMAN 108 204 DBREF 6G8W B 108 204 UNP Q9BQQ3 GORS1_HUMAN 108 204 SEQRES 1 A 97 ALA SER GLU GLN VAL TRP HIS VAL LEU ASP VAL GLU PRO SEQRES 2 A 97 SER SER PRO ALA ALA LEU ALA GLY LEU ARG PRO TYR THR SEQRES 3 A 97 ASP TYR VAL VAL GLY SER ASP GLN ILE LEU GLN GLU SER SEQRES 4 A 97 GLU ASP PHE PHE THR LEU ILE GLU SER HIS GLU GLY LYS SEQRES 5 A 97 PRO LEU LYS LEU MET VAL TYR ASN SER LYS SER ASP SER SEQRES 6 A 97 CYS ARG GLU VAL THR VAL THR PRO ASN ALA ALA TRP GLY SEQRES 7 A 97 GLY GLU GLY SER LEU GLY CYS GLY ILE GLY TYR GLY TYR SEQRES 8 A 97 LEU HIS ARG ILE PRO THR SEQRES 1 B 97 ALA SER GLU GLN VAL TRP HIS VAL LEU ASP VAL GLU PRO SEQRES 2 B 97 SER SER PRO ALA ALA LEU ALA GLY LEU ARG PRO TYR THR SEQRES 3 B 97 ASP TYR VAL VAL GLY SER ASP GLN ILE LEU GLN GLU SER SEQRES 4 B 97 GLU ASP PHE PHE THR LEU ILE GLU SER HIS GLU GLY LYS SEQRES 5 B 97 PRO LEU LYS LEU MET VAL TYR ASN SER LYS SER ASP SER SEQRES 6 B 97 CYS ARG GLU VAL THR VAL THR PRO ASN ALA ALA TRP GLY SEQRES 7 B 97 GLY GLU GLY SER LEU GLY CYS GLY ILE GLY TYR GLY TYR SEQRES 8 B 97 LEU HIS ARG ILE PRO THR HET EDO B 301 4 HET EDO B 302 4 HET EDO B 303 4 HET EDO B 304 4 HET EDO B 305 4 HET EDO B 306 4 HETNAM EDO 1,2-ETHANEDIOL HETSYN EDO ETHYLENE GLYCOL FORMUL 3 EDO 6(C2 H6 O2) FORMUL 9 HOH *94(H2 O) HELIX 1 AA1 SER A 122 ALA A 127 1 6 HELIX 2 AA2 ASP A 148 HIS A 156 1 9 HELIX 3 AA3 SER B 122 GLY B 128 1 7 HELIX 4 AA4 PHE B 149 HIS B 156 1 8 SHEET 1 AA1 5 SER A 172 VAL A 178 0 SHEET 2 AA1 5 LEU A 161 ASN A 167 -1 N VAL A 165 O ARG A 174 SHEET 3 AA1 5 ASP A 134 SER A 139 -1 N GLY A 138 O MET A 164 SHEET 4 AA1 5 TRP A 113 VAL A 118 -1 N TRP A 113 O VAL A 136 SHEET 5 AA1 5 CYS A 192 TYR A 196 -1 O GLY A 195 N HIS A 114 SHEET 1 AA2 5 SER B 172 VAL B 178 0 SHEET 2 AA2 5 LEU B 161 ASN B 167 -1 N LEU B 163 O VAL B 176 SHEET 3 AA2 5 ASP B 134 GLY B 138 -1 N VAL B 137 O MET B 164 SHEET 4 AA2 5 TRP B 113 VAL B 118 -1 N TRP B 113 O VAL B 136 SHEET 5 AA2 5 CYS B 192 TYR B 196 -1 O GLY B 195 N HIS B 114 LINK C2 EDO B 305 C1 EDO B 306 1555 1555 1.55 SITE *** AC1 5 VAL A 112 HOH B 402 HOH B 414 HOH B 440 SITE *** AC1 5 HOH B 442 SITE *** AC2 6 SER A 121 LYS B 162 LYS B 169 SER B 170 SITE *** AC2 6 HOH B 409 HOH B 411 SITE *** AC3 2 EDO B 304 EDO B 305 SITE *** AC4 4 TYR A 198 EDO B 303 EDO B 305 EDO B 306 SITE *** AC5 6 TYR A 198 EDO B 303 EDO B 304 HOH B 406 SITE *** AC5 6 HOH B 410 HOH B 420 CRYST1 50.825 82.613 49.220 90.00 110.82 90.00 C 1 2 1 8 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 0.019675 0.000000 0.007480 0.00000 SCALE2 0.000000 0.012105 0.000000 0.00000 SCALE3 0.000000 0.000000 0.021736 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: B 305 EDO H22 : B 305 EDO C2 : B 306 EDO C1 :(H bumps) USER MOD NoAdj-H: B 305 EDO H21 : B 305 EDO C2 : B 306 EDO C1 :(H bumps) USER MOD NoAdj-H: B 306 EDO H12 : B 306 EDO C1 : B 305 EDO C2 :(H bumps) USER MOD NoAdj-H: B 306 EDO H11 : B 306 EDO C1 : B 305 EDO C2 :(H bumps) USER MOD Set 1.1: B 303 EDO O1 : rot 180:sc= -0.167 USER MOD Set 1.2: B 303 EDO O2 : rot -14:sc= -0.0845 USER MOD Set 1.3: B 304 EDO O1 : rot 180:sc= 0 USER MOD Set 1.4: B 304 EDO O2 : rot -179:sc= 0.0715 USER MOD Set 1.5: B 305 EDO O1 : rot 143:sc= -0.224 USER MOD Set 1.6: B 305 EDO O2 : rot -33:sc= 0.958 USER MOD Set 2.1: B 198 TYR OH : rot -172:sc= 1.42 USER MOD Set 2.2: B 200 HIS : no HD1:sc= 1.07 K(o=2.5,f=-5.3!) USER MOD Set 3.1: B 170 SER OG : rot -165:sc= 0.993 USER MOD Set 3.2: B 172 SER OG : rot 47:sc= 0.255 USER MOD Set 4.1: B 155 SER OG : rot -15:sc= 0.223 USER MOD Set 4.2: B 156 HIS : no HE2:sc= 1.16 K(o=1.4,f=-3.4!) USER MOD Set 5.1: B 133 THR OG1 : rot -74:sc= 1.47 USER MOD Set 5.2: B 167 ASN : amide:sc= 1.64 K(o=3.1,f=1.9) USER MOD Set 6.1: A 198 TYR OH : rot -149:sc= 1.11 USER MOD Set 6.2: A 200 HIS : no HD1:sc= 0.958 K(o=2.1,f=-10!) USER MOD Set 7.1: A 170 SER OG : rot 108:sc= 0.965 USER MOD Set 7.2: A 172 SER OG : rot 176:sc= 0.499 USER MOD Set 8.1: A 133 THR OG1 : rot -121:sc= 0.195 USER MOD Set 8.2: A 167 ASN : amide:sc= 1.07 K(o=1.3,f=-2.9!) USER MOD Set 9.1: A 162 LYS NZ :NH3+ -149:sc= 0.00585 (180deg=0) USER MOD Set 9.2: A 177 THR OG1 : rot 170:sc= 0.00504 USER MOD Set10.1: A 155 SER OG : rot 180:sc= 0.0527 USER MOD Set10.2: A 156 HIS : no HE2:sc= -0.256 K(o=-0.2,f=-4.3!) USER MOD Set11.1: A 114 HIS : no HD1:sc= 0.502 K(o=1.7,f=-4.5!) USER MOD Set11.2: A 135 TYR OH : rot -103:sc= 1.16 USER MOD Set12.1: A 111 GLN : amide:sc= -0.0109 X(o=-0.011,f=0) USER MOD Set12.2: A 196 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 42:sc= 0.0458 USER MOD Single : A 121 SER OG : rot -53:sc= 0.972 USER MOD Single : A 122 SER OG : rot -107:sc= 1.03 USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot -53:sc= 0.225 USER MOD Single : A 141 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 151 THR OG1 : rot -69:sc= 1.32 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 MET CE :methyl -179:sc= 0 (180deg=-0.00155) USER MOD Single : A 166 TYR OH : rot 1:sc= 2.17 USER MOD Single : A 168 SER OG : rot 167:sc= 1.39 USER MOD Single : A 169 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 CYS SG A: rot 180:sc= 0 USER MOD Single : A 173 CYS SG B: rot 180:sc= 0 USER MOD Single : A 179 THR OG1 : rot 81:sc= 1.31 USER MOD Single : A 181 ASN : amide:sc= 1.33 K(o=1.3,f=-3.2!) USER MOD Single : A 189 SER OG : rot -130:sc= 0.354 USER MOD Single : A 192 CYS SG : rot 180:sc= 0 USER MOD Single : A 204 THR OG1 : rot 180:sc= 0 USER MOD Single : B 111 GLN : amide:sc= -0.17 K(o=-0.17,f=-0.99) USER MOD Single : B 114 HIS : no HD1:sc= 0.293 K(o=0.29,f=-4.4!) USER MOD Single : B 121 SER OG A: rot -50:sc= 1.19 USER MOD Single : B 121 SER OG B: rot -167:sc= 0.443 USER MOD Single : B 122 SER OG : rot -91:sc= 0.391 USER MOD Single : B 132 TYR OH : rot 180:sc= 0 USER MOD Single : B 135 TYR OH : rot -6:sc= 1.26 USER MOD Single : B 139 SER OG : rot 180:sc= 0 USER MOD Single : B 151 THR OG1 : rot 180:sc= 0 USER MOD Single : B 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 164 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 166 TYR OH : rot 167:sc= 0.451 USER MOD Single : B 168 SER OG : rot -166:sc= 0.992 USER MOD Single : B 169 LYS NZ :NH3+ -165:sc= -0.0343 (180deg=-0.146) USER MOD Single : B 173 CYS SG : rot 180:sc= 0 USER MOD Single : B 177 THR OG1 : rot 173:sc= 0.132 USER MOD Single : B 179 THR OG1 : rot 115:sc= 2.25 USER MOD Single : B 181 ASN : amide:sc= -0.0411 K(o=-0.041,f=-7!) USER MOD Single : B 189 SER OG : rot 173:sc= 0.362 USER MOD Single : B 192 CYS SG : rot 180:sc= 0 USER MOD Single : B 196 TYR OH : rot 180:sc= 0 USER MOD Single : B 204 THR OG1 : rot 180:sc= -0.0647 USER MOD Single : B 301 EDO O1 : rot -86:sc= 0.0427 USER MOD Single : B 301 EDO O2 : rot -39:sc= 0.253 USER MOD Single : B 302 EDO O1 : rot -31:sc= -1.19 USER MOD Single : B 302 EDO O2 : rot 180:sc= 0.0658 USER MOD Single : B 306 EDO O1 : rot 180:sc= 0 USER MOD Single : B 306 EDO O2 : rot -38:sc= 1.31 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 109 -23.501 18.459 18.375 1.00 87.08 N ATOM 2 CA SER A 109 -23.713 17.358 19.376 1.00 90.34 C ATOM 3 C SER A 109 -25.022 16.528 19.231 1.00 93.09 C ATOM 4 O SER A 109 -25.131 15.438 19.820 1.00 90.15 O ATOM 5 CB SER A 109 -23.583 17.925 20.795 1.00 87.52 C ATOM 6 OG SER A 109 -22.264 18.409 20.989 1.00 81.60 O ATOM 0 HA SER A 109 -23.015 16.712 19.187 1.00 90.34 H new ATOM 0 HB2 SER A 109 -24.224 18.641 20.928 1.00 87.52 H new ATOM 0 HB3 SER A 109 -23.786 17.238 21.449 1.00 87.52 H new ATOM 0 HG SER A 109 -22.011 18.817 20.300 1.00 81.60 H new ATOM 7 N GLU A 110 -25.992 17.034 18.458 1.00 90.52 N ATOM 8 CA GLU A 110 -27.171 16.251 18.010 1.00 86.16 C ATOM 9 C GLU A 110 -26.935 15.688 16.566 1.00 74.98 C ATOM 10 O GLU A 110 -27.729 15.884 15.628 1.00 61.43 O ATOM 11 CB GLU A 110 -28.484 17.065 18.150 1.00 91.19 C ATOM 12 CG GLU A 110 -28.516 18.439 17.469 1.00 93.70 C ATOM 13 CD GLU A 110 -29.915 19.036 17.369 1.00 92.71 C ATOM 14 OE1 GLU A 110 -30.821 18.607 18.111 1.00 88.35 O ATOM 15 OE2 GLU A 110 -30.112 19.948 16.545 1.00 90.46 O ATOM 0 H GLU A 110 -25.990 17.846 18.174 1.00 90.52 H new ATOM 0 HA GLU A 110 -27.280 15.485 18.595 1.00 86.16 H new ATOM 0 HB2 GLU A 110 -29.211 16.532 17.792 1.00 91.19 H new ATOM 0 HB3 GLU A 110 -28.664 17.191 19.095 1.00 91.19 H new ATOM 0 HG2 GLU A 110 -27.946 19.050 17.962 1.00 93.70 H new ATOM 0 HG3 GLU A 110 -28.142 18.359 16.578 1.00 93.70 H new ATOM 16 N GLN A 111 -25.822 14.967 16.433 1.00 65.72 N ATOM 17 CA GLN A 111 -25.385 14.383 15.177 1.00 56.86 C ATOM 18 C GLN A 111 -26.199 13.102 14.872 1.00 47.20 C ATOM 19 O GLN A 111 -26.558 12.381 15.761 1.00 44.63 O ATOM 20 CB GLN A 111 -23.909 14.031 15.291 1.00 62.18 C ATOM 21 CG GLN A 111 -22.979 15.190 15.665 1.00 65.35 C ATOM 22 CD GLN A 111 -21.515 14.749 15.692 1.00 65.35 C ATOM 23 OE1 GLN A 111 -21.131 13.796 16.387 1.00 73.12 O ATOM 24 NE2 GLN A 111 -20.695 15.436 14.926 1.00 69.98 N ATOM 0 H GLN A 111 -25.291 14.803 17.089 1.00 65.72 H new ATOM 0 HA GLN A 111 -25.524 15.019 14.458 1.00 56.86 H new ATOM 0 HB2 GLN A 111 -23.810 13.331 15.955 1.00 62.18 H new ATOM 0 HB3 GLN A 111 -23.615 13.662 14.444 1.00 62.18 H new ATOM 0 HG2 GLN A 111 -23.089 15.913 15.027 1.00 65.35 H new ATOM 0 HG3 GLN A 111 -23.229 15.539 16.535 1.00 65.35 H new ATOM 0 HE21 GLN A 111 -20.993 16.092 14.456 1.00 69.98 H new ATOM 0 HE22 GLN A 111 -19.861 15.229 14.895 1.00 69.98 H new ATOM 25 N VAL A 112 -26.497 12.842 13.609 1.00 38.23 N ATOM 26 CA VAL A 112 -27.238 11.661 13.185 1.00 33.12 C ATOM 27 C VAL A 112 -26.382 10.926 12.120 1.00 28.91 C ATOM 28 O VAL A 112 -25.764 11.547 11.246 1.00 29.92 O ATOM 29 CB VAL A 112 -28.643 12.103 12.674 1.00 36.69 C ATOM 30 CG1 VAL A 112 -29.475 10.923 12.241 1.00 36.94 C ATOM 31 CG2 VAL A 112 -29.396 12.844 13.759 1.00 37.29 C ATOM 0 H VAL A 112 -26.270 13.357 12.959 1.00 38.23 H new ATOM 0 HA VAL A 112 -27.398 11.038 13.911 1.00 33.12 H new ATOM 0 HB VAL A 112 -28.494 12.684 11.912 1.00 36.69 H new ATOM 0 HG11 VAL A 112 -30.340 11.233 11.930 1.00 36.94 H new ATOM 0 HG12 VAL A 112 -29.023 10.454 11.522 1.00 36.94 H new ATOM 0 HG13 VAL A 112 -29.599 10.321 12.992 1.00 36.94 H new ATOM 0 HG21 VAL A 112 -30.266 13.111 13.424 1.00 37.29 H new ATOM 0 HG22 VAL A 112 -29.510 12.264 14.528 1.00 37.29 H new ATOM 0 HG23 VAL A 112 -28.895 13.632 14.020 1.00 37.29 H new ATOM 32 N TRP A 113 -26.273 9.614 12.197 1.00 25.37 N ATOM 33 CA TRP A 113 -25.392 8.881 11.267 1.00 22.03 C ATOM 34 C TRP A 113 -26.305 7.940 10.514 1.00 20.34 C ATOM 35 O TRP A 113 -26.860 7.036 11.117 1.00 21.45 O ATOM 36 CB TRP A 113 -24.302 8.124 12.028 1.00 24.11 C ATOM 37 CG TRP A 113 -23.371 9.020 12.705 1.00 25.51 C ATOM 38 CD1 TRP A 113 -23.411 9.424 14.008 1.00 28.61 C ATOM 39 CD2 TRP A 113 -22.317 9.743 12.090 1.00 26.52 C ATOM 40 NE1 TRP A 113 -22.439 10.370 14.243 1.00 31.16 N ATOM 41 CE2 TRP A 113 -21.727 10.561 13.091 1.00 29.51 C ATOM 42 CE3 TRP A 113 -21.839 9.814 10.776 1.00 28.70 C ATOM 43 CZ2 TRP A 113 -20.625 11.447 12.828 1.00 35.63 C ATOM 44 CZ3 TRP A 113 -20.722 10.683 10.484 1.00 35.87 C ATOM 45 CH2 TRP A 113 -20.130 11.489 11.524 1.00 36.64 C ATOM 0 H TRP A 113 -26.689 9.122 12.767 1.00 25.37 H new ATOM 0 HA TRP A 113 -24.923 9.477 10.662 1.00 22.03 H new ATOM 0 HB2 TRP A 113 -24.715 7.537 12.681 1.00 24.11 H new ATOM 0 HB3 TRP A 113 -23.812 7.560 11.410 1.00 24.11 H new ATOM 0 HD1 TRP A 113 -24.009 9.106 14.645 1.00 28.61 H new ATOM 0 HE1 TRP A 113 -22.302 10.774 14.990 1.00 31.16 H new ATOM 0 HE3 TRP A 113 -22.234 9.310 10.102 1.00 28.70 H new ATOM 0 HZ2 TRP A 113 -20.256 11.972 13.501 1.00 35.63 H new ATOM 0 HZ3 TRP A 113 -20.382 10.723 9.619 1.00 35.87 H new ATOM 0 HH2 TRP A 113 -19.410 12.043 11.323 1.00 36.64 H new ATOM 46 N HIS A 114 -26.500 8.164 9.212 1.00 16.75 N ATOM 47 CA HIS A 114 -27.368 7.363 8.335 1.00 14.95 C ATOM 48 C HIS A 114 -26.622 6.056 7.913 1.00 16.47 C ATOM 49 O HIS A 114 -25.540 6.098 7.316 1.00 15.58 O ATOM 50 CB HIS A 114 -27.659 8.223 7.093 1.00 15.57 C ATOM 51 CG HIS A 114 -28.679 7.691 6.155 1.00 15.40 C ATOM 52 ND1 HIS A 114 -28.796 8.174 4.878 1.00 15.87 N ATOM 53 CD2 HIS A 114 -29.686 6.810 6.321 1.00 15.91 C ATOM 54 CE1 HIS A 114 -29.851 7.616 4.289 1.00 18.13 C ATOM 55 NE2 HIS A 114 -30.407 6.774 5.143 1.00 17.26 N ATOM 0 H HIS A 114 -26.116 8.812 8.797 1.00 16.75 H new ATOM 0 HA HIS A 114 -28.190 7.113 8.785 1.00 14.95 H new ATOM 0 HB2 HIS A 114 -27.945 9.101 7.390 1.00 15.57 H new ATOM 0 HB3 HIS A 114 -26.830 8.345 6.605 1.00 15.57 H new ATOM 0 HD2 HIS A 114 -29.863 6.316 7.089 1.00 15.91 H new ATOM 0 HE1 HIS A 114 -30.147 7.789 3.424 1.00 18.13 H new ATOM 0 HE2 HIS A 114 -31.099 6.287 4.991 1.00 17.26 H new ATOM 56 N VAL A 115 -27.213 4.915 8.198 1.00 17.66 N ATOM 57 CA VAL A 115 -26.671 3.627 7.829 1.00 18.86 C ATOM 58 C VAL A 115 -26.935 3.437 6.366 1.00 20.09 C ATOM 59 O VAL A 115 -28.136 3.557 5.911 1.00 19.31 O ATOM 60 CB VAL A 115 -27.384 2.504 8.634 1.00 21.21 C ATOM 61 CG1 VAL A 115 -27.023 1.112 8.180 1.00 23.63 C ATOM 62 CG2 VAL A 115 -27.010 2.632 10.093 1.00 23.07 C ATOM 0 H VAL A 115 -27.960 4.866 8.622 1.00 17.66 H new ATOM 0 HA VAL A 115 -25.721 3.587 8.020 1.00 18.86 H new ATOM 0 HB VAL A 115 -28.336 2.621 8.487 1.00 21.21 H new ATOM 0 HG11 VAL A 115 -27.499 0.462 8.720 1.00 23.63 H new ATOM 0 HG12 VAL A 115 -27.270 1.001 7.248 1.00 23.63 H new ATOM 0 HG13 VAL A 115 -26.068 0.977 8.279 1.00 23.63 H new ATOM 0 HG21 VAL A 115 -27.451 1.934 10.603 1.00 23.07 H new ATOM 0 HG22 VAL A 115 -26.049 2.544 10.190 1.00 23.07 H new ATOM 0 HG23 VAL A 115 -27.290 3.500 10.424 1.00 23.07 H new ATOM 63 N LEU A 116 -25.872 3.108 5.641 1.00 17.59 N ATOM 64 CA LEU A 116 -25.974 2.906 4.229 1.00 19.99 C ATOM 65 C LEU A 116 -25.861 1.415 3.941 1.00 23.18 C ATOM 66 O LEU A 116 -26.488 0.612 4.615 1.00 24.91 O ATOM 67 CB LEU A 116 -24.865 3.721 3.563 1.00 20.04 C ATOM 68 CG LEU A 116 -24.709 5.146 4.052 1.00 19.56 C ATOM 69 CD1 LEU A 116 -23.443 5.761 3.457 1.00 19.92 C ATOM 70 CD2 LEU A 116 -25.901 6.017 3.666 1.00 19.20 C ATOM 0 H LEU A 116 -25.082 2.999 5.963 1.00 17.59 H new ATOM 0 HA LEU A 116 -26.826 3.204 3.874 1.00 19.99 H new ATOM 0 HB2 LEU A 116 -24.023 3.258 3.695 1.00 20.04 H new ATOM 0 HB3 LEU A 116 -25.031 3.741 2.608 1.00 20.04 H new ATOM 0 HG LEU A 116 -24.653 5.113 5.020 1.00 19.56 H new ATOM 0 HD11 LEU A 116 -23.347 6.673 3.773 1.00 19.92 H new ATOM 0 HD12 LEU A 116 -22.671 5.242 3.731 1.00 19.92 H new ATOM 0 HD13 LEU A 116 -23.506 5.759 2.489 1.00 19.92 H new ATOM 0 HD21 LEU A 116 -25.764 6.919 3.996 1.00 19.20 H new ATOM 0 HD22 LEU A 116 -25.988 6.037 2.700 1.00 19.20 H new ATOM 0 HD23 LEU A 116 -26.710 5.650 4.056 1.00 19.20 H new ATOM 71 N ASP A 117 -25.072 1.002 2.960 1.00 27.34 N ATOM 72 CA ASP A 117 -24.924 -0.442 2.664 1.00 30.74 C ATOM 73 C ASP A 117 -24.414 -1.166 3.853 1.00 30.11 C ATOM 74 O ASP A 117 -23.513 -0.650 4.477 1.00 28.82 O ATOM 75 CB ASP A 117 -23.945 -0.746 1.553 1.00 30.80 C ATOM 76 CG ASP A 117 -22.680 0.122 1.577 1.00 35.41 C ATOM 77 OD1 ASP A 117 -22.728 1.310 1.979 1.00 30.31 O ATOM 78 OD2 ASP A 117 -21.627 -0.370 1.062 1.00 40.40 O ATOM 0 H ASP A 117 -24.614 1.524 2.453 1.00 27.34 H new ATOM 0 HA ASP A 117 -25.812 -0.726 2.398 1.00 30.74 H new ATOM 0 HB2 ASP A 117 -23.686 -1.679 1.609 1.00 30.80 H new ATOM 0 HB3 ASP A 117 -24.391 -0.627 0.700 1.00 30.80 H new ATOM 79 N VAL A 118 -24.982 -2.360 4.113 1.00 28.66 N ATOM 80 CA VAL A 118 -24.585 -3.289 5.202 1.00 26.77 C ATOM 81 C VAL A 118 -24.129 -4.579 4.557 1.00 30.18 C ATOM 82 O VAL A 118 -24.897 -5.176 3.806 1.00 30.16 O ATOM 83 CB VAL A 118 -25.794 -3.529 6.085 1.00 30.40 C ATOM 84 CG1 VAL A 118 -25.569 -4.638 7.135 1.00 33.54 C ATOM 85 CG2 VAL A 118 -26.163 -2.219 6.755 1.00 31.49 C ATOM 0 H VAL A 118 -25.634 -2.664 3.643 1.00 28.66 H new ATOM 0 HA VAL A 118 -23.867 -2.926 5.745 1.00 26.77 H new ATOM 0 HB VAL A 118 -26.521 -3.844 5.525 1.00 30.40 H new ATOM 0 HG11 VAL A 118 -26.372 -4.747 7.668 1.00 33.54 H new ATOM 0 HG12 VAL A 118 -25.364 -5.473 6.685 1.00 33.54 H new ATOM 0 HG13 VAL A 118 -24.829 -4.392 7.712 1.00 33.54 H new ATOM 0 HG21 VAL A 118 -26.936 -2.353 7.325 1.00 31.49 H new ATOM 0 HG22 VAL A 118 -25.417 -1.908 7.291 1.00 31.49 H new ATOM 0 HG23 VAL A 118 -26.372 -1.557 6.078 1.00 31.49 H new ATOM 86 N GLU A 119 -22.858 -4.966 4.734 1.00 33.18 N ATOM 87 CA GLU A 119 -22.316 -6.208 4.139 1.00 29.87 C ATOM 88 C GLU A 119 -22.995 -7.415 4.796 1.00 29.16 C ATOM 89 O GLU A 119 -23.280 -7.425 5.995 1.00 22.28 O ATOM 90 CB GLU A 119 -20.826 -6.346 4.341 1.00 33.13 C ATOM 91 CG GLU A 119 -19.900 -5.406 3.565 1.00 37.82 C ATOM 92 CD GLU A 119 -20.028 -5.570 2.065 1.00 48.08 C ATOM 93 OE1 GLU A 119 -20.587 -6.594 1.612 1.00 59.95 O ATOM 94 OE2 GLU A 119 -19.598 -4.668 1.323 1.00 56.31 O ATOM 0 H GLU A 119 -22.286 -4.522 5.198 1.00 33.18 H new ATOM 0 HA GLU A 119 -22.492 -6.169 3.186 1.00 29.87 H new ATOM 0 HB2 GLU A 119 -20.643 -6.228 5.286 1.00 33.13 H new ATOM 0 HB3 GLU A 119 -20.580 -7.257 4.116 1.00 33.13 H new ATOM 0 HG2 GLU A 119 -20.102 -4.488 3.805 1.00 37.82 H new ATOM 0 HG3 GLU A 119 -18.981 -5.573 3.828 1.00 37.82 H new ATOM 95 N PRO A 120 -23.294 -8.438 4.013 1.00 31.12 N ATOM 96 CA PRO A 120 -23.776 -9.694 4.708 1.00 31.18 C ATOM 97 C PRO A 120 -22.752 -10.299 5.715 1.00 27.71 C ATOM 98 O PRO A 120 -21.549 -10.284 5.450 1.00 24.80 O ATOM 99 CB PRO A 120 -24.026 -10.670 3.553 1.00 31.35 C ATOM 100 CG PRO A 120 -23.289 -10.088 2.360 1.00 31.86 C ATOM 101 CD PRO A 120 -23.040 -8.617 2.578 1.00 30.21 C ATOM 0 HA PRO A 120 -24.557 -9.506 5.252 1.00 31.18 H new ATOM 0 HB2 PRO A 120 -23.696 -11.557 3.768 1.00 31.35 H new ATOM 0 HB3 PRO A 120 -24.974 -10.757 3.369 1.00 31.35 H new ATOM 0 HG2 PRO A 120 -22.446 -10.551 2.233 1.00 31.86 H new ATOM 0 HG3 PRO A 120 -23.810 -10.220 1.552 1.00 31.86 H new ATOM 0 HD2 PRO A 120 -22.132 -8.369 2.342 1.00 30.21 H new ATOM 0 HD3 PRO A 120 -23.633 -8.070 2.039 1.00 30.21 H new ATOM 102 N SER A 121 -23.265 -10.791 6.862 1.00 25.67 N ATOM 103 CA SER A 121 -22.473 -11.407 7.912 1.00 27.49 C ATOM 104 C SER A 121 -21.512 -10.433 8.634 1.00 27.03 C ATOM 105 O SER A 121 -20.668 -10.848 9.414 1.00 26.09 O ATOM 106 CB SER A 121 -21.701 -12.622 7.336 1.00 28.14 C ATOM 107 OG SER A 121 -22.600 -13.639 6.908 1.00 28.37 O ATOM 0 H SER A 121 -24.106 -10.768 7.041 1.00 25.67 H new ATOM 0 HA SER A 121 -23.097 -11.701 8.594 1.00 27.49 H new ATOM 0 HB2 SER A 121 -21.151 -12.336 6.590 1.00 28.14 H new ATOM 0 HB3 SER A 121 -21.101 -12.978 8.010 1.00 28.14 H new ATOM 0 HG SER A 121 -23.121 -13.835 7.537 1.00 28.37 H new ATOM 108 N SER A 122 -21.703 -9.134 8.426 1.00 29.11 N ATOM 109 CA SER A 122 -20.885 -8.057 9.051 1.00 24.98 C ATOM 110 C SER A 122 -21.404 -7.964 10.470 1.00 23.20 C ATOM 111 O SER A 122 -22.546 -8.359 10.687 1.00 22.74 O ATOM 112 CB SER A 122 -21.187 -6.733 8.311 1.00 25.52 C ATOM 113 OG SER A 122 -22.555 -6.280 8.556 1.00 23.05 O ATOM 0 H SER A 122 -22.321 -8.833 7.909 1.00 29.11 H new ATOM 0 HA SER A 122 -19.931 -8.228 9.016 1.00 24.98 H new ATOM 0 HB2 SER A 122 -20.562 -6.050 8.601 1.00 25.52 H new ATOM 0 HB3 SER A 122 -21.052 -6.856 7.358 1.00 25.52 H new ATOM 0 HG SER A 122 -23.017 -6.397 7.865 1.00 23.05 H new ATOM 114 N PRO A 123 -20.617 -7.402 11.420 1.00 22.71 N ATOM 115 CA PRO A 123 -21.141 -6.992 12.759 1.00 22.49 C ATOM 116 C PRO A 123 -22.419 -6.203 12.674 1.00 21.55 C ATOM 117 O PRO A 123 -23.450 -6.493 13.374 1.00 25.32 O ATOM 118 CB PRO A 123 -19.995 -6.155 13.339 1.00 22.23 C ATOM 119 CG PRO A 123 -18.766 -6.840 12.742 1.00 23.17 C ATOM 120 CD PRO A 123 -19.160 -7.139 11.321 1.00 22.59 C ATOM 0 HA PRO A 123 -21.379 -7.755 13.309 1.00 22.49 H new ATOM 0 HB2 PRO A 123 -20.056 -5.224 13.074 1.00 22.23 H new ATOM 0 HB3 PRO A 123 -19.986 -6.174 14.309 1.00 22.23 H new ATOM 0 HG2 PRO A 123 -17.987 -6.264 12.779 1.00 23.17 H new ATOM 0 HG3 PRO A 123 -18.543 -7.651 13.225 1.00 23.17 H new ATOM 0 HD2 PRO A 123 -18.970 -6.392 10.732 1.00 22.59 H new ATOM 0 HD3 PRO A 123 -18.681 -7.906 10.970 1.00 22.59 H new ATOM 121 N ALA A 124 -22.402 -5.232 11.796 1.00 20.75 N ATOM 122 CA ALA A 124 -23.636 -4.449 11.543 1.00 21.18 C ATOM 123 C ALA A 124 -24.874 -5.308 11.179 1.00 18.41 C ATOM 124 O ALA A 124 -25.949 -5.115 11.685 1.00 17.55 O ATOM 125 CB ALA A 124 -23.328 -3.432 10.431 1.00 22.28 C ATOM 0 H ALA A 124 -21.716 -4.997 11.334 1.00 20.75 H new ATOM 0 HA ALA A 124 -23.882 -4.007 12.371 1.00 21.18 H new ATOM 0 HB1 ALA A 124 -24.121 -2.905 10.245 1.00 22.28 H new ATOM 0 HB2 ALA A 124 -22.611 -2.846 10.718 1.00 22.28 H new ATOM 0 HB3 ALA A 124 -23.058 -3.903 9.627 1.00 22.28 H new ATOM 126 N ALA A 125 -24.694 -6.275 10.309 1.00 20.94 N ATOM 127 CA ALA A 125 -25.764 -7.192 9.857 1.00 22.45 C ATOM 128 C ALA A 125 -26.315 -8.075 10.942 1.00 25.74 C ATOM 129 O ALA A 125 -27.557 -8.218 11.098 1.00 25.92 O ATOM 130 CB ALA A 125 -25.232 -8.042 8.684 1.00 24.81 C ATOM 0 H ALA A 125 -23.932 -6.436 9.944 1.00 20.94 H new ATOM 0 HA ALA A 125 -26.510 -6.641 9.573 1.00 22.45 H new ATOM 0 HB1 ALA A 125 -25.927 -8.647 8.381 1.00 24.81 H new ATOM 0 HB2 ALA A 125 -24.970 -7.459 7.954 1.00 24.81 H new ATOM 0 HB3 ALA A 125 -24.464 -8.555 8.979 1.00 24.81 H new ATOM 131 N LEU A 126 -25.413 -8.626 11.758 1.00 29.80 N ATOM 132 CA LEU A 126 -25.811 -9.435 12.943 1.00 31.28 C ATOM 133 C LEU A 126 -26.578 -8.624 13.948 1.00 28.74 C ATOM 134 O LEU A 126 -27.528 -9.095 14.535 1.00 31.32 O ATOM 135 CB LEU A 126 -24.572 -10.039 13.644 1.00 38.40 C ATOM 136 CG LEU A 126 -23.427 -10.614 12.759 1.00 41.32 C ATOM 137 CD1 LEU A 126 -22.441 -11.502 13.547 1.00 41.28 C ATOM 138 CD2 LEU A 126 -23.926 -11.337 11.499 1.00 42.69 C ATOM 0 H LEU A 126 -24.563 -8.550 11.652 1.00 29.80 H new ATOM 0 HA LEU A 126 -26.382 -10.144 12.609 1.00 31.28 H new ATOM 0 HB2 LEU A 126 -24.190 -9.352 14.212 1.00 38.40 H new ATOM 0 HB3 LEU A 126 -24.880 -10.750 14.227 1.00 38.40 H new ATOM 0 HG LEU A 126 -22.939 -9.831 12.460 1.00 41.32 H new ATOM 0 HD11 LEU A 126 -21.752 -11.831 12.948 1.00 41.28 H new ATOM 0 HD12 LEU A 126 -22.031 -10.981 14.255 1.00 41.28 H new ATOM 0 HD13 LEU A 126 -22.919 -12.253 13.933 1.00 41.28 H new ATOM 0 HD21 LEU A 126 -23.167 -11.669 10.995 1.00 42.69 H new ATOM 0 HD22 LEU A 126 -24.494 -12.080 11.756 1.00 42.69 H new ATOM 0 HD23 LEU A 126 -24.433 -10.718 10.950 1.00 42.69 H new ATOM 139 N ALA A 127 -26.203 -7.358 14.103 1.00 27.34 N ATOM 140 CA ALA A 127 -26.940 -6.430 14.965 1.00 23.85 C ATOM 141 C ALA A 127 -28.302 -6.082 14.435 1.00 21.59 C ATOM 142 O ALA A 127 -29.111 -5.527 15.187 1.00 23.27 O ATOM 143 CB ALA A 127 -26.129 -5.135 15.157 1.00 26.42 C ATOM 0 H ALA A 127 -25.518 -7.011 13.715 1.00 27.34 H new ATOM 0 HA ALA A 127 -27.068 -6.886 15.812 1.00 23.85 H new ATOM 0 HB1 ALA A 127 -26.622 -4.526 15.728 1.00 26.42 H new ATOM 0 HB2 ALA A 127 -25.276 -5.345 15.569 1.00 26.42 H new ATOM 0 HB3 ALA A 127 -25.977 -4.717 14.295 1.00 26.42 H new ATOM 144 N GLY A 128 -28.553 -6.345 13.147 1.00 19.44 N ATOM 145 CA GLY A 128 -29.820 -6.045 12.551 1.00 20.21 C ATOM 146 C GLY A 128 -29.988 -4.642 12.000 1.00 22.06 C ATOM 147 O GLY A 128 -31.128 -4.212 11.724 1.00 20.77 O ATOM 0 H GLY A 128 -27.984 -6.702 12.610 1.00 19.44 H new ATOM 0 HA2 GLY A 128 -29.974 -6.676 11.830 1.00 20.21 H new ATOM 0 HA3 GLY A 128 -30.512 -6.197 13.214 1.00 20.21 H new ATOM 148 N LEU A 129 -28.875 -3.930 11.775 1.00 22.04 N ATOM 149 CA LEU A 129 -28.917 -2.630 11.135 1.00 20.48 C ATOM 150 C LEU A 129 -29.293 -2.641 9.660 1.00 24.77 C ATOM 151 O LEU A 129 -28.646 -3.337 8.832 1.00 26.39 O ATOM 152 CB LEU A 129 -27.561 -1.939 11.261 1.00 19.83 C ATOM 153 CG LEU A 129 -27.118 -1.525 12.678 1.00 19.50 C ATOM 154 CD1 LEU A 129 -25.714 -0.965 12.651 1.00 20.17 C ATOM 155 CD2 LEU A 129 -28.006 -0.436 13.192 1.00 20.55 C ATOM 0 H LEU A 129 -28.085 -4.194 11.991 1.00 22.04 H new ATOM 0 HA LEU A 129 -29.622 -2.155 11.603 1.00 20.48 H new ATOM 0 HB2 LEU A 129 -26.885 -2.531 10.894 1.00 19.83 H new ATOM 0 HB3 LEU A 129 -27.574 -1.144 10.705 1.00 19.83 H new ATOM 0 HG LEU A 129 -27.163 -2.313 13.242 1.00 19.50 H new ATOM 0 HD11 LEU A 129 -25.450 -0.709 13.549 1.00 20.17 H new ATOM 0 HD12 LEU A 129 -25.103 -1.639 12.314 1.00 20.17 H new ATOM 0 HD13 LEU A 129 -25.687 -0.187 12.073 1.00 20.17 H new ATOM 0 HD21 LEU A 129 -27.722 -0.180 14.084 1.00 20.55 H new ATOM 0 HD22 LEU A 129 -27.950 0.332 12.603 1.00 20.55 H new ATOM 0 HD23 LEU A 129 -28.922 -0.753 13.224 1.00 20.55 H new ATOM 156 N ARG A 130 -30.239 -1.766 9.291 1.00 22.95 N ATOM 157 CA ARG A 130 -30.942 -1.855 7.977 1.00 23.05 C ATOM 158 C ARG A 130 -30.425 -0.818 7.005 1.00 22.36 C ATOM 159 O ARG A 130 -30.428 0.358 7.322 1.00 21.39 O ATOM 160 CB ARG A 130 -32.437 -1.668 8.164 1.00 21.02 C ATOM 161 CG ARG A 130 -32.977 -2.677 9.149 1.00 21.15 C ATOM 162 CD ARG A 130 -34.195 -2.212 9.919 1.00 21.15 C ATOM 163 NE ARG A 130 -34.922 -3.333 10.509 1.00 23.82 N ATOM 164 CZ ARG A 130 -35.899 -3.225 11.388 1.00 25.59 C ATOM 165 NH1 ARG A 130 -36.296 -2.014 11.797 1.00 28.75 N ATOM 166 NH2 ARG A 130 -36.517 -4.318 11.818 1.00 26.41 N ATOM 0 H ARG A 130 -30.496 -1.108 9.782 1.00 22.95 H new ATOM 0 HA ARG A 130 -30.767 -2.736 7.611 1.00 23.05 H new ATOM 0 HB2 ARG A 130 -32.619 -0.769 8.481 1.00 21.02 H new ATOM 0 HB3 ARG A 130 -32.890 -1.766 7.312 1.00 21.02 H new ATOM 0 HG2 ARG A 130 -33.202 -3.491 8.671 1.00 21.15 H new ATOM 0 HG3 ARG A 130 -32.276 -2.903 9.780 1.00 21.15 H new ATOM 0 HD2 ARG A 130 -33.921 -1.599 10.619 1.00 21.15 H new ATOM 0 HD3 ARG A 130 -34.784 -1.720 9.326 1.00 21.15 H new ATOM 0 HE ARG A 130 -34.695 -4.126 10.264 1.00 23.82 H new ATOM 0 HH11 ARG A 130 -35.914 -1.309 11.487 1.00 28.75 H new ATOM 0 HH12 ARG A 130 -36.933 -1.941 12.370 1.00 28.75 H new ATOM 0 HH21 ARG A 130 -36.280 -5.090 11.523 1.00 26.41 H new ATOM 0 HH22 ARG A 130 -37.155 -4.254 12.391 1.00 26.41 H new ATOM 167 N PRO A 131 -30.027 -1.252 5.811 1.00 24.55 N ATOM 168 CA PRO A 131 -29.457 -0.268 4.909 1.00 25.42 C ATOM 169 C PRO A 131 -30.458 0.822 4.592 1.00 24.50 C ATOM 170 O PRO A 131 -31.623 0.529 4.411 1.00 22.94 O ATOM 171 CB PRO A 131 -29.130 -1.082 3.648 1.00 25.66 C ATOM 172 CG PRO A 131 -28.936 -2.459 4.153 1.00 25.93 C ATOM 173 CD PRO A 131 -30.001 -2.605 5.221 1.00 26.05 C ATOM 0 HA PRO A 131 -28.683 0.180 5.285 1.00 25.42 H new ATOM 0 HB2 PRO A 131 -29.851 -1.039 3.000 1.00 25.66 H new ATOM 0 HB3 PRO A 131 -28.333 -0.749 3.207 1.00 25.66 H new ATOM 0 HG2 PRO A 131 -29.047 -3.116 3.448 1.00 25.93 H new ATOM 0 HG3 PRO A 131 -28.046 -2.582 4.518 1.00 25.93 H new ATOM 0 HD2 PRO A 131 -30.860 -2.855 4.846 1.00 26.05 H new ATOM 0 HD3 PRO A 131 -29.769 -3.283 5.875 1.00 26.05 H new ATOM 174 N TYR A 132 -30.014 2.063 4.687 1.00 27.96 N ATOM 175 CA TYR A 132 -30.793 3.279 4.311 1.00 27.13 C ATOM 176 C TYR A 132 -32.059 3.658 5.039 1.00 22.23 C ATOM 177 O TYR A 132 -32.454 4.822 4.979 1.00 17.70 O ATOM 178 CB TYR A 132 -31.016 3.277 2.830 1.00 32.19 C ATOM 179 CG TYR A 132 -29.694 3.482 2.131 1.00 37.27 C ATOM 180 CD1 TYR A 132 -29.180 4.790 1.987 1.00 41.57 C ATOM 181 CD2 TYR A 132 -28.921 2.391 1.643 1.00 39.06 C ATOM 182 CE1 TYR A 132 -27.971 5.011 1.354 1.00 43.21 C ATOM 183 CE2 TYR A 132 -27.698 2.609 0.984 1.00 37.03 C ATOM 184 CZ TYR A 132 -27.252 3.904 0.845 1.00 40.37 C ATOM 185 OH TYR A 132 -26.072 4.188 0.227 1.00 63.63 O ATOM 0 H TYR A 132 -29.227 2.248 4.980 1.00 27.96 H new ATOM 0 HA TYR A 132 -30.210 3.986 4.629 1.00 27.13 H new ATOM 0 HB2 TYR A 132 -31.414 2.437 2.553 1.00 32.19 H new ATOM 0 HB3 TYR A 132 -31.637 3.980 2.584 1.00 32.19 H new ATOM 0 HD1 TYR A 132 -29.661 5.512 2.322 1.00 41.57 H new ATOM 0 HD2 TYR A 132 -29.229 1.522 1.762 1.00 39.06 H new ATOM 0 HE1 TYR A 132 -27.636 5.874 1.264 1.00 43.21 H new ATOM 0 HE2 TYR A 132 -27.203 1.896 0.650 1.00 37.03 H new ATOM 0 HH TYR A 132 -25.717 3.475 -0.040 1.00 63.63 H new ATOM 186 N THR A 133 -32.642 2.741 5.802 1.00 20.49 N ATOM 187 CA THR A 133 -33.773 3.105 6.671 1.00 20.91 C ATOM 188 C THR A 133 -33.423 3.370 8.125 1.00 18.39 C ATOM 189 O THR A 133 -34.192 3.983 8.803 1.00 18.94 O ATOM 190 CB THR A 133 -34.894 2.061 6.544 1.00 22.99 C ATOM 191 OG1 THR A 133 -34.430 0.780 7.020 1.00 23.84 O ATOM 192 CG2 THR A 133 -35.313 1.953 5.071 1.00 24.32 C ATOM 0 H THR A 133 -32.408 1.914 5.837 1.00 20.49 H new ATOM 0 HA THR A 133 -34.081 3.965 6.346 1.00 20.91 H new ATOM 0 HB THR A 133 -35.655 2.334 7.079 1.00 22.99 H new ATOM 0 HG1 THR A 133 -34.490 0.213 6.403 1.00 23.84 H new ATOM 0 HG21 THR A 133 -36.021 1.295 4.983 1.00 24.32 H new ATOM 0 HG22 THR A 133 -35.633 2.815 4.761 1.00 24.32 H new ATOM 0 HG23 THR A 133 -34.551 1.680 4.537 1.00 24.32 H new ATOM 193 N ASP A 134 -32.256 2.954 8.587 1.00 19.71 N ATOM 194 CA ASP A 134 -31.830 3.115 9.988 1.00 20.53 C ATOM 195 C ASP A 134 -30.853 4.327 10.113 1.00 20.98 C ATOM 196 O ASP A 134 -30.035 4.583 9.206 1.00 18.90 O ATOM 197 CB ASP A 134 -31.081 1.869 10.475 1.00 23.04 C ATOM 198 CG ASP A 134 -31.973 0.753 11.028 1.00 24.71 C ATOM 199 OD1 ASP A 134 -33.196 0.922 11.280 1.00 21.40 O ATOM 200 OD2 ASP A 134 -31.353 -0.336 11.246 1.00 24.82 O ATOM 0 H ASP A 134 -31.671 2.561 8.094 1.00 19.71 H new ATOM 0 HA ASP A 134 -32.627 3.256 10.523 1.00 20.53 H new ATOM 0 HB2 ASP A 134 -30.560 1.513 9.739 1.00 23.04 H new ATOM 0 HB3 ASP A 134 -30.453 2.135 11.165 1.00 23.04 H new ATOM 201 N TYR A 135 -30.981 5.056 11.234 1.00 18.56 N ATOM 202 CA TYR A 135 -30.155 6.164 11.581 1.00 17.88 C ATOM 203 C TYR A 135 -29.702 5.961 13.019 1.00 19.78 C ATOM 204 O TYR A 135 -30.532 5.730 13.909 1.00 19.18 O ATOM 205 CB TYR A 135 -30.959 7.458 11.547 1.00 18.45 C ATOM 206 CG TYR A 135 -31.472 7.773 10.184 1.00 18.88 C ATOM 207 CD1 TYR A 135 -32.543 7.072 9.663 1.00 18.96 C ATOM 208 CD2 TYR A 135 -30.856 8.696 9.397 1.00 17.28 C ATOM 209 CE1 TYR A 135 -33.001 7.308 8.403 1.00 19.93 C ATOM 210 CE2 TYR A 135 -31.319 8.934 8.146 1.00 17.43 C ATOM 211 CZ TYR A 135 -32.368 8.240 7.659 1.00 18.14 C ATOM 212 OH TYR A 135 -32.841 8.448 6.420 1.00 19.50 O ATOM 0 H TYR A 135 -31.586 4.891 11.823 1.00 18.56 H new ATOM 0 HA TYR A 135 -29.413 6.221 10.958 1.00 17.88 H new ATOM 0 HB2 TYR A 135 -31.705 7.388 12.163 1.00 18.45 H new ATOM 0 HB3 TYR A 135 -30.403 8.190 11.857 1.00 18.45 H new ATOM 0 HD1 TYR A 135 -32.960 6.425 10.185 1.00 18.96 H new ATOM 0 HD2 TYR A 135 -30.118 9.163 9.717 1.00 17.28 H new ATOM 0 HE1 TYR A 135 -33.730 6.840 8.064 1.00 19.93 H new ATOM 0 HE2 TYR A 135 -30.910 9.582 7.619 1.00 17.43 H new ATOM 0 HH TYR A 135 -32.335 8.078 5.861 1.00 19.50 H new ATOM 213 N VAL A 136 -28.419 6.099 13.267 1.00 20.34 N ATOM 214 CA VAL A 136 -27.853 5.995 14.608 1.00 22.26 C ATOM 215 C VAL A 136 -27.939 7.366 15.215 1.00 24.82 C ATOM 216 O VAL A 136 -27.253 8.296 14.759 1.00 23.24 O ATOM 217 CB VAL A 136 -26.398 5.545 14.631 1.00 22.99 C ATOM 218 CG1 VAL A 136 -25.824 5.490 16.072 1.00 23.94 C ATOM 219 CG2 VAL A 136 -26.325 4.188 14.042 1.00 24.72 C ATOM 0 H VAL A 136 -27.835 6.259 12.656 1.00 20.34 H new ATOM 0 HA VAL A 136 -28.352 5.322 15.097 1.00 22.26 H new ATOM 0 HB VAL A 136 -25.874 6.187 14.127 1.00 22.99 H new ATOM 0 HG11 VAL A 136 -24.899 5.200 16.041 1.00 23.94 H new ATOM 0 HG12 VAL A 136 -25.873 6.371 16.474 1.00 23.94 H new ATOM 0 HG13 VAL A 136 -26.341 4.864 16.603 1.00 23.94 H new ATOM 0 HG21 VAL A 136 -25.405 3.882 14.047 1.00 24.72 H new ATOM 0 HG22 VAL A 136 -26.871 3.579 14.564 1.00 24.72 H new ATOM 0 HG23 VAL A 136 -26.652 4.213 13.129 1.00 24.72 H new ATOM 220 N VAL A 137 -28.823 7.468 16.211 1.00 25.99 N ATOM 221 CA VAL A 137 -29.112 8.695 16.933 1.00 29.34 C ATOM 222 C VAL A 137 -28.430 8.823 18.300 1.00 28.81 C ATOM 223 O VAL A 137 -28.526 9.875 18.921 1.00 33.12 O ATOM 224 CB VAL A 137 -30.645 8.971 17.069 1.00 29.10 C ATOM 225 CG1 VAL A 137 -31.312 8.956 15.702 1.00 29.93 C ATOM 226 CG2 VAL A 137 -31.404 7.986 17.949 1.00 31.14 C ATOM 0 H VAL A 137 -29.284 6.797 16.490 1.00 25.99 H new ATOM 0 HA VAL A 137 -28.718 9.379 16.369 1.00 29.34 H new ATOM 0 HB VAL A 137 -30.691 9.841 17.495 1.00 29.10 H new ATOM 0 HG11 VAL A 137 -32.261 9.128 15.803 1.00 29.93 H new ATOM 0 HG12 VAL A 137 -30.917 9.642 15.141 1.00 29.93 H new ATOM 0 HG13 VAL A 137 -31.184 8.088 15.289 1.00 29.93 H new ATOM 0 HG21 VAL A 137 -32.342 8.232 17.976 1.00 31.14 H new ATOM 0 HG22 VAL A 137 -31.315 7.091 17.585 1.00 31.14 H new ATOM 0 HG23 VAL A 137 -31.039 8.006 18.847 1.00 31.14 H new ATOM 227 N GLY A 138 -27.757 7.792 18.771 1.00 28.50 N ATOM 228 CA GLY A 138 -26.950 7.917 19.993 1.00 33.18 C ATOM 229 C GLY A 138 -26.543 6.569 20.509 1.00 35.66 C ATOM 230 O GLY A 138 -26.995 5.570 19.990 1.00 33.34 O ATOM 0 H GLY A 138 -27.747 7.012 18.409 1.00 28.50 H new ATOM 0 HA2 GLY A 138 -26.160 8.449 19.810 1.00 33.18 H new ATOM 0 HA3 GLY A 138 -27.457 8.388 20.673 1.00 33.18 H new ATOM 231 N SER A 139 -25.653 6.533 21.495 1.00 39.81 N ATOM 232 CA SER A 139 -25.416 5.293 22.272 1.00 41.62 C ATOM 233 C SER A 139 -26.533 5.260 23.280 1.00 44.01 C ATOM 234 O SER A 139 -27.450 6.097 23.213 1.00 47.73 O ATOM 235 CB SER A 139 -24.086 5.331 23.026 1.00 44.01 C ATOM 236 OG SER A 139 -24.125 6.289 24.101 1.00 44.28 O ATOM 0 H SER A 139 -25.173 7.205 21.737 1.00 39.81 H new ATOM 0 HA SER A 139 -25.386 4.521 21.685 1.00 41.62 H new ATOM 0 HB2 SER A 139 -23.887 4.450 23.381 1.00 44.01 H new ATOM 0 HB3 SER A 139 -23.370 5.558 22.413 1.00 44.01 H new ATOM 0 HG SER A 139 -24.375 7.034 23.804 1.00 44.28 H new ATOM 237 N ASP A 140 -26.455 4.346 24.245 1.00 44.04 N ATOM 238 CA ASP A 140 -27.436 4.373 25.327 1.00 45.34 C ATOM 239 C ASP A 140 -27.141 5.323 26.531 1.00 45.15 C ATOM 240 O ASP A 140 -28.032 5.447 27.384 1.00 38.28 O ATOM 241 CB ASP A 140 -27.832 2.942 25.775 1.00 42.73 C ATOM 242 CG ASP A 140 -26.731 2.181 26.566 1.00 44.70 C ATOM 243 OD1 ASP A 140 -25.552 2.600 26.732 1.00 37.36 O ATOM 244 OD2 ASP A 140 -27.122 1.100 27.052 1.00 53.25 O ATOM 0 H ASP A 140 -25.864 3.723 24.293 1.00 44.04 H new ATOM 0 HA ASP A 140 -28.208 4.797 24.920 1.00 45.34 H new ATOM 0 HB2 ASP A 140 -28.629 2.997 26.326 1.00 42.73 H new ATOM 0 HB3 ASP A 140 -28.066 2.423 24.989 1.00 42.73 H new ATOM 245 N GLN A 141 -25.946 5.951 26.595 1.00 44.12 N ATOM 246 CA GLN A 141 -25.555 6.885 27.699 1.00 51.85 C ATOM 247 C GLN A 141 -25.270 8.241 27.111 1.00 47.33 C ATOM 248 O GLN A 141 -26.197 8.890 26.612 1.00 47.60 O ATOM 249 CB GLN A 141 -24.339 6.406 28.561 1.00 55.69 C ATOM 250 CG GLN A 141 -24.563 5.027 29.190 1.00 63.40 C ATOM 251 CD GLN A 141 -23.578 4.583 30.299 1.00 70.64 C ATOM 252 OE1 GLN A 141 -23.379 5.261 31.317 1.00 69.30 O ATOM 253 NE2 GLN A 141 -23.015 3.386 30.126 1.00 66.70 N ATOM 0 H GLN A 141 -25.334 5.850 26.000 1.00 44.12 H new ATOM 0 HA GLN A 141 -26.305 6.915 28.313 1.00 51.85 H new ATOM 0 HB2 GLN A 141 -23.545 6.378 28.005 1.00 55.69 H new ATOM 0 HB3 GLN A 141 -24.171 7.054 29.263 1.00 55.69 H new ATOM 0 HG2 GLN A 141 -25.460 5.008 29.560 1.00 63.40 H new ATOM 0 HG3 GLN A 141 -24.535 4.366 28.481 1.00 63.40 H new ATOM 0 HE21 GLN A 141 -23.171 2.937 29.409 1.00 66.70 H new ATOM 0 HE22 GLN A 141 -22.496 3.063 30.731 1.00 66.70 H new ATOM 254 N SER A 146 -20.380 11.539 26.874 1.00 64.48 N ATOM 255 CA SER A 146 -20.562 12.363 25.673 1.00 77.43 C ATOM 256 C SER A 146 -19.445 12.154 24.579 1.00 79.19 C ATOM 257 O SER A 146 -18.320 12.703 24.663 1.00 69.39 O ATOM 258 CB SER A 146 -20.693 13.847 26.086 1.00 80.94 C ATOM 259 OG SER A 146 -21.411 14.614 25.121 1.00 72.76 O ATOM 0 HA SER A 146 -21.381 12.071 25.243 1.00 77.43 H new ATOM 0 HB2 SER A 146 -21.144 13.904 26.943 1.00 80.94 H new ATOM 0 HB3 SER A 146 -19.809 14.227 26.206 1.00 80.94 H new ATOM 0 HG SER A 146 -21.463 15.412 25.379 1.00 72.76 H new ATOM 260 N GLU A 147 -19.787 11.370 23.546 1.00 77.88 N ATOM 261 CA GLU A 147 -18.847 10.976 22.470 1.00 72.93 C ATOM 262 C GLU A 147 -19.522 10.950 21.096 1.00 64.36 C ATOM 263 O GLU A 147 -20.720 10.760 20.988 1.00 58.41 O ATOM 264 CB GLU A 147 -18.289 9.574 22.740 1.00 73.65 C ATOM 265 CG GLU A 147 -17.425 9.430 23.989 1.00 80.65 C ATOM 266 CD GLU A 147 -16.068 10.112 23.866 1.00 85.26 C ATOM 267 OE1 GLU A 147 -15.559 10.190 22.728 1.00 91.86 O ATOM 268 OE2 GLU A 147 -15.498 10.565 24.894 1.00 74.64 O ATOM 0 H GLU A 147 -20.578 11.047 23.446 1.00 77.88 H new ATOM 0 HA GLU A 147 -18.139 11.639 22.465 1.00 72.93 H new ATOM 0 HB2 GLU A 147 -19.034 8.956 22.810 1.00 73.65 H new ATOM 0 HB3 GLU A 147 -17.764 9.300 21.972 1.00 73.65 H new ATOM 0 HG2 GLU A 147 -17.900 9.804 24.748 1.00 80.65 H new ATOM 0 HG3 GLU A 147 -17.290 8.487 24.175 1.00 80.65 H new ATOM 269 N ASP A 148 -18.734 11.144 20.047 1.00 57.36 N ATOM 270 CA ASP A 148 -19.201 10.923 18.679 1.00 55.34 C ATOM 271 C ASP A 148 -19.132 9.443 18.336 1.00 53.36 C ATOM 272 O ASP A 148 -18.539 8.637 19.053 1.00 53.80 O ATOM 273 CB ASP A 148 -18.386 11.717 17.641 1.00 56.13 C ATOM 274 CG ASP A 148 -16.985 11.121 17.367 1.00 57.65 C ATOM 275 OD1 ASP A 148 -16.398 10.462 18.240 1.00 59.49 O ATOM 276 OD2 ASP A 148 -16.435 11.358 16.276 1.00 59.53 O ATOM 0 H ASP A 148 -17.917 11.406 20.104 1.00 57.36 H new ATOM 0 HA ASP A 148 -20.118 11.237 18.642 1.00 55.34 H new ATOM 0 HB2 ASP A 148 -18.883 11.752 16.809 1.00 56.13 H new ATOM 0 HB3 ASP A 148 -18.286 12.631 17.950 1.00 56.13 H new ATOM 277 N PHE A 149 -19.725 9.118 17.205 1.00 49.20 N ATOM 278 CA PHE A 149 -19.870 7.753 16.755 1.00 45.58 C ATOM 279 C PHE A 149 -18.506 7.014 16.515 1.00 39.16 C ATOM 280 O PHE A 149 -18.248 5.939 17.084 1.00 38.13 O ATOM 281 CB PHE A 149 -20.795 7.777 15.493 1.00 46.96 C ATOM 282 CG PHE A 149 -21.211 6.409 14.999 1.00 43.15 C ATOM 283 CD1 PHE A 149 -21.852 5.503 15.858 1.00 43.54 C ATOM 284 CD2 PHE A 149 -20.930 6.013 13.701 1.00 39.74 C ATOM 285 CE1 PHE A 149 -22.213 4.249 15.419 1.00 39.46 C ATOM 286 CE2 PHE A 149 -21.265 4.758 13.265 1.00 36.98 C ATOM 287 CZ PHE A 149 -21.887 3.874 14.124 1.00 40.69 C ATOM 0 H PHE A 149 -20.062 9.698 16.666 1.00 49.20 H new ATOM 0 HA PHE A 149 -20.280 7.223 17.457 1.00 45.58 H new ATOM 0 HB2 PHE A 149 -21.592 8.291 15.699 1.00 46.96 H new ATOM 0 HB3 PHE A 149 -20.335 8.242 14.777 1.00 46.96 H new ATOM 0 HD1 PHE A 149 -22.035 5.753 16.735 1.00 43.54 H new ATOM 0 HD2 PHE A 149 -20.510 6.605 13.120 1.00 39.74 H new ATOM 0 HE1 PHE A 149 -22.667 3.664 15.981 1.00 39.46 H new ATOM 0 HE2 PHE A 149 -21.074 4.502 12.392 1.00 36.98 H new ATOM 0 HZ PHE A 149 -22.090 3.015 13.830 1.00 40.69 H new ATOM 288 N PHE A 150 -17.609 7.627 15.763 1.00 33.30 N ATOM 289 CA PHE A 150 -16.380 6.966 15.386 1.00 37.46 C ATOM 290 C PHE A 150 -15.454 6.617 16.550 1.00 34.81 C ATOM 291 O PHE A 150 -14.840 5.563 16.557 1.00 32.73 O ATOM 292 CB PHE A 150 -15.706 7.745 14.252 1.00 42.24 C ATOM 293 CG PHE A 150 -16.520 7.706 12.976 1.00 50.17 C ATOM 294 CD1 PHE A 150 -16.482 6.589 12.167 1.00 55.53 C ATOM 295 CD2 PHE A 150 -17.397 8.724 12.663 1.00 56.49 C ATOM 296 CE1 PHE A 150 -17.266 6.500 11.042 1.00 64.00 C ATOM 297 CE2 PHE A 150 -18.185 8.654 11.539 1.00 60.08 C ATOM 298 CZ PHE A 150 -18.127 7.541 10.722 1.00 66.65 C ATOM 0 H PHE A 150 -17.695 8.428 15.461 1.00 33.30 H new ATOM 0 HA PHE A 150 -16.613 6.087 15.049 1.00 37.46 H new ATOM 0 HB2 PHE A 150 -15.578 8.667 14.525 1.00 42.24 H new ATOM 0 HB3 PHE A 150 -14.825 7.374 14.085 1.00 42.24 H new ATOM 0 HD1 PHE A 150 -15.916 5.884 12.387 1.00 55.53 H new ATOM 0 HD2 PHE A 150 -17.456 9.467 13.219 1.00 56.49 H new ATOM 0 HE1 PHE A 150 -17.220 5.747 10.498 1.00 64.00 H new ATOM 0 HE2 PHE A 150 -18.757 9.356 11.328 1.00 60.08 H new ATOM 0 HZ PHE A 150 -18.661 7.490 9.963 1.00 66.65 H new ATOM 299 N THR A 151 -15.428 7.434 17.585 1.00 35.47 N ATOM 300 CA THR A 151 -14.514 7.166 18.712 1.00 38.47 C ATOM 301 C THR A 151 -15.156 6.106 19.607 1.00 35.33 C ATOM 302 O THR A 151 -14.491 5.232 20.138 1.00 41.42 O ATOM 303 CB THR A 151 -14.112 8.460 19.453 1.00 44.48 C ATOM 304 OG1 THR A 151 -15.264 9.060 20.051 1.00 53.20 O ATOM 305 CG2 THR A 151 -13.437 9.489 18.484 1.00 45.50 C ATOM 0 H THR A 151 -15.915 8.138 17.667 1.00 35.47 H new ATOM 0 HA THR A 151 -13.671 6.813 18.386 1.00 38.47 H new ATOM 0 HB THR A 151 -13.471 8.219 20.140 1.00 44.48 H new ATOM 0 HG1 THR A 151 -15.769 9.357 19.450 1.00 53.20 H new ATOM 0 HG21 THR A 151 -13.197 10.289 18.977 1.00 45.50 H new ATOM 0 HG22 THR A 151 -12.639 9.095 18.099 1.00 45.50 H new ATOM 0 HG23 THR A 151 -14.057 9.721 17.775 1.00 45.50 H new ATOM 306 N LEU A 152 -16.468 6.137 19.685 1.00 32.66 N ATOM 307 CA LEU A 152 -17.215 5.054 20.293 1.00 33.77 C ATOM 308 C LEU A 152 -16.944 3.710 19.616 1.00 28.40 C ATOM 309 O LEU A 152 -16.502 2.763 20.251 1.00 28.21 O ATOM 310 CB LEU A 152 -18.695 5.396 20.268 1.00 36.76 C ATOM 311 CG LEU A 152 -19.520 5.074 21.481 1.00 43.38 C ATOM 312 CD1 LEU A 152 -18.997 5.817 22.688 1.00 47.16 C ATOM 313 CD2 LEU A 152 -20.960 5.482 21.169 1.00 44.84 C ATOM 0 H LEU A 152 -16.953 6.783 19.389 1.00 32.66 H new ATOM 0 HA LEU A 152 -16.921 4.956 21.212 1.00 33.77 H new ATOM 0 HB2 LEU A 152 -18.776 6.348 20.099 1.00 36.76 H new ATOM 0 HB3 LEU A 152 -19.092 4.939 19.510 1.00 36.76 H new ATOM 0 HG LEU A 152 -19.475 4.127 21.688 1.00 43.38 H new ATOM 0 HD11 LEU A 152 -19.539 5.599 23.462 1.00 47.16 H new ATOM 0 HD12 LEU A 152 -18.077 5.558 22.854 1.00 47.16 H new ATOM 0 HD13 LEU A 152 -19.038 6.772 22.523 1.00 47.16 H new ATOM 0 HD21 LEU A 152 -21.524 5.288 21.934 1.00 44.84 H new ATOM 0 HD22 LEU A 152 -20.993 6.432 20.976 1.00 44.84 H new ATOM 0 HD23 LEU A 152 -21.278 4.985 20.399 1.00 44.84 H new ATOM 314 N ILE A 153 -17.136 3.664 18.316 1.00 26.71 N ATOM 315 CA ILE A 153 -16.898 2.423 17.567 1.00 28.52 C ATOM 316 C ILE A 153 -15.478 1.987 17.853 1.00 30.16 C ATOM 317 O ILE A 153 -15.256 0.841 18.116 1.00 33.46 O ATOM 318 CB ILE A 153 -17.050 2.603 16.039 1.00 30.89 C ATOM 319 CG1 ILE A 153 -18.470 3.026 15.621 1.00 29.66 C ATOM 320 CG2 ILE A 153 -16.558 1.351 15.280 1.00 30.46 C ATOM 321 CD1 ILE A 153 -19.532 2.024 16.032 1.00 33.96 C ATOM 0 H ILE A 153 -17.402 4.329 17.840 1.00 26.71 H new ATOM 0 HA ILE A 153 -17.557 1.769 17.848 1.00 28.52 H new ATOM 0 HB ILE A 153 -16.477 3.343 15.783 1.00 30.89 H new ATOM 0 HG12 ILE A 153 -18.675 3.888 16.017 1.00 29.66 H new ATOM 0 HG13 ILE A 153 -18.497 3.142 14.658 1.00 29.66 H new ATOM 0 HG21 ILE A 153 -16.664 1.489 14.326 1.00 30.46 H new ATOM 0 HG22 ILE A 153 -15.622 1.197 15.482 1.00 30.46 H new ATOM 0 HG23 ILE A 153 -17.079 0.580 15.555 1.00 30.46 H new ATOM 0 HD11 ILE A 153 -20.403 2.339 15.745 1.00 33.96 H new ATOM 0 HD12 ILE A 153 -19.346 1.167 15.618 1.00 33.96 H new ATOM 0 HD13 ILE A 153 -19.527 1.924 16.997 1.00 33.96 H new ATOM 322 N GLU A 154 -14.530 2.930 17.848 1.00 34.62 N ATOM 323 CA GLU A 154 -13.107 2.635 18.060 1.00 35.78 C ATOM 324 C GLU A 154 -12.856 2.049 19.436 1.00 34.64 C ATOM 325 O GLU A 154 -12.309 0.983 19.600 1.00 31.52 O ATOM 326 CB GLU A 154 -12.337 3.909 17.906 1.00 42.63 C ATOM 327 CG GLU A 154 -10.850 3.777 18.050 1.00 48.93 C ATOM 328 CD GLU A 154 -10.175 5.025 17.532 1.00 64.81 C ATOM 329 OE1 GLU A 154 -9.624 4.978 16.397 1.00 71.53 O ATOM 330 OE2 GLU A 154 -10.250 6.064 18.244 1.00 72.09 O ATOM 0 H GLU A 154 -14.696 3.764 17.721 1.00 34.62 H new ATOM 0 HA GLU A 154 -12.821 1.977 17.407 1.00 35.78 H new ATOM 0 HB2 GLU A 154 -12.531 4.284 17.033 1.00 42.63 H new ATOM 0 HB3 GLU A 154 -12.656 4.545 18.565 1.00 42.63 H new ATOM 0 HG2 GLU A 154 -10.618 3.636 18.981 1.00 48.93 H new ATOM 0 HG3 GLU A 154 -10.536 3.002 17.559 1.00 48.93 H new ATOM 331 N SER A 155 -13.368 2.731 20.418 1.00 34.33 N ATOM 332 CA SER A 155 -13.147 2.365 21.790 1.00 38.53 C ATOM 333 C SER A 155 -13.904 1.134 22.219 1.00 36.98 C ATOM 334 O SER A 155 -13.657 0.689 23.324 1.00 32.71 O ATOM 335 CB SER A 155 -13.603 3.499 22.709 1.00 43.08 C ATOM 336 OG SER A 155 -15.011 3.448 22.894 1.00 46.02 O ATOM 0 H SER A 155 -13.860 3.428 20.312 1.00 34.33 H new ATOM 0 HA SER A 155 -12.196 2.186 21.859 1.00 38.53 H new ATOM 0 HB2 SER A 155 -13.155 3.429 23.567 1.00 43.08 H new ATOM 0 HB3 SER A 155 -13.351 4.354 22.327 1.00 43.08 H new ATOM 0 HG SER A 155 -15.250 4.074 23.401 1.00 46.02 H new ATOM 337 N HIS A 156 -14.864 0.635 21.407 1.00 33.65 N ATOM 338 CA HIS A 156 -15.535 -0.627 21.702 1.00 27.56 C ATOM 339 C HIS A 156 -15.120 -1.702 20.741 1.00 26.82 C ATOM 340 O HIS A 156 -15.848 -2.631 20.480 1.00 26.52 O ATOM 341 CB HIS A 156 -17.044 -0.478 21.650 1.00 29.35 C ATOM 342 CG HIS A 156 -17.603 0.401 22.700 1.00 29.63 C ATOM 343 ND1 HIS A 156 -17.300 1.743 22.783 1.00 32.19 N ATOM 344 CD2 HIS A 156 -18.453 0.132 23.721 1.00 28.62 C ATOM 345 CE1 HIS A 156 -17.923 2.260 23.833 1.00 32.68 C ATOM 346 NE2 HIS A 156 -18.648 1.310 24.404 1.00 28.43 N ATOM 0 H HIS A 156 -15.131 1.020 20.686 1.00 33.65 H new ATOM 0 HA HIS A 156 -15.270 -0.880 22.600 1.00 27.56 H new ATOM 0 HB2 HIS A 156 -17.294 -0.127 20.781 1.00 29.35 H new ATOM 0 HB3 HIS A 156 -17.449 -1.356 21.728 1.00 29.35 H new ATOM 0 HD1 HIS A 156 -16.790 2.175 22.242 1.00 32.19 H new ATOM 0 HD2 HIS A 156 -18.833 -0.693 23.922 1.00 28.62 H new ATOM 0 HE1 HIS A 156 -17.861 3.142 24.121 1.00 32.68 H new ATOM 347 N GLU A 157 -13.939 -1.594 20.187 1.00 28.76 N ATOM 348 CA GLU A 157 -13.418 -2.690 19.418 1.00 32.95 C ATOM 349 C GLU A 157 -13.457 -3.928 20.287 1.00 34.67 C ATOM 350 O GLU A 157 -13.036 -3.881 21.402 1.00 37.53 O ATOM 351 CB GLU A 157 -12.010 -2.397 18.968 1.00 32.54 C ATOM 352 CG GLU A 157 -11.408 -3.560 18.252 1.00 37.35 C ATOM 353 CD GLU A 157 -12.028 -3.848 16.890 1.00 39.16 C ATOM 354 OE1 GLU A 157 -12.734 -2.974 16.352 1.00 43.14 O ATOM 355 OE2 GLU A 157 -11.762 -4.946 16.348 1.00 36.94 O ATOM 0 H GLU A 157 -13.428 -0.905 20.242 1.00 28.76 H new ATOM 0 HA GLU A 157 -13.954 -2.827 18.621 1.00 32.95 H new ATOM 0 HB2 GLU A 157 -12.011 -1.622 18.384 1.00 32.54 H new ATOM 0 HB3 GLU A 157 -11.464 -2.172 19.737 1.00 32.54 H new ATOM 0 HG2 GLU A 157 -10.459 -3.398 18.136 1.00 37.35 H new ATOM 0 HG3 GLU A 157 -11.495 -4.349 18.809 1.00 37.35 H new ATOM 356 N GLY A 158 -14.016 -5.019 19.789 1.00 34.09 N ATOM 357 CA GLY A 158 -14.211 -6.216 20.587 1.00 31.67 C ATOM 358 C GLY A 158 -15.166 -6.210 21.753 1.00 34.35 C ATOM 359 O GLY A 158 -15.111 -7.087 22.574 1.00 39.15 O ATOM 0 H GLY A 158 -14.293 -5.086 18.978 1.00 34.09 H new ATOM 0 HA2 GLY A 158 -14.500 -6.918 19.984 1.00 31.67 H new ATOM 0 HA3 GLY A 158 -13.342 -6.476 20.930 1.00 31.67 H new ATOM 360 N LYS A 159 -16.102 -5.298 21.832 1.00 35.23 N ATOM 361 CA LYS A 159 -16.882 -5.220 23.021 1.00 35.23 C ATOM 362 C LYS A 159 -18.248 -4.837 22.573 1.00 33.49 C ATOM 363 O LYS A 159 -18.362 -4.148 21.586 1.00 32.48 O ATOM 364 CB LYS A 159 -16.245 -4.181 23.958 1.00 46.36 C ATOM 365 CG LYS A 159 -16.111 -4.618 25.428 1.00 61.05 C ATOM 366 CD LYS A 159 -15.325 -5.945 25.660 1.00 66.70 C ATOM 367 CE LYS A 159 -15.435 -6.505 27.094 1.00 66.23 C ATOM 368 NZ LYS A 159 -16.756 -7.103 27.453 1.00 57.53 N ATOM 0 H LYS A 159 -16.296 -4.727 21.219 1.00 35.23 H new ATOM 0 HA LYS A 159 -16.924 -6.051 23.519 1.00 35.23 H new ATOM 0 HB2 LYS A 159 -15.363 -3.959 23.620 1.00 46.36 H new ATOM 0 HB3 LYS A 159 -16.774 -3.369 23.924 1.00 46.36 H new ATOM 0 HG2 LYS A 159 -15.671 -3.908 25.922 1.00 61.05 H new ATOM 0 HG3 LYS A 159 -17.000 -4.716 25.803 1.00 61.05 H new ATOM 0 HD2 LYS A 159 -15.649 -6.614 25.037 1.00 66.70 H new ATOM 0 HD3 LYS A 159 -14.389 -5.795 25.453 1.00 66.70 H new ATOM 0 HE2 LYS A 159 -14.749 -7.180 27.214 1.00 66.23 H new ATOM 0 HE3 LYS A 159 -15.241 -5.789 27.719 1.00 66.23 H new ATOM 0 HZ1 LYS A 159 -16.730 -7.399 28.292 1.00 57.53 H new ATOM 0 HZ2 LYS A 159 -17.392 -6.486 27.376 1.00 57.53 H new ATOM 0 HZ3 LYS A 159 -16.934 -7.782 26.905 1.00 57.53 H new ATOM 369 N PRO A 160 -19.296 -5.314 23.256 1.00 32.60 N ATOM 370 CA PRO A 160 -20.626 -4.959 22.796 1.00 34.40 C ATOM 371 C PRO A 160 -20.875 -3.501 23.062 1.00 35.24 C ATOM 372 O PRO A 160 -20.346 -2.952 24.025 1.00 29.83 O ATOM 373 CB PRO A 160 -21.584 -5.830 23.626 1.00 32.23 C ATOM 374 CG PRO A 160 -20.743 -6.665 24.505 1.00 32.89 C ATOM 375 CD PRO A 160 -19.341 -6.124 24.486 1.00 33.10 C ATOM 0 HA PRO A 160 -20.744 -5.106 21.844 1.00 34.40 H new ATOM 0 HB2 PRO A 160 -22.186 -5.278 24.149 1.00 32.23 H new ATOM 0 HB3 PRO A 160 -22.134 -6.383 23.049 1.00 32.23 H new ATOM 0 HG2 PRO A 160 -21.093 -6.660 25.410 1.00 32.89 H new ATOM 0 HG3 PRO A 160 -20.752 -7.587 24.203 1.00 32.89 H new ATOM 0 HD2 PRO A 160 -19.155 -5.588 25.273 1.00 33.10 H new ATOM 0 HD3 PRO A 160 -18.684 -6.837 24.467 1.00 33.10 H new ATOM 376 N LEU A 161 -21.690 -2.918 22.197 1.00 33.97 N ATOM 377 CA LEU A 161 -21.933 -1.500 22.170 1.00 33.26 C ATOM 378 C LEU A 161 -23.401 -1.339 21.935 1.00 32.73 C ATOM 379 O LEU A 161 -23.881 -1.800 20.905 1.00 31.61 O ATOM 380 CB LEU A 161 -21.129 -0.841 21.025 1.00 31.06 C ATOM 381 CG LEU A 161 -21.295 0.666 20.703 1.00 31.72 C ATOM 382 CD1 LEU A 161 -21.250 1.512 21.940 1.00 28.65 C ATOM 383 CD2 LEU A 161 -20.254 1.174 19.686 1.00 31.40 C ATOM 0 H LEU A 161 -22.125 -3.353 21.596 1.00 33.97 H new ATOM 0 HA LEU A 161 -21.657 -1.075 22.997 1.00 33.26 H new ATOM 0 HB2 LEU A 161 -20.189 -0.990 21.214 1.00 31.06 H new ATOM 0 HB3 LEU A 161 -21.336 -1.330 20.213 1.00 31.06 H new ATOM 0 HG LEU A 161 -22.173 0.751 20.300 1.00 31.72 H new ATOM 0 HD11 LEU A 161 -21.357 2.445 21.698 1.00 28.65 H new ATOM 0 HD12 LEU A 161 -21.967 1.249 22.538 1.00 28.65 H new ATOM 0 HD13 LEU A 161 -20.397 1.390 22.385 1.00 28.65 H new ATOM 0 HD21 LEU A 161 -20.399 2.118 19.518 1.00 31.40 H new ATOM 0 HD22 LEU A 161 -19.362 1.043 20.043 1.00 31.40 H new ATOM 0 HD23 LEU A 161 -20.345 0.681 18.856 1.00 31.40 H new ATOM 384 N LYS A 162 -24.114 -0.707 22.877 1.00 33.07 N ATOM 385 CA LYS A 162 -25.561 -0.367 22.682 1.00 32.58 C ATOM 386 C LYS A 162 -25.771 0.935 21.964 1.00 29.50 C ATOM 387 O LYS A 162 -25.104 1.956 22.280 1.00 31.44 O ATOM 388 CB LYS A 162 -26.333 -0.315 23.985 1.00 31.90 C ATOM 389 CG LYS A 162 -26.430 -1.687 24.614 1.00 39.98 C ATOM 390 CD LYS A 162 -27.858 -2.138 24.942 1.00 46.03 C ATOM 391 CE LYS A 162 -27.869 -3.348 25.905 1.00 52.59 C ATOM 392 NZ LYS A 162 -27.182 -4.606 25.406 1.00 50.42 N ATOM 0 H LYS A 162 -23.793 -0.462 23.636 1.00 33.07 H new ATOM 0 HA LYS A 162 -25.900 -1.091 22.133 1.00 32.58 H new ATOM 0 HB2 LYS A 162 -25.896 0.296 24.599 1.00 31.90 H new ATOM 0 HB3 LYS A 162 -27.224 0.034 23.823 1.00 31.90 H new ATOM 0 HG2 LYS A 162 -26.029 -2.334 24.013 1.00 39.98 H new ATOM 0 HG3 LYS A 162 -25.906 -1.694 25.430 1.00 39.98 H new ATOM 0 HD2 LYS A 162 -28.346 -1.401 25.342 1.00 46.03 H new ATOM 0 HD3 LYS A 162 -28.320 -2.373 24.122 1.00 46.03 H new ATOM 0 HE2 LYS A 162 -27.448 -3.080 26.737 1.00 52.59 H new ATOM 0 HE3 LYS A 162 -28.792 -3.565 26.111 1.00 52.59 H new ATOM 0 HZ1 LYS A 162 -27.585 -5.321 25.750 1.00 50.42 H new ATOM 0 HZ2 LYS A 162 -27.229 -4.638 24.518 1.00 50.42 H new ATOM 0 HZ3 LYS A 162 -26.328 -4.598 25.657 1.00 50.42 H new ATOM 393 N LEU A 163 -26.714 0.901 21.007 1.00 27.10 N ATOM 394 CA LEU A 163 -27.027 2.071 20.170 1.00 24.35 C ATOM 395 C LEU A 163 -28.487 2.291 20.047 1.00 22.60 C ATOM 396 O LEU A 163 -29.227 1.338 20.085 1.00 25.17 O ATOM 397 CB LEU A 163 -26.471 1.878 18.792 1.00 23.99 C ATOM 398 CG LEU A 163 -24.988 1.706 18.620 1.00 24.87 C ATOM 399 CD1 LEU A 163 -24.787 1.292 17.171 1.00 26.27 C ATOM 400 CD2 LEU A 163 -24.237 2.972 18.962 1.00 23.28 C ATOM 0 H LEU A 163 -27.185 0.204 20.827 1.00 27.10 H new ATOM 0 HA LEU A 163 -26.627 2.842 20.602 1.00 24.35 H new ATOM 0 HB2 LEU A 163 -26.902 1.098 18.409 1.00 23.99 H new ATOM 0 HB3 LEU A 163 -26.741 2.642 18.258 1.00 23.99 H new ATOM 0 HG LEU A 163 -24.635 1.035 19.225 1.00 24.87 H new ATOM 0 HD11 LEU A 163 -23.841 1.165 16.999 1.00 26.27 H new ATOM 0 HD12 LEU A 163 -25.260 0.462 17.003 1.00 26.27 H new ATOM 0 HD13 LEU A 163 -25.132 1.984 16.586 1.00 26.27 H new ATOM 0 HD21 LEU A 163 -23.286 2.827 18.841 1.00 23.28 H new ATOM 0 HD22 LEU A 163 -24.531 3.690 18.380 1.00 23.28 H new ATOM 0 HD23 LEU A 163 -24.412 3.213 19.885 1.00 23.28 H new ATOM 401 N MET A 164 -28.902 3.543 19.901 1.00 21.99 N ATOM 402 CA MET A 164 -30.286 3.875 19.705 1.00 25.86 C ATOM 403 C MET A 164 -30.405 4.232 18.251 1.00 21.84 C ATOM 404 O MET A 164 -29.645 5.047 17.750 1.00 20.35 O ATOM 405 CB MET A 164 -30.729 5.022 20.610 1.00 32.32 C ATOM 406 CG MET A 164 -30.485 4.739 22.097 1.00 41.96 C ATOM 407 SD MET A 164 -31.137 3.158 22.756 1.00 50.43 S ATOM 408 CE MET A 164 -32.827 3.568 22.731 1.00 44.96 C ATOM 0 H MET A 164 -28.376 4.223 19.914 1.00 21.99 H new ATOM 0 HA MET A 164 -30.867 3.134 19.939 1.00 25.86 H new ATOM 0 HB2 MET A 164 -30.254 5.829 20.357 1.00 32.32 H new ATOM 0 HB3 MET A 164 -31.673 5.193 20.469 1.00 32.32 H new ATOM 0 HG2 MET A 164 -29.528 4.761 22.256 1.00 41.96 H new ATOM 0 HG3 MET A 164 -30.874 5.464 22.610 1.00 41.96 H new ATOM 0 HE1 MET A 164 -33.346 2.824 23.075 1.00 44.96 H new ATOM 0 HE2 MET A 164 -32.979 4.350 23.284 1.00 44.96 H new ATOM 0 HE3 MET A 164 -33.101 3.759 21.820 1.00 44.96 H new ATOM 409 N VAL A 165 -31.383 3.622 17.602 1.00 20.21 N ATOM 410 CA VAL A 165 -31.478 3.589 16.164 1.00 19.97 C ATOM 411 C VAL A 165 -32.867 3.986 15.772 1.00 19.30 C ATOM 412 O VAL A 165 -33.808 3.322 16.072 1.00 23.66 O ATOM 413 CB VAL A 165 -31.143 2.215 15.643 1.00 18.30 C ATOM 414 CG1 VAL A 165 -31.309 2.138 14.127 1.00 19.74 C ATOM 415 CG2 VAL A 165 -29.749 1.849 16.065 1.00 18.69 C ATOM 0 H VAL A 165 -32.023 3.207 17.999 1.00 20.21 H new ATOM 0 HA VAL A 165 -30.841 4.209 15.776 1.00 19.97 H new ATOM 0 HB VAL A 165 -31.763 1.574 16.023 1.00 18.30 H new ATOM 0 HG11 VAL A 165 -31.087 1.244 13.822 1.00 19.74 H new ATOM 0 HG12 VAL A 165 -32.228 2.341 13.891 1.00 19.74 H new ATOM 0 HG13 VAL A 165 -30.718 2.780 13.704 1.00 19.74 H new ATOM 0 HG21 VAL A 165 -29.531 0.965 15.731 1.00 18.69 H new ATOM 0 HG22 VAL A 165 -29.121 2.494 15.704 1.00 18.69 H new ATOM 0 HG23 VAL A 165 -29.693 1.851 17.033 1.00 18.69 H new ATOM 416 N TYR A 166 -32.997 5.074 15.058 1.00 21.41 N ATOM 417 CA TYR A 166 -34.248 5.448 14.425 1.00 20.36 C ATOM 418 C TYR A 166 -34.393 4.796 13.036 1.00 19.74 C ATOM 419 O TYR A 166 -33.469 4.873 12.235 1.00 21.12 O ATOM 420 CB TYR A 166 -34.325 6.966 14.326 1.00 22.81 C ATOM 421 CG TYR A 166 -35.561 7.438 13.567 1.00 26.12 C ATOM 422 CD1 TYR A 166 -36.821 7.358 14.143 1.00 26.72 C ATOM 423 CD2 TYR A 166 -35.463 7.898 12.252 1.00 26.04 C ATOM 424 CE1 TYR A 166 -37.949 7.746 13.437 1.00 30.20 C ATOM 425 CE2 TYR A 166 -36.578 8.270 11.536 1.00 29.42 C ATOM 426 CZ TYR A 166 -37.811 8.241 12.135 1.00 30.11 C ATOM 427 OH TYR A 166 -38.885 8.646 11.440 1.00 29.17 O ATOM 0 H TYR A 166 -32.356 5.630 14.920 1.00 21.41 H new ATOM 0 HA TYR A 166 -34.983 5.124 14.968 1.00 20.36 H new ATOM 0 HB2 TYR A 166 -34.332 7.346 15.219 1.00 22.81 H new ATOM 0 HB3 TYR A 166 -33.529 7.299 13.882 1.00 22.81 H new ATOM 0 HD1 TYR A 166 -36.910 7.040 15.013 1.00 26.72 H new ATOM 0 HD2 TYR A 166 -34.626 7.954 11.851 1.00 26.04 H new ATOM 0 HE1 TYR A 166 -38.791 7.678 13.825 1.00 30.20 H new ATOM 0 HE2 TYR A 166 -36.495 8.540 10.650 1.00 29.42 H new ATOM 0 HH TYR A 166 -39.574 8.562 11.914 1.00 29.17 H new ATOM 428 N ASN A 167 -35.575 4.244 12.731 1.00 18.31 N ATOM 429 CA ASN A 167 -35.884 3.693 11.438 1.00 20.69 C ATOM 430 C ASN A 167 -36.936 4.610 10.767 1.00 21.60 C ATOM 431 O ASN A 167 -37.959 4.917 11.342 1.00 19.36 O ATOM 432 CB ASN A 167 -36.395 2.229 11.537 1.00 19.06 C ATOM 433 CG ASN A 167 -36.642 1.596 10.161 1.00 21.03 C ATOM 434 OD1 ASN A 167 -37.716 1.795 9.514 1.00 21.52 O ATOM 435 ND2 ASN A 167 -35.664 0.845 9.692 1.00 21.77 N ATOM 0 H ASN A 167 -36.223 4.186 13.293 1.00 18.31 H new ATOM 0 HA ASN A 167 -35.077 3.660 10.900 1.00 20.69 H new ATOM 0 HB2 ASN A 167 -35.746 1.696 12.023 1.00 19.06 H new ATOM 0 HB3 ASN A 167 -37.218 2.211 12.050 1.00 19.06 H new ATOM 0 HD21 ASN A 167 -35.741 0.470 8.922 1.00 21.77 H new ATOM 0 HD22 ASN A 167 -34.949 0.731 10.156 1.00 21.77 H new ATOM 436 N SER A 168 -36.681 5.026 9.531 1.00 23.93 N ATOM 437 CA SER A 168 -37.631 5.940 8.832 1.00 27.27 C ATOM 438 C SER A 168 -38.919 5.269 8.345 1.00 26.83 C ATOM 439 O SER A 168 -39.964 5.911 8.362 1.00 28.43 O ATOM 440 CB SER A 168 -36.939 6.609 7.646 1.00 23.39 C ATOM 441 OG SER A 168 -36.438 5.586 6.840 1.00 21.13 O ATOM 0 H SER A 168 -35.986 4.806 9.075 1.00 23.93 H new ATOM 0 HA SER A 168 -37.896 6.593 9.499 1.00 27.27 H new ATOM 0 HB2 SER A 168 -37.563 7.162 7.151 1.00 23.39 H new ATOM 0 HB3 SER A 168 -36.224 7.190 7.948 1.00 23.39 H new ATOM 0 HG SER A 168 -36.210 5.902 6.096 1.00 21.13 H new ATOM 442 N LYS A 169 -38.862 4.012 7.916 1.00 27.04 N ATOM 443 CA LYS A 169 -40.073 3.344 7.421 1.00 32.42 C ATOM 444 C LYS A 169 -41.024 2.962 8.525 1.00 33.73 C ATOM 445 O LYS A 169 -42.242 3.133 8.379 1.00 40.36 O ATOM 446 CB LYS A 169 -39.781 2.088 6.624 1.00 38.21 C ATOM 447 CG LYS A 169 -39.930 2.313 5.132 1.00 49.26 C ATOM 448 CD LYS A 169 -38.896 3.297 4.545 1.00 52.39 C ATOM 449 CE LYS A 169 -38.579 2.887 3.100 1.00 58.13 C ATOM 450 NZ LYS A 169 -38.008 3.993 2.287 1.00 61.71 N ATOM 0 H LYS A 169 -38.149 3.532 7.901 1.00 27.04 H new ATOM 0 HA LYS A 169 -40.482 4.009 6.845 1.00 32.42 H new ATOM 0 HB2 LYS A 169 -38.879 1.787 6.816 1.00 38.21 H new ATOM 0 HB3 LYS A 169 -40.382 1.381 6.905 1.00 38.21 H new ATOM 0 HG2 LYS A 169 -39.849 1.461 4.675 1.00 49.26 H new ATOM 0 HG3 LYS A 169 -40.822 2.648 4.951 1.00 49.26 H new ATOM 0 HD2 LYS A 169 -39.245 4.202 4.568 1.00 52.39 H new ATOM 0 HD3 LYS A 169 -38.087 3.291 5.080 1.00 52.39 H new ATOM 0 HE2 LYS A 169 -37.954 2.146 3.111 1.00 58.13 H new ATOM 0 HE3 LYS A 169 -39.391 2.568 2.676 1.00 58.13 H new ATOM 0 HZ1 LYS A 169 -37.844 3.701 1.462 1.00 61.71 H new ATOM 0 HZ2 LYS A 169 -38.588 4.667 2.253 1.00 61.71 H new ATOM 0 HZ3 LYS A 169 -37.249 4.274 2.658 1.00 61.71 H new ATOM 451 N SER A 170 -40.511 2.416 9.612 1.00 31.29 N ATOM 452 CA SER A 170 -41.385 2.151 10.758 1.00 33.80 C ATOM 453 C SER A 170 -41.671 3.430 11.563 1.00 34.68 C ATOM 454 O SER A 170 -42.545 3.438 12.414 1.00 32.71 O ATOM 455 CB SER A 170 -40.783 1.114 11.675 1.00 30.44 C ATOM 456 OG SER A 170 -39.702 1.638 12.370 1.00 34.12 O ATOM 0 H SER A 170 -39.686 2.194 9.714 1.00 31.29 H new ATOM 0 HA SER A 170 -42.221 1.815 10.398 1.00 33.80 H new ATOM 0 HB2 SER A 170 -41.454 0.801 12.301 1.00 30.44 H new ATOM 0 HB3 SER A 170 -40.498 0.345 11.157 1.00 30.44 H new ATOM 0 HG SER A 170 -39.912 1.746 13.176 1.00 34.12 H new ATOM 457 N ASP A 171 -40.889 4.479 11.309 1.00 32.23 N ATOM 458 CA ASP A 171 -40.943 5.711 12.035 1.00 35.52 C ATOM 459 C ASP A 171 -40.909 5.478 13.566 1.00 32.88 C ATOM 460 O ASP A 171 -41.836 5.844 14.276 1.00 38.95 O ATOM 461 CB ASP A 171 -42.153 6.525 11.565 1.00 38.45 C ATOM 462 CG ASP A 171 -42.132 7.975 12.077 1.00 45.32 C ATOM 463 OD1 ASP A 171 -41.060 8.531 12.433 1.00 46.66 O ATOM 464 OD2 ASP A 171 -43.228 8.542 12.148 1.00 52.36 O ATOM 0 H ASP A 171 -40.297 4.478 10.685 1.00 32.23 H new ATOM 0 HA ASP A 171 -40.148 6.234 11.845 1.00 35.52 H new ATOM 0 HB2 ASP A 171 -42.178 6.529 10.595 1.00 38.45 H new ATOM 0 HB3 ASP A 171 -42.966 6.091 11.867 1.00 38.45 H new ATOM 465 N SER A 172 -39.841 4.858 14.049 1.00 30.58 N ATOM 466 CA SER A 172 -39.731 4.495 15.441 1.00 31.92 C ATOM 467 C SER A 172 -38.325 4.187 15.862 1.00 30.20 C ATOM 468 O SER A 172 -37.487 3.893 15.043 1.00 30.00 O ATOM 469 CB SER A 172 -40.637 3.276 15.742 1.00 33.53 C ATOM 470 OG SER A 172 -40.116 2.072 15.196 1.00 33.85 O ATOM 0 H SER A 172 -39.160 4.638 13.572 1.00 30.58 H new ATOM 0 HA SER A 172 -40.019 5.268 15.952 1.00 31.92 H new ATOM 0 HB2 SER A 172 -40.736 3.178 16.702 1.00 33.53 H new ATOM 0 HB3 SER A 172 -41.523 3.436 15.381 1.00 33.53 H new ATOM 0 HG SER A 172 -40.602 1.427 15.426 1.00 33.85 H new ATOM 471 N CYS A 173 -38.092 4.225 17.164 1.00 29.05 N ATOM 472 CA ACYS A 173 -36.761 4.052 17.710 0.50 29.10 C ATOM 473 CA BCYS A 173 -36.753 4.070 17.716 0.50 31.49 C ATOM 474 C CYS A 173 -36.610 2.676 18.320 1.00 29.74 C ATOM 475 O CYS A 173 -37.596 2.090 18.751 1.00 25.92 O ATOM 476 CB ACYS A 173 -36.482 5.149 18.743 0.50 28.47 C ATOM 477 CB BCYS A 173 -36.464 5.170 18.768 0.50 33.55 C ATOM 478 SG ACYS A 173 -36.296 6.740 17.925 0.50 24.63 S ATOM 479 SG BCYS A 173 -34.760 5.798 18.751 0.50 36.03 S ATOM 0 H ACYS A 173 -38.703 4.352 17.756 0.50 29.05 H new ATOM 0 H BCYS A 173 -38.705 4.341 17.755 0.50 29.05 H new ATOM 0 HA ACYS A 173 -36.111 4.128 16.994 0.50 31.49 H new ATOM 0 HA BCYS A 173 -36.100 4.169 17.005 0.50 31.49 H new ATOM 0 HB2ACYS A 173 -37.208 5.191 19.385 0.50 33.55 H new ATOM 0 HB2BCYS A 173 -37.072 5.911 18.619 0.50 33.55 H new ATOM 0 HB3ACYS A 173 -35.676 4.937 19.240 0.50 33.55 H new ATOM 0 HB3BCYS A 173 -36.658 4.817 19.650 0.50 33.55 H new ATOM 0 HG ACYS A 173 -36.080 7.589 18.745 0.50 36.03 H new ATOM 0 HG BCYS A 173 -34.636 6.642 19.595 0.50 36.03 H new ATOM 480 N ARG A 174 -35.377 2.166 18.337 1.00 26.17 N ATOM 481 CA ARG A 174 -35.106 0.853 18.943 1.00 28.28 C ATOM 482 C ARG A 174 -33.691 0.786 19.412 1.00 27.44 C ATOM 483 O ARG A 174 -32.888 1.586 18.985 1.00 26.06 O ATOM 484 CB ARG A 174 -35.421 -0.335 18.002 1.00 27.17 C ATOM 485 CG ARG A 174 -34.379 -0.691 16.966 1.00 25.85 C ATOM 486 CD ARG A 174 -34.978 -1.658 15.950 1.00 27.13 C ATOM 487 NE ARG A 174 -33.950 -2.173 15.046 1.00 27.16 N ATOM 488 CZ ARG A 174 -33.419 -1.485 14.024 1.00 28.21 C ATOM 489 NH1 ARG A 174 -33.847 -0.281 13.721 1.00 29.82 N ATOM 490 NH2 ARG A 174 -32.469 -2.020 13.295 1.00 27.35 N ATOM 0 H ARG A 174 -34.687 2.558 18.007 1.00 26.17 H new ATOM 0 HA ARG A 174 -35.707 0.767 19.699 1.00 28.28 H new ATOM 0 HB2 ARG A 174 -35.580 -1.119 18.551 1.00 27.17 H new ATOM 0 HB3 ARG A 174 -36.251 -0.140 17.539 1.00 27.17 H new ATOM 0 HG2 ARG A 174 -34.067 0.111 16.518 1.00 25.85 H new ATOM 0 HG3 ARG A 174 -33.608 -1.094 17.395 1.00 25.85 H new ATOM 0 HD2 ARG A 174 -35.405 -2.396 16.413 1.00 27.13 H new ATOM 0 HD3 ARG A 174 -35.668 -1.208 15.438 1.00 27.13 H new ATOM 0 HE ARG A 174 -33.666 -2.974 15.179 1.00 27.16 H new ATOM 0 HH11 ARG A 174 -34.478 0.079 14.181 1.00 29.82 H new ATOM 0 HH12 ARG A 174 -33.496 0.147 13.063 1.00 29.82 H new ATOM 0 HH21 ARG A 174 -32.186 -2.813 13.472 1.00 27.35 H new ATOM 0 HH22 ARG A 174 -32.129 -1.578 12.640 1.00 27.35 H new ATOM 491 N GLU A 175 -33.429 -0.171 20.299 1.00 25.53 N ATOM 492 CA GLU A 175 -32.111 -0.458 20.851 1.00 27.40 C ATOM 493 C GLU A 175 -31.425 -1.447 19.905 1.00 26.18 C ATOM 494 O GLU A 175 -32.038 -2.396 19.464 1.00 25.72 O ATOM 495 CB GLU A 175 -32.327 -1.103 22.208 1.00 33.00 C ATOM 496 CG GLU A 175 -31.215 -1.200 23.228 1.00 36.77 C ATOM 497 CD GLU A 175 -31.653 -2.072 24.470 1.00 41.89 C ATOM 498 OE1 GLU A 175 -32.866 -2.393 24.738 1.00 36.45 O ATOM 499 OE2 GLU A 175 -30.748 -2.464 25.216 1.00 53.12 O ATOM 0 H GLU A 175 -34.041 -0.691 20.607 1.00 25.53 H new ATOM 0 HA GLU A 175 -31.566 0.339 20.945 1.00 27.40 H new ATOM 0 HB2 GLU A 175 -33.057 -0.626 22.633 1.00 33.00 H new ATOM 0 HB3 GLU A 175 -32.637 -2.007 22.043 1.00 33.00 H new ATOM 0 HG2 GLU A 175 -30.428 -1.591 22.816 1.00 36.77 H new ATOM 0 HG3 GLU A 175 -30.967 -0.311 23.525 1.00 36.77 H new ATOM 500 N VAL A 176 -30.147 -1.273 19.621 1.00 23.81 N ATOM 501 CA VAL A 176 -29.404 -2.304 18.874 1.00 26.05 C ATOM 502 C VAL A 176 -28.042 -2.548 19.524 1.00 23.84 C ATOM 503 O VAL A 176 -27.446 -1.625 20.053 1.00 24.81 O ATOM 504 CB VAL A 176 -29.275 -1.859 17.355 1.00 29.05 C ATOM 505 CG1 VAL A 176 -28.173 -2.586 16.624 1.00 31.29 C ATOM 506 CG2 VAL A 176 -30.601 -2.038 16.594 1.00 29.61 C ATOM 0 H VAL A 176 -29.687 -0.581 19.842 1.00 23.81 H new ATOM 0 HA VAL A 176 -29.885 -3.146 18.899 1.00 26.05 H new ATOM 0 HB VAL A 176 -29.047 -0.916 17.379 1.00 29.05 H new ATOM 0 HG11 VAL A 176 -28.137 -2.279 15.705 1.00 31.29 H new ATOM 0 HG12 VAL A 176 -27.324 -2.407 17.058 1.00 31.29 H new ATOM 0 HG13 VAL A 176 -28.349 -3.540 16.639 1.00 31.29 H new ATOM 0 HG21 VAL A 176 -30.486 -1.757 15.673 1.00 29.61 H new ATOM 0 HG22 VAL A 176 -30.864 -2.971 16.617 1.00 29.61 H new ATOM 0 HG23 VAL A 176 -31.290 -1.498 17.012 1.00 29.61 H new ATOM 507 N THR A 177 -27.525 -3.782 19.428 1.00 24.93 N ATOM 508 CA THR A 177 -26.276 -4.158 20.088 1.00 23.82 C ATOM 509 C THR A 177 -25.353 -4.622 19.058 1.00 23.21 C ATOM 510 O THR A 177 -25.688 -5.489 18.277 1.00 21.84 O ATOM 511 CB THR A 177 -26.427 -5.260 21.140 1.00 25.61 C ATOM 512 OG1 THR A 177 -27.369 -4.822 22.116 1.00 31.77 O ATOM 513 CG2 THR A 177 -25.106 -5.552 21.811 1.00 26.96 C ATOM 0 H THR A 177 -27.891 -4.418 18.979 1.00 24.93 H new ATOM 0 HA THR A 177 -25.954 -3.374 20.560 1.00 23.82 H new ATOM 0 HB THR A 177 -26.732 -6.074 20.709 1.00 25.61 H new ATOM 0 HG1 THR A 177 -27.568 -5.463 22.621 1.00 31.77 H new ATOM 0 HG21 THR A 177 -25.226 -6.252 22.472 1.00 26.96 H new ATOM 0 HG22 THR A 177 -24.462 -5.843 21.146 1.00 26.96 H new ATOM 0 HG23 THR A 177 -24.780 -4.749 22.247 1.00 26.96 H new ATOM 514 N VAL A 178 -24.153 -4.052 19.079 1.00 25.59 N ATOM 515 CA VAL A 178 -23.166 -4.332 18.077 1.00 26.18 C ATOM 516 C VAL A 178 -21.797 -4.600 18.695 1.00 27.91 C ATOM 517 O VAL A 178 -21.319 -3.882 19.627 1.00 26.54 O ATOM 518 CB VAL A 178 -23.156 -3.197 17.018 1.00 26.18 C ATOM 519 CG1 VAL A 178 -22.711 -1.840 17.586 1.00 28.52 C ATOM 520 CG2 VAL A 178 -22.293 -3.590 15.849 1.00 27.61 C ATOM 0 H VAL A 178 -23.899 -3.493 19.681 1.00 25.59 H new ATOM 0 HA VAL A 178 -23.401 -5.152 17.616 1.00 26.18 H new ATOM 0 HB VAL A 178 -24.073 -3.080 16.723 1.00 26.18 H new ATOM 0 HG11 VAL A 178 -22.725 -1.174 16.881 1.00 28.52 H new ATOM 0 HG12 VAL A 178 -23.316 -1.572 18.296 1.00 28.52 H new ATOM 0 HG13 VAL A 178 -21.811 -1.917 17.940 1.00 28.52 H new ATOM 0 HG21 VAL A 178 -22.292 -2.876 15.193 1.00 27.61 H new ATOM 0 HG22 VAL A 178 -21.386 -3.748 16.155 1.00 27.61 H new ATOM 0 HG23 VAL A 178 -22.644 -4.399 15.445 1.00 27.61 H new ATOM 521 N THR A 179 -21.110 -5.598 18.147 1.00 26.48 N ATOM 522 CA THR A 179 -19.755 -5.776 18.560 1.00 27.29 C ATOM 523 C THR A 179 -18.843 -5.471 17.389 1.00 24.04 C ATOM 524 O THR A 179 -18.670 -6.320 16.579 1.00 24.25 O ATOM 525 CB THR A 179 -19.556 -7.185 19.175 1.00 29.48 C ATOM 526 OG1 THR A 179 -20.537 -7.348 20.172 1.00 26.53 O ATOM 527 CG2 THR A 179 -18.175 -7.353 19.814 1.00 28.86 C ATOM 0 H THR A 179 -21.406 -6.153 17.561 1.00 26.48 H new ATOM 0 HA THR A 179 -19.522 -5.155 19.268 1.00 27.29 H new ATOM 0 HB THR A 179 -19.631 -7.847 18.470 1.00 29.48 H new ATOM 0 HG1 THR A 179 -21.267 -7.563 19.815 1.00 26.53 H new ATOM 0 HG21 THR A 179 -18.096 -8.246 20.184 1.00 28.86 H new ATOM 0 HG22 THR A 179 -17.489 -7.220 19.141 1.00 28.86 H new ATOM 0 HG23 THR A 179 -18.064 -6.699 20.522 1.00 28.86 H new ATOM 528 N PRO A 180 -18.221 -4.265 17.353 1.00 24.09 N ATOM 529 CA PRO A 180 -17.203 -4.044 16.312 1.00 25.52 C ATOM 530 C PRO A 180 -16.082 -5.125 16.371 1.00 25.99 C ATOM 531 O PRO A 180 -15.742 -5.656 17.451 1.00 23.48 O ATOM 532 CB PRO A 180 -16.656 -2.624 16.616 1.00 26.27 C ATOM 533 CG PRO A 180 -17.608 -1.995 17.638 1.00 25.06 C ATOM 534 CD PRO A 180 -18.373 -3.105 18.276 1.00 23.98 C ATOM 0 HA PRO A 180 -17.566 -4.112 15.415 1.00 25.52 H new ATOM 0 HB2 PRO A 180 -15.754 -2.671 16.969 1.00 26.27 H new ATOM 0 HB3 PRO A 180 -16.617 -2.090 15.807 1.00 26.27 H new ATOM 0 HG2 PRO A 180 -17.112 -1.495 18.305 1.00 25.06 H new ATOM 0 HG3 PRO A 180 -18.210 -1.370 17.205 1.00 25.06 H new ATOM 0 HD2 PRO A 180 -18.023 -3.310 19.157 1.00 23.98 H new ATOM 0 HD3 PRO A 180 -19.307 -2.867 18.389 1.00 23.98 H new ATOM 535 N ASN A 181 -15.545 -5.464 15.199 1.00 26.06 N ATOM 536 CA ASN A 181 -14.592 -6.504 15.043 1.00 21.82 C ATOM 537 C ASN A 181 -13.877 -6.237 13.742 1.00 23.16 C ATOM 538 O ASN A 181 -14.348 -6.593 12.692 1.00 23.28 O ATOM 539 CB ASN A 181 -15.354 -7.821 15.058 1.00 25.22 C ATOM 540 CG ASN A 181 -14.489 -9.046 14.839 1.00 25.64 C ATOM 541 OD1 ASN A 181 -13.234 -8.969 14.806 1.00 29.89 O ATOM 542 ND2 ASN A 181 -15.168 -10.195 14.639 1.00 22.32 N ATOM 0 H ASN A 181 -15.745 -5.070 14.461 1.00 26.06 H new ATOM 0 HA ASN A 181 -13.928 -6.546 15.749 1.00 21.82 H new ATOM 0 HB2 ASN A 181 -15.810 -7.909 15.909 1.00 25.22 H new ATOM 0 HB3 ASN A 181 -16.038 -7.794 14.371 1.00 25.22 H new ATOM 0 HD21 ASN A 181 -14.741 -10.924 14.479 1.00 22.32 H new ATOM 0 HD22 ASN A 181 -16.027 -10.198 14.671 1.00 22.32 H new ATOM 543 N ALA A 182 -12.666 -5.701 13.832 1.00 22.12 N ATOM 544 CA ALA A 182 -11.821 -5.443 12.685 1.00 27.45 C ATOM 545 C ALA A 182 -11.481 -6.731 11.962 1.00 27.59 C ATOM 546 O ALA A 182 -11.237 -6.709 10.782 1.00 30.67 O ATOM 547 CB ALA A 182 -10.567 -4.699 13.112 1.00 27.46 C ATOM 0 H ALA A 182 -12.309 -5.474 14.580 1.00 22.12 H new ATOM 0 HA ALA A 182 -12.308 -4.881 12.062 1.00 27.45 H new ATOM 0 HB1 ALA A 182 -10.009 -4.532 12.336 1.00 27.46 H new ATOM 0 HB2 ALA A 182 -10.815 -3.854 13.519 1.00 27.46 H new ATOM 0 HB3 ALA A 182 -10.075 -5.235 13.754 1.00 27.46 H new ATOM 548 N ALA A 183 -11.581 -7.859 12.671 1.00 29.96 N ATOM 549 CA ALA A 183 -11.260 -9.164 12.114 1.00 29.17 C ATOM 550 C ALA A 183 -12.490 -9.890 11.622 1.00 28.84 C ATOM 551 O ALA A 183 -12.390 -11.068 11.381 1.00 28.07 O ATOM 552 CB ALA A 183 -10.547 -10.004 13.159 1.00 27.54 C ATOM 0 H ALA A 183 -11.838 -7.883 13.491 1.00 29.96 H new ATOM 0 HA ALA A 183 -10.680 -9.024 11.349 1.00 29.17 H new ATOM 0 HB1 ALA A 183 -10.334 -10.873 12.785 1.00 27.54 H new ATOM 0 HB2 ALA A 183 -9.728 -9.559 13.429 1.00 27.54 H new ATOM 0 HB3 ALA A 183 -11.123 -10.117 13.932 1.00 27.54 H new ATOM 553 N TRP A 184 -13.631 -9.221 11.409 1.00 26.71 N ATOM 554 CA TRP A 184 -14.793 -9.935 10.937 1.00 22.96 C ATOM 555 C TRP A 184 -14.585 -10.570 9.555 1.00 24.48 C ATOM 556 O TRP A 184 -15.314 -11.466 9.197 1.00 20.10 O ATOM 557 CB TRP A 184 -16.008 -9.024 10.971 1.00 27.36 C ATOM 558 CG TRP A 184 -16.130 -8.012 9.841 1.00 28.60 C ATOM 559 CD1 TRP A 184 -15.639 -6.727 9.810 1.00 29.68 C ATOM 560 CD2 TRP A 184 -16.839 -8.197 8.611 1.00 28.46 C ATOM 561 NE1 TRP A 184 -15.985 -6.117 8.625 1.00 31.33 N ATOM 562 CE2 TRP A 184 -16.714 -6.996 7.867 1.00 28.21 C ATOM 563 CE3 TRP A 184 -17.558 -9.263 8.058 1.00 30.55 C ATOM 564 CZ2 TRP A 184 -17.278 -6.837 6.590 1.00 30.52 C ATOM 565 CZ3 TRP A 184 -18.134 -9.108 6.760 1.00 29.63 C ATOM 566 CH2 TRP A 184 -17.971 -7.912 6.040 1.00 30.49 C ATOM 0 H TRP A 184 -13.740 -8.377 11.531 1.00 26.71 H new ATOM 0 HA TRP A 184 -14.947 -10.680 11.539 1.00 22.96 H new ATOM 0 HB2 TRP A 184 -16.804 -9.579 10.969 1.00 27.36 H new ATOM 0 HB3 TRP A 184 -16.002 -8.541 11.812 1.00 27.36 H new ATOM 0 HD1 TRP A 184 -15.145 -6.329 10.490 1.00 29.68 H new ATOM 0 HE1 TRP A 184 -15.777 -5.314 8.397 1.00 31.33 H new ATOM 0 HE3 TRP A 184 -17.659 -10.059 8.528 1.00 30.55 H new ATOM 0 HZ2 TRP A 184 -17.191 -6.036 6.125 1.00 30.52 H new ATOM 0 HZ3 TRP A 184 -18.622 -9.806 6.387 1.00 29.63 H new ATOM 0 HH2 TRP A 184 -18.331 -7.838 5.186 1.00 30.49 H new ATOM 567 N GLY A 185 -13.584 -10.119 8.784 1.00 23.83 N ATOM 568 CA GLY A 185 -13.316 -10.693 7.447 1.00 27.52 C ATOM 569 C GLY A 185 -13.298 -9.749 6.266 1.00 27.61 C ATOM 570 O GLY A 185 -12.530 -9.977 5.327 1.00 27.04 O ATOM 0 H GLY A 185 -13.050 -9.485 9.012 1.00 23.83 H new ATOM 0 HA2 GLY A 185 -12.457 -11.143 7.482 1.00 27.52 H new ATOM 0 HA3 GLY A 185 -13.986 -11.373 7.275 1.00 27.52 H new ATOM 571 N GLY A 186 -14.181 -8.746 6.310 1.00 28.48 N ATOM 572 CA GLY A 186 -14.161 -7.584 5.395 1.00 31.72 C ATOM 573 C GLY A 186 -13.526 -6.304 5.953 1.00 34.70 C ATOM 574 O GLY A 186 -12.701 -6.344 6.934 1.00 30.55 O ATOM 0 H GLY A 186 -14.823 -8.717 6.882 1.00 28.48 H new ATOM 0 HA2 GLY A 186 -13.684 -7.837 4.589 1.00 31.72 H new ATOM 0 HA3 GLY A 186 -15.073 -7.384 5.133 1.00 31.72 H new ATOM 575 N GLU A 187 -13.906 -5.190 5.298 1.00 32.30 N ATOM 576 CA GLU A 187 -13.414 -3.846 5.546 1.00 31.09 C ATOM 577 C GLU A 187 -14.009 -3.278 6.792 1.00 28.46 C ATOM 578 O GLU A 187 -15.157 -3.509 7.089 1.00 28.78 O ATOM 579 CB GLU A 187 -13.779 -2.866 4.429 1.00 38.99 C ATOM 580 CG GLU A 187 -12.866 -2.830 3.206 1.00 44.90 C ATOM 581 CD GLU A 187 -13.144 -1.612 2.250 1.00 58.89 C ATOM 582 OE1 GLU A 187 -14.047 -0.743 2.509 1.00 65.37 O ATOM 583 OE2 GLU A 187 -12.441 -1.518 1.207 1.00 58.30 O ATOM 0 H GLU A 187 -14.489 -5.214 4.666 1.00 32.30 H new ATOM 0 HA GLU A 187 -12.451 -3.940 5.611 1.00 31.09 H new ATOM 0 HB2 GLU A 187 -14.677 -3.075 4.128 1.00 38.99 H new ATOM 0 HB3 GLU A 187 -13.808 -1.974 4.809 1.00 38.99 H new ATOM 0 HG2 GLU A 187 -11.943 -2.796 3.502 1.00 44.90 H new ATOM 0 HG3 GLU A 187 -12.973 -3.655 2.707 1.00 44.90 H new ATOM 584 N GLY A 188 -13.200 -2.531 7.540 1.00 25.93 N ATOM 585 CA GLY A 188 -13.677 -1.871 8.756 1.00 25.30 C ATOM 586 C GLY A 188 -13.911 -2.804 9.920 1.00 24.31 C ATOM 587 O GLY A 188 -13.357 -3.953 9.933 1.00 21.61 O ATOM 0 H GLY A 188 -12.370 -2.393 7.361 1.00 25.93 H new ATOM 0 HA2 GLY A 188 -13.031 -1.197 9.020 1.00 25.30 H new ATOM 0 HA3 GLY A 188 -14.505 -1.407 8.556 1.00 25.30 H new ATOM 588 N SER A 189 -14.665 -2.258 10.895 1.00 20.16 N ATOM 589 CA SER A 189 -15.077 -2.941 12.129 1.00 21.38 C ATOM 590 C SER A 189 -16.587 -3.233 12.256 1.00 22.34 C ATOM 591 O SER A 189 -17.004 -4.076 13.020 1.00 19.35 O ATOM 592 CB SER A 189 -14.619 -2.111 13.333 1.00 23.27 C ATOM 593 OG SER A 189 -13.214 -2.271 13.497 1.00 22.97 O ATOM 0 H SER A 189 -14.958 -1.451 10.849 1.00 20.16 H new ATOM 0 HA SER A 189 -14.651 -3.812 12.099 1.00 21.38 H new ATOM 0 HB2 SER A 189 -14.836 -1.175 13.197 1.00 23.27 H new ATOM 0 HB3 SER A 189 -15.085 -2.397 14.134 1.00 23.27 H new ATOM 0 HG SER A 189 -13.046 -2.469 14.296 1.00 22.97 H new ATOM 594 N LEU A 190 -17.414 -2.482 11.536 1.00 24.13 N ATOM 595 CA LEU A 190 -18.847 -2.743 11.478 1.00 23.96 C ATOM 596 C LEU A 190 -19.216 -3.461 10.168 1.00 22.02 C ATOM 597 O LEU A 190 -20.139 -4.227 10.146 1.00 21.21 O ATOM 598 CB LEU A 190 -19.633 -1.448 11.571 1.00 24.84 C ATOM 599 CG LEU A 190 -19.638 -0.653 12.833 1.00 27.60 C ATOM 600 CD1 LEU A 190 -20.738 0.361 12.720 1.00 31.71 C ATOM 601 CD2 LEU A 190 -19.935 -1.527 14.020 1.00 28.80 C ATOM 0 H LEU A 190 -17.160 -1.807 11.068 1.00 24.13 H new ATOM 0 HA LEU A 190 -19.073 -3.311 12.231 1.00 23.96 H new ATOM 0 HB2 LEU A 190 -19.308 -0.865 10.867 1.00 24.84 H new ATOM 0 HB3 LEU A 190 -20.557 -1.658 11.362 1.00 24.84 H new ATOM 0 HG LEU A 190 -18.768 -0.242 12.957 1.00 27.60 H new ATOM 0 HD11 LEU A 190 -20.769 0.897 13.528 1.00 31.71 H new ATOM 0 HD12 LEU A 190 -20.571 0.936 11.957 1.00 31.71 H new ATOM 0 HD13 LEU A 190 -21.587 -0.094 12.602 1.00 31.71 H new ATOM 0 HD21 LEU A 190 -19.933 -0.989 14.827 1.00 28.80 H new ATOM 0 HD22 LEU A 190 -20.806 -1.939 13.909 1.00 28.80 H new ATOM 0 HD23 LEU A 190 -19.258 -2.218 14.091 1.00 28.80 H new ATOM 602 N GLY A 191 -18.512 -3.202 9.099 1.00 22.46 N ATOM 603 CA GLY A 191 -18.900 -3.703 7.772 1.00 26.15 C ATOM 604 C GLY A 191 -20.141 -2.999 7.175 1.00 27.23 C ATOM 605 O GLY A 191 -20.821 -3.580 6.324 1.00 27.92 O ATOM 0 H GLY A 191 -17.792 -2.732 9.103 1.00 22.46 H new ATOM 0 HA2 GLY A 191 -18.153 -3.593 7.163 1.00 26.15 H new ATOM 0 HA3 GLY A 191 -19.078 -4.655 7.834 1.00 26.15 H new ATOM 606 N CYS A 192 -20.437 -1.777 7.615 1.00 24.72 N ATOM 607 CA CYS A 192 -21.286 -0.902 6.847 1.00 27.34 C ATOM 608 C CYS A 192 -20.657 0.435 6.365 1.00 28.20 C ATOM 609 O CYS A 192 -19.642 0.938 6.905 1.00 27.33 O ATOM 610 CB CYS A 192 -22.539 -0.623 7.629 1.00 29.68 C ATOM 611 SG CYS A 192 -22.372 0.202 9.240 1.00 32.50 S ATOM 0 H CYS A 192 -20.152 -1.445 8.355 1.00 24.72 H new ATOM 0 HA CYS A 192 -21.463 -1.387 6.026 1.00 27.34 H new ATOM 0 HB2 CYS A 192 -23.120 -0.079 7.075 1.00 29.68 H new ATOM 0 HB3 CYS A 192 -22.994 -1.468 7.773 1.00 29.68 H new ATOM 0 HG CYS A 192 -23.458 0.351 9.728 1.00 32.50 H new ATOM 612 N GLY A 193 -21.276 0.993 5.331 1.00 22.79 N ATOM 613 CA GLY A 193 -21.159 2.416 5.062 1.00 22.56 C ATOM 614 C GLY A 193 -22.025 3.272 6.028 1.00 21.36 C ATOM 615 O GLY A 193 -23.077 2.859 6.486 1.00 19.47 O ATOM 0 H GLY A 193 -21.769 0.562 4.773 1.00 22.79 H new ATOM 0 HA2 GLY A 193 -20.230 2.683 5.142 1.00 22.56 H new ATOM 0 HA3 GLY A 193 -21.428 2.593 4.147 1.00 22.56 H new ATOM 616 N ILE A 194 -21.562 4.482 6.266 1.00 20.22 N ATOM 617 CA ILE A 194 -22.204 5.485 7.098 1.00 19.57 C ATOM 618 C ILE A 194 -22.182 6.854 6.424 1.00 18.78 C ATOM 619 O ILE A 194 -21.158 7.253 5.876 1.00 17.53 O ATOM 620 CB ILE A 194 -21.451 5.609 8.436 1.00 22.52 C ATOM 621 CG1 ILE A 194 -21.564 4.295 9.230 1.00 26.55 C ATOM 622 CG2 ILE A 194 -21.999 6.740 9.276 1.00 23.60 C ATOM 623 CD1 ILE A 194 -22.960 3.937 9.794 1.00 25.50 C ATOM 0 H ILE A 194 -20.821 4.760 5.928 1.00 20.22 H new ATOM 0 HA ILE A 194 -23.122 5.206 7.240 1.00 19.57 H new ATOM 0 HB ILE A 194 -20.521 5.796 8.232 1.00 22.52 H new ATOM 0 HG12 ILE A 194 -21.275 3.569 8.655 1.00 26.55 H new ATOM 0 HG13 ILE A 194 -20.940 4.335 9.971 1.00 26.55 H new ATOM 0 HG21 ILE A 194 -21.506 6.793 10.110 1.00 23.60 H new ATOM 0 HG22 ILE A 194 -21.907 7.576 8.793 1.00 23.60 H new ATOM 0 HG23 ILE A 194 -22.937 6.578 9.465 1.00 23.60 H new ATOM 0 HD11 ILE A 194 -22.910 3.094 10.272 1.00 25.50 H new ATOM 0 HD12 ILE A 194 -23.253 4.635 10.400 1.00 25.50 H new ATOM 0 HD13 ILE A 194 -23.593 3.857 9.064 1.00 25.50 H new ATOM 624 N GLY A 195 -23.306 7.568 6.474 1.00 17.03 N ATOM 625 CA GLY A 195 -23.397 8.924 6.017 1.00 18.95 C ATOM 626 C GLY A 195 -23.772 9.908 7.102 1.00 18.05 C ATOM 627 O GLY A 195 -24.345 9.525 8.088 1.00 17.30 O ATOM 0 H GLY A 195 -24.046 7.258 6.784 1.00 17.03 H new ATOM 0 HA2 GLY A 195 -22.545 9.186 5.635 1.00 18.95 H new ATOM 0 HA3 GLY A 195 -24.054 8.974 5.305 1.00 18.95 H new ATOM 628 N TYR A 196 -23.424 11.163 6.878 1.00 15.41 N ATOM 629 CA TYR A 196 -23.663 12.207 7.830 1.00 17.51 C ATOM 630 C TYR A 196 -25.012 12.841 7.583 1.00 15.21 C ATOM 631 O TYR A 196 -25.243 13.388 6.516 1.00 13.44 O ATOM 632 CB TYR A 196 -22.558 13.289 7.758 1.00 21.56 C ATOM 633 CG TYR A 196 -22.525 14.193 8.995 1.00 27.33 C ATOM 634 CD1 TYR A 196 -22.117 13.714 10.209 1.00 33.96 C ATOM 635 CD2 TYR A 196 -22.898 15.509 8.926 1.00 29.80 C ATOM 636 CE1 TYR A 196 -22.083 14.534 11.326 1.00 40.38 C ATOM 637 CE2 TYR A 196 -22.860 16.343 10.026 1.00 33.42 C ATOM 638 CZ TYR A 196 -22.467 15.859 11.218 1.00 39.00 C ATOM 639 OH TYR A 196 -22.475 16.704 12.276 1.00 44.72 O ATOM 0 H TYR A 196 -23.038 11.428 6.157 1.00 15.41 H new ATOM 0 HA TYR A 196 -23.651 11.812 8.716 1.00 17.51 H new ATOM 0 HB2 TYR A 196 -21.695 12.857 7.656 1.00 21.56 H new ATOM 0 HB3 TYR A 196 -22.697 13.835 6.968 1.00 21.56 H new ATOM 0 HD1 TYR A 196 -21.858 12.824 10.286 1.00 33.96 H new ATOM 0 HD2 TYR A 196 -23.186 15.852 8.111 1.00 29.80 H new ATOM 0 HE1 TYR A 196 -21.803 14.195 12.145 1.00 40.38 H new ATOM 0 HE2 TYR A 196 -23.105 17.236 9.943 1.00 33.42 H new ATOM 0 HH TYR A 196 -22.734 17.463 12.026 1.00 44.72 H new ATOM 640 N GLY A 197 -25.898 12.738 8.579 1.00 15.99 N ATOM 641 CA GLY A 197 -27.249 13.205 8.518 1.00 15.79 C ATOM 642 C GLY A 197 -28.139 12.301 7.686 1.00 16.79 C ATOM 643 O GLY A 197 -28.841 11.469 8.208 1.00 16.56 O ATOM 0 H GLY A 197 -25.702 12.376 9.334 1.00 15.99 H new ATOM 0 HA2 GLY A 197 -27.607 13.268 9.417 1.00 15.79 H new ATOM 0 HA3 GLY A 197 -27.262 14.100 8.144 1.00 15.79 H new ATOM 644 N TYR A 198 -28.034 12.475 6.358 1.00 15.74 N ATOM 645 CA TYR A 198 -28.913 11.808 5.416 1.00 16.27 C ATOM 646 C TYR A 198 -28.288 11.915 4.072 1.00 14.67 C ATOM 647 O TYR A 198 -27.908 12.995 3.668 1.00 16.85 O ATOM 648 CB TYR A 198 -30.304 12.479 5.397 1.00 15.26 C ATOM 649 CG TYR A 198 -31.231 11.940 4.291 1.00 14.35 C ATOM 650 CD1 TYR A 198 -32.014 10.785 4.501 1.00 13.25 C ATOM 651 CD2 TYR A 198 -31.331 12.584 3.072 1.00 14.87 C ATOM 652 CE1 TYR A 198 -32.792 10.254 3.522 1.00 13.96 C ATOM 653 CE2 TYR A 198 -32.166 12.080 2.061 1.00 15.17 C ATOM 654 CZ TYR A 198 -32.911 10.932 2.312 1.00 15.24 C ATOM 655 OH TYR A 198 -33.699 10.454 1.329 1.00 14.80 O ATOM 0 H TYR A 198 -27.448 12.985 5.990 1.00 15.74 H new ATOM 0 HA TYR A 198 -29.034 10.880 5.673 1.00 16.27 H new ATOM 0 HB2 TYR A 198 -30.730 12.348 6.259 1.00 15.26 H new ATOM 0 HB3 TYR A 198 -30.192 13.435 5.278 1.00 15.26 H new ATOM 0 HD1 TYR A 198 -31.997 10.375 5.335 1.00 13.25 H new ATOM 0 HD2 TYR A 198 -30.840 13.359 2.920 1.00 14.87 H new ATOM 0 HE1 TYR A 198 -33.238 9.450 3.658 1.00 13.96 H new ATOM 0 HE2 TYR A 198 -32.220 12.507 1.237 1.00 15.17 H new ATOM 0 HH TYR A 198 -33.377 10.667 0.583 1.00 14.80 H new ATOM 656 N LEU A 199 -28.180 10.807 3.373 1.00 15.66 N ATOM 657 CA LEU A 199 -27.805 10.772 1.941 1.00 16.25 C ATOM 658 C LEU A 199 -28.988 10.298 1.149 1.00 16.28 C ATOM 659 O LEU A 199 -29.572 9.321 1.519 1.00 13.81 O ATOM 660 CB LEU A 199 -26.624 9.826 1.697 1.00 15.15 C ATOM 661 CG LEU A 199 -25.413 10.089 2.550 1.00 14.92 C ATOM 662 CD1 LEU A 199 -24.370 9.086 2.180 1.00 14.95 C ATOM 663 CD2 LEU A 199 -24.840 11.455 2.291 1.00 14.83 C ATOM 0 H LEU A 199 -28.322 10.028 3.708 1.00 15.66 H new ATOM 0 HA LEU A 199 -27.539 11.664 1.666 1.00 16.25 H new ATOM 0 HB2 LEU A 199 -26.920 8.915 1.851 1.00 15.15 H new ATOM 0 HB3 LEU A 199 -26.365 9.887 0.764 1.00 15.15 H new ATOM 0 HG LEU A 199 -25.672 10.030 3.483 1.00 14.92 H new ATOM 0 HD11 LEU A 199 -23.575 9.233 2.716 1.00 14.95 H new ATOM 0 HD12 LEU A 199 -24.709 8.192 2.342 1.00 14.95 H new ATOM 0 HD13 LEU A 199 -24.148 9.182 1.241 1.00 14.95 H new ATOM 0 HD21 LEU A 199 -24.063 11.592 2.855 1.00 14.83 H new ATOM 0 HD22 LEU A 199 -24.579 11.525 1.359 1.00 14.83 H new ATOM 0 HD23 LEU A 199 -25.508 12.130 2.491 1.00 14.83 H new ATOM 664 N HIS A 200 -29.308 10.952 0.034 1.00 18.11 N ATOM 665 CA HIS A 200 -30.515 10.642 -0.690 1.00 19.37 C ATOM 666 C HIS A 200 -30.399 9.498 -1.690 1.00 17.65 C ATOM 667 O HIS A 200 -29.941 9.665 -2.766 1.00 18.05 O ATOM 668 CB HIS A 200 -31.077 11.915 -1.392 1.00 20.68 C ATOM 669 CG HIS A 200 -32.484 11.727 -1.875 1.00 21.79 C ATOM 670 ND1 HIS A 200 -33.505 11.383 -1.024 1.00 23.82 N ATOM 671 CD2 HIS A 200 -33.035 11.808 -3.111 1.00 22.50 C ATOM 672 CE1 HIS A 200 -34.624 11.262 -1.720 1.00 26.52 C ATOM 673 NE2 HIS A 200 -34.364 11.536 -2.984 1.00 21.12 N ATOM 0 H HIS A 200 -28.832 11.579 -0.313 1.00 18.11 H new ATOM 0 HA HIS A 200 -31.134 10.327 -0.013 1.00 19.37 H new ATOM 0 HB2 HIS A 200 -31.047 12.662 -0.774 1.00 20.68 H new ATOM 0 HB3 HIS A 200 -30.508 12.145 -2.143 1.00 20.68 H new ATOM 0 HD2 HIS A 200 -32.588 12.012 -3.901 1.00 22.50 H new ATOM 0 HE1 HIS A 200 -35.454 11.024 -1.376 1.00 26.52 H new ATOM 0 HE2 HIS A 200 -34.939 11.542 -3.623 1.00 21.12 H new ATOM 674 N ARG A 201 -30.929 8.347 -1.357 1.00 20.12 N ATOM 675 CA ARG A 201 -30.853 7.145 -2.191 1.00 22.47 C ATOM 676 C ARG A 201 -32.103 6.964 -3.029 1.00 23.96 C ATOM 677 O ARG A 201 -33.153 7.092 -2.503 1.00 28.70 O ATOM 678 CB ARG A 201 -30.651 5.935 -1.329 1.00 24.63 C ATOM 679 CG ARG A 201 -30.755 4.663 -2.087 1.00 27.05 C ATOM 680 CD ARG A 201 -30.767 3.595 -1.070 1.00 29.67 C ATOM 681 NE ARG A 201 -30.629 2.283 -1.675 1.00 28.56 N ATOM 682 CZ ARG A 201 -31.637 1.504 -2.018 1.00 26.24 C ATOM 683 NH1 ARG A 201 -32.863 1.901 -1.904 1.00 30.43 N ATOM 684 NH2 ARG A 201 -31.397 0.346 -2.559 1.00 26.11 N ATOM 0 H ARG A 201 -31.358 8.226 -0.621 1.00 20.12 H new ATOM 0 HA ARG A 201 -30.099 7.253 -2.792 1.00 22.47 H new ATOM 0 HB2 ARG A 201 -29.778 5.985 -0.908 1.00 24.63 H new ATOM 0 HB3 ARG A 201 -31.310 5.937 -0.617 1.00 24.63 H new ATOM 0 HG2 ARG A 201 -31.562 4.642 -2.624 1.00 27.05 H new ATOM 0 HG3 ARG A 201 -30.007 4.557 -2.695 1.00 27.05 H new ATOM 0 HD2 ARG A 201 -30.044 3.739 -0.439 1.00 29.67 H new ATOM 0 HD3 ARG A 201 -31.595 3.635 -0.567 1.00 29.67 H new ATOM 0 HE ARG A 201 -29.833 1.992 -1.820 1.00 28.56 H new ATOM 0 HH11 ARG A 201 -33.034 2.687 -1.599 1.00 30.43 H new ATOM 0 HH12 ARG A 201 -33.507 1.379 -2.133 1.00 30.43 H new ATOM 0 HH21 ARG A 201 -30.586 0.093 -2.691 1.00 26.11 H new ATOM 0 HH22 ARG A 201 -32.050 -0.167 -2.785 1.00 26.11 H new ATOM 685 N ILE A 202 -31.984 6.733 -4.334 1.00 22.80 N ATOM 686 CA ILE A 202 -33.106 6.533 -5.207 1.00 25.88 C ATOM 687 C ILE A 202 -33.130 5.028 -5.499 1.00 26.64 C ATOM 688 O ILE A 202 -32.137 4.490 -6.022 1.00 26.18 O ATOM 689 CB ILE A 202 -32.930 7.322 -6.539 1.00 30.81 C ATOM 690 CG1 ILE A 202 -32.687 8.791 -6.246 1.00 30.96 C ATOM 691 CG2 ILE A 202 -34.148 7.210 -7.447 1.00 29.66 C ATOM 692 CD1 ILE A 202 -31.831 9.428 -7.279 1.00 32.17 C ATOM 0 H ILE A 202 -31.224 6.689 -4.735 1.00 22.80 H new ATOM 0 HA ILE A 202 -33.928 6.847 -4.798 1.00 25.88 H new ATOM 0 HB ILE A 202 -32.169 6.930 -6.996 1.00 30.81 H new ATOM 0 HG12 ILE A 202 -33.537 9.256 -6.199 1.00 30.96 H new ATOM 0 HG13 ILE A 202 -32.266 8.882 -5.377 1.00 30.96 H new ATOM 0 HG21 ILE A 202 -33.993 7.715 -8.261 1.00 29.66 H new ATOM 0 HG22 ILE A 202 -34.301 6.278 -7.670 1.00 29.66 H new ATOM 0 HG23 ILE A 202 -34.926 7.565 -6.990 1.00 29.66 H new ATOM 0 HD11 ILE A 202 -31.699 10.363 -7.058 1.00 32.17 H new ATOM 0 HD12 ILE A 202 -30.972 8.979 -7.310 1.00 32.17 H new ATOM 0 HD13 ILE A 202 -32.263 9.359 -8.145 1.00 32.17 H new ATOM 693 N PRO A 203 -34.212 4.327 -5.116 1.00 28.63 N ATOM 694 CA PRO A 203 -34.301 2.911 -5.431 1.00 31.99 C ATOM 695 C PRO A 203 -34.494 2.797 -6.931 1.00 32.62 C ATOM 696 O PRO A 203 -35.282 3.519 -7.468 1.00 34.39 O ATOM 697 CB PRO A 203 -35.577 2.434 -4.696 1.00 31.77 C ATOM 698 CG PRO A 203 -36.064 3.617 -3.903 1.00 33.02 C ATOM 699 CD PRO A 203 -35.481 4.829 -4.552 1.00 31.69 C ATOM 0 HA PRO A 203 -33.522 2.394 -5.171 1.00 31.99 H new ATOM 0 HB2 PRO A 203 -36.251 2.138 -5.327 1.00 31.77 H new ATOM 0 HB3 PRO A 203 -35.383 1.682 -4.115 1.00 31.77 H new ATOM 0 HG2 PRO A 203 -37.033 3.658 -3.903 1.00 33.02 H new ATOM 0 HG3 PRO A 203 -35.783 3.552 -2.977 1.00 33.02 H new ATOM 0 HD2 PRO A 203 -36.065 5.183 -5.241 1.00 31.69 H new ATOM 0 HD3 PRO A 203 -35.332 5.542 -3.912 1.00 31.69 H new ATOM 700 N THR A 204 -33.728 1.939 -7.585 1.00 36.09 N ATOM 701 CA THR A 204 -33.768 1.792 -9.029 1.00 38.90 C ATOM 702 C THR A 204 -33.862 0.307 -9.406 1.00 38.77 C ATOM 703 O THR A 204 -33.585 -0.584 -8.593 1.00 31.15 O ATOM 704 CB THR A 204 -32.537 2.492 -9.618 1.00 44.66 C ATOM 705 OG1 THR A 204 -32.547 3.866 -9.188 1.00 47.05 O ATOM 706 CG2 THR A 204 -32.514 2.440 -11.138 1.00 46.68 C ATOM 707 OXT THR A 204 -34.253 -0.036 -10.550 1.00 39.83 O ATOM 0 H THR A 204 -33.163 1.419 -7.198 1.00 36.09 H new ATOM 0 HA THR A 204 -34.558 2.213 -9.404 1.00 38.90 H new ATOM 0 HB THR A 204 -31.745 2.030 -9.302 1.00 44.66 H new ATOM 0 HG1 THR A 204 -31.877 4.263 -9.502 1.00 47.05 H new ATOM 0 HG21 THR A 204 -31.721 2.893 -11.466 1.00 46.68 H new ATOM 0 HG22 THR A 204 -32.501 1.515 -11.430 1.00 46.68 H new ATOM 0 HG23 THR A 204 -33.305 2.879 -11.489 1.00 46.68 H new TER 708 THR A 204 ATOM 709 N GLU B 110 -33.865 -30.073 8.081 1.00 77.20 N ATOM 710 CA GLU B 110 -34.281 -30.249 6.653 1.00 72.40 C ATOM 711 C GLU B 110 -35.575 -29.516 6.294 1.00 65.71 C ATOM 712 O GLU B 110 -36.023 -29.665 5.170 1.00 66.48 O ATOM 713 CB GLU B 110 -34.449 -31.740 6.293 1.00 80.45 C ATOM 714 CG GLU B 110 -33.145 -32.520 6.120 1.00 90.14 C ATOM 715 CD GLU B 110 -32.465 -32.887 7.436 1.00 96.37 C ATOM 716 OE1 GLU B 110 -31.254 -33.209 7.416 1.00 91.87 O ATOM 717 OE2 GLU B 110 -33.131 -32.837 8.500 1.00 99.61 O ATOM 0 HA GLU B 110 -33.561 -29.856 6.136 1.00 72.40 H new ATOM 0 HB2 GLU B 110 -34.975 -32.168 6.986 1.00 80.45 H new ATOM 0 HB3 GLU B 110 -34.959 -31.804 5.470 1.00 80.45 H new ATOM 0 HG2 GLU B 110 -33.328 -33.333 5.623 1.00 90.14 H new ATOM 0 HG3 GLU B 110 -32.531 -31.992 5.585 1.00 90.14 H new ATOM 718 N GLN B 111 -36.173 -28.740 7.212 1.00 55.19 N ATOM 719 CA GLN B 111 -37.434 -28.019 6.939 1.00 50.59 C ATOM 720 C GLN B 111 -37.273 -26.700 6.188 1.00 41.34 C ATOM 721 O GLN B 111 -36.232 -26.081 6.207 1.00 40.38 O ATOM 722 CB GLN B 111 -38.213 -27.788 8.229 1.00 59.02 C ATOM 723 CG GLN B 111 -37.687 -26.682 9.145 1.00 64.88 C ATOM 724 CD GLN B 111 -38.039 -26.913 10.623 1.00 77.16 C ATOM 725 OE1 GLN B 111 -38.107 -28.077 11.098 1.00 78.67 O ATOM 726 NE2 GLN B 111 -38.266 -25.806 11.363 1.00 70.92 N ATOM 0 H GLN B 111 -35.863 -28.616 8.005 1.00 55.19 H new ATOM 0 HA GLN B 111 -37.929 -28.603 6.343 1.00 50.59 H new ATOM 0 HB2 GLN B 111 -39.132 -27.581 7.998 1.00 59.02 H new ATOM 0 HB3 GLN B 111 -38.227 -28.618 8.730 1.00 59.02 H new ATOM 0 HG2 GLN B 111 -36.723 -26.622 9.052 1.00 64.88 H new ATOM 0 HG3 GLN B 111 -38.053 -25.830 8.859 1.00 64.88 H new ATOM 0 HE21 GLN B 111 -38.210 -25.028 11.001 1.00 70.92 H new ATOM 0 HE22 GLN B 111 -38.467 -25.879 12.196 1.00 70.92 H new ATOM 727 N VAL B 112 -38.322 -26.270 5.508 1.00 36.55 N ATOM 728 CA VAL B 112 -38.259 -25.087 4.647 1.00 32.28 C ATOM 729 C VAL B 112 -39.552 -24.326 4.780 1.00 26.47 C ATOM 730 O VAL B 112 -40.618 -24.922 4.794 1.00 26.73 O ATOM 731 CB VAL B 112 -37.986 -25.513 3.189 1.00 32.28 C ATOM 732 CG1 VAL B 112 -38.211 -24.382 2.201 1.00 30.58 C ATOM 733 CG2 VAL B 112 -36.567 -26.064 3.087 1.00 32.82 C ATOM 0 H VAL B 112 -39.093 -26.651 5.528 1.00 36.55 H new ATOM 0 HA VAL B 112 -37.531 -24.506 4.917 1.00 32.28 H new ATOM 0 HB VAL B 112 -38.621 -26.206 2.950 1.00 32.28 H new ATOM 0 HG11 VAL B 112 -38.028 -24.696 1.302 1.00 30.58 H new ATOM 0 HG12 VAL B 112 -39.132 -24.082 2.257 1.00 30.58 H new ATOM 0 HG13 VAL B 112 -37.618 -23.644 2.412 1.00 30.58 H new ATOM 0 HG21 VAL B 112 -36.389 -26.334 2.172 1.00 32.82 H new ATOM 0 HG22 VAL B 112 -35.934 -25.378 3.350 1.00 32.82 H new ATOM 0 HG23 VAL B 112 -36.475 -26.831 3.673 1.00 32.82 H new ATOM 734 N TRP B 113 -39.451 -23.015 4.957 1.00 22.36 N ATOM 735 CA TRP B 113 -40.609 -22.166 4.999 1.00 22.31 C ATOM 736 C TRP B 113 -40.743 -21.191 3.822 1.00 20.74 C ATOM 737 O TRP B 113 -39.818 -20.374 3.531 1.00 20.12 O ATOM 738 CB TRP B 113 -40.633 -21.437 6.338 1.00 24.85 C ATOM 739 CG TRP B 113 -40.651 -22.345 7.508 1.00 28.78 C ATOM 740 CD1 TRP B 113 -39.574 -22.826 8.180 1.00 32.78 C ATOM 741 CD2 TRP B 113 -41.809 -22.906 8.139 1.00 32.56 C ATOM 742 NE1 TRP B 113 -39.997 -23.645 9.200 1.00 37.85 N ATOM 743 CE2 TRP B 113 -41.361 -23.706 9.195 1.00 35.74 C ATOM 744 CE3 TRP B 113 -43.178 -22.813 7.897 1.00 35.96 C ATOM 745 CZ2 TRP B 113 -42.229 -24.418 10.029 1.00 41.87 C ATOM 746 CZ3 TRP B 113 -44.043 -23.495 8.716 1.00 42.20 C ATOM 747 CH2 TRP B 113 -43.564 -24.295 9.790 1.00 40.62 C ATOM 0 H TRP B 113 -38.704 -22.601 5.055 1.00 22.36 H new ATOM 0 HA TRP B 113 -41.384 -22.742 4.909 1.00 22.31 H new ATOM 0 HB2 TRP B 113 -39.855 -20.860 6.398 1.00 24.85 H new ATOM 0 HB3 TRP B 113 -41.415 -20.863 6.371 1.00 24.85 H new ATOM 0 HD1 TRP B 113 -38.687 -22.631 7.981 1.00 32.78 H new ATOM 0 HE1 TRP B 113 -39.483 -24.055 9.754 1.00 37.85 H new ATOM 0 HE3 TRP B 113 -43.500 -22.298 7.193 1.00 35.96 H new ATOM 0 HZ2 TRP B 113 -41.908 -24.953 10.718 1.00 41.87 H new ATOM 0 HZ3 TRP B 113 -44.959 -23.433 8.566 1.00 42.20 H new ATOM 0 HH2 TRP B 113 -44.171 -24.740 10.336 1.00 40.62 H new ATOM 748 N HIS B 114 -41.922 -21.205 3.208 1.00 17.20 N ATOM 749 CA HIS B 114 -42.218 -20.437 2.007 1.00 17.31 C ATOM 750 C HIS B 114 -42.749 -19.068 2.444 1.00 17.99 C ATOM 751 O HIS B 114 -43.768 -19.007 3.128 1.00 17.43 O ATOM 752 CB HIS B 114 -43.237 -21.182 1.146 1.00 16.76 C ATOM 753 CG HIS B 114 -43.578 -20.534 -0.172 1.00 17.95 C ATOM 754 ND1 HIS B 114 -44.719 -20.863 -0.892 1.00 17.17 N ATOM 755 CD2 HIS B 114 -42.888 -19.661 -0.953 1.00 17.03 C ATOM 756 CE1 HIS B 114 -44.766 -20.120 -1.993 1.00 18.19 C ATOM 757 NE2 HIS B 114 -43.632 -19.437 -2.086 1.00 16.64 N ATOM 0 H HIS B 114 -42.587 -21.673 3.486 1.00 17.20 H new ATOM 0 HA HIS B 114 -41.420 -20.317 1.469 1.00 17.31 H new ATOM 0 HB2 HIS B 114 -42.897 -22.074 0.971 1.00 16.76 H new ATOM 0 HB3 HIS B 114 -44.054 -21.285 1.658 1.00 16.76 H new ATOM 0 HD2 HIS B 114 -42.061 -19.283 -0.756 1.00 17.03 H new ATOM 0 HE1 HIS B 114 -45.473 -20.085 -2.596 1.00 18.19 H new ATOM 0 HE2 HIS B 114 -43.401 -18.937 -2.746 1.00 16.64 H new ATOM 758 N VAL B 115 -42.042 -17.980 2.059 1.00 18.42 N ATOM 759 CA VAL B 115 -42.499 -16.607 2.338 1.00 21.25 C ATOM 760 C VAL B 115 -43.569 -16.165 1.345 1.00 19.57 C ATOM 761 O VAL B 115 -43.388 -16.255 0.128 1.00 21.22 O ATOM 762 CB VAL B 115 -41.340 -15.578 2.270 1.00 22.71 C ATOM 763 CG1 VAL B 115 -41.865 -14.167 2.614 1.00 22.14 C ATOM 764 CG2 VAL B 115 -40.199 -16.035 3.131 1.00 22.44 C ATOM 0 H VAL B 115 -41.295 -18.023 1.635 1.00 18.42 H new ATOM 0 HA VAL B 115 -42.861 -16.629 3.238 1.00 21.25 H new ATOM 0 HB VAL B 115 -40.989 -15.520 1.368 1.00 22.71 H new ATOM 0 HG11 VAL B 115 -41.135 -13.530 2.569 1.00 22.14 H new ATOM 0 HG12 VAL B 115 -42.554 -13.914 1.979 1.00 22.14 H new ATOM 0 HG13 VAL B 115 -42.237 -14.169 3.510 1.00 22.14 H new ATOM 0 HG21 VAL B 115 -39.478 -15.388 3.084 1.00 22.44 H new ATOM 0 HG22 VAL B 115 -40.499 -16.118 4.050 1.00 22.44 H new ATOM 0 HG23 VAL B 115 -39.881 -16.896 2.817 1.00 22.44 H new ATOM 765 N LEU B 116 -44.689 -15.732 1.865 1.00 21.29 N ATOM 766 CA LEU B 116 -45.844 -15.432 1.068 1.00 25.14 C ATOM 767 C LEU B 116 -45.985 -13.926 0.925 1.00 23.85 C ATOM 768 O LEU B 116 -45.067 -13.335 0.443 1.00 27.28 O ATOM 769 CB LEU B 116 -47.107 -16.083 1.665 1.00 26.54 C ATOM 770 CG LEU B 116 -46.963 -17.601 1.840 1.00 26.35 C ATOM 771 CD1 LEU B 116 -48.151 -18.081 2.622 1.00 26.79 C ATOM 772 CD2 LEU B 116 -46.899 -18.394 0.557 1.00 26.80 C ATOM 0 H LEU B 116 -44.802 -15.602 2.708 1.00 21.29 H new ATOM 0 HA LEU B 116 -45.732 -15.808 0.181 1.00 25.14 H new ATOM 0 HB2 LEU B 116 -47.299 -15.679 2.525 1.00 26.54 H new ATOM 0 HB3 LEU B 116 -47.865 -15.898 1.089 1.00 26.54 H new ATOM 0 HG LEU B 116 -46.114 -17.746 2.286 1.00 26.35 H new ATOM 0 HD11 LEU B 116 -48.089 -19.041 2.749 1.00 26.79 H new ATOM 0 HD12 LEU B 116 -48.169 -17.641 3.486 1.00 26.79 H new ATOM 0 HD13 LEU B 116 -48.964 -17.872 2.136 1.00 26.79 H new ATOM 0 HD21 LEU B 116 -46.809 -19.337 0.764 1.00 26.80 H new ATOM 0 HD22 LEU B 116 -47.712 -18.251 0.047 1.00 26.80 H new ATOM 0 HD23 LEU B 116 -46.135 -18.103 0.034 1.00 26.80 H new ATOM 773 N ASP B 117 -47.144 -13.349 1.249 1.00 24.08 N ATOM 774 CA ASP B 117 -47.365 -11.934 1.236 1.00 25.51 C ATOM 775 C ASP B 117 -46.409 -11.289 2.216 1.00 30.04 C ATOM 776 O ASP B 117 -46.134 -11.936 3.256 1.00 31.88 O ATOM 777 CB ASP B 117 -48.800 -11.573 1.654 1.00 28.21 C ATOM 778 CG ASP B 117 -49.324 -12.347 2.892 1.00 35.67 C ATOM 779 OD1 ASP B 117 -49.251 -13.609 2.924 1.00 36.96 O ATOM 780 OD2 ASP B 117 -49.893 -11.684 3.799 1.00 33.26 O ATOM 0 H ASP B 117 -47.837 -13.799 1.488 1.00 24.08 H new ATOM 0 HA ASP B 117 -47.221 -11.615 0.331 1.00 25.51 H new ATOM 0 HB2 ASP B 117 -48.841 -10.622 1.840 1.00 28.21 H new ATOM 0 HB3 ASP B 117 -49.394 -11.741 0.906 1.00 28.21 H new ATOM 781 N VAL B 118 -45.890 -10.084 1.917 1.00 27.13 N ATOM 782 CA VAL B 118 -44.951 -9.347 2.833 1.00 29.92 C ATOM 783 C VAL B 118 -45.443 -7.916 2.891 1.00 35.11 C ATOM 784 O VAL B 118 -45.230 -7.182 1.922 1.00 41.59 O ATOM 785 CB VAL B 118 -43.488 -9.372 2.310 1.00 32.73 C ATOM 786 CG1 VAL B 118 -42.528 -8.406 3.098 1.00 34.29 C ATOM 787 CG2 VAL B 118 -42.926 -10.772 2.337 1.00 32.38 C ATOM 0 H VAL B 118 -46.063 -9.664 1.187 1.00 27.13 H new ATOM 0 HA VAL B 118 -44.944 -9.770 3.706 1.00 29.92 H new ATOM 0 HB VAL B 118 -43.532 -9.053 1.395 1.00 32.73 H new ATOM 0 HG11 VAL B 118 -41.634 -8.465 2.728 1.00 34.29 H new ATOM 0 HG12 VAL B 118 -42.850 -7.494 3.020 1.00 34.29 H new ATOM 0 HG13 VAL B 118 -42.508 -8.662 4.033 1.00 34.29 H new ATOM 0 HG21 VAL B 118 -42.014 -10.761 2.007 1.00 32.38 H new ATOM 0 HG22 VAL B 118 -42.936 -11.107 3.247 1.00 32.38 H new ATOM 0 HG23 VAL B 118 -43.466 -11.349 1.775 1.00 32.38 H new ATOM 788 N GLU B 119 -46.137 -7.548 3.976 1.00 38.70 N ATOM 789 CA GLU B 119 -46.662 -6.185 4.237 1.00 39.36 C ATOM 790 C GLU B 119 -45.671 -5.043 4.078 1.00 41.61 C ATOM 791 O GLU B 119 -44.488 -5.210 4.328 1.00 33.87 O ATOM 792 CB GLU B 119 -47.261 -6.074 5.633 1.00 39.41 C ATOM 793 CG GLU B 119 -48.610 -6.699 5.747 1.00 44.36 C ATOM 794 CD GLU B 119 -49.501 -6.158 4.658 1.00 54.61 C ATOM 795 OE1 GLU B 119 -50.029 -5.031 4.842 1.00 61.33 O ATOM 796 OE2 GLU B 119 -49.610 -6.841 3.605 1.00 49.54 O ATOM 0 H GLU B 119 -46.325 -8.102 4.607 1.00 38.70 H new ATOM 0 HA GLU B 119 -47.331 -6.082 3.542 1.00 39.36 H new ATOM 0 HB2 GLU B 119 -46.662 -6.494 6.270 1.00 39.41 H new ATOM 0 HB3 GLU B 119 -47.324 -5.137 5.878 1.00 39.41 H new ATOM 0 HG2 GLU B 119 -48.539 -7.663 5.672 1.00 44.36 H new ATOM 0 HG3 GLU B 119 -48.994 -6.510 6.618 1.00 44.36 H new ATOM 797 N PRO B 120 -46.166 -3.882 3.603 1.00 45.72 N ATOM 798 CA PRO B 120 -45.256 -2.766 3.402 1.00 46.37 C ATOM 799 C PRO B 120 -44.804 -2.256 4.772 1.00 39.78 C ATOM 800 O PRO B 120 -45.620 -2.138 5.683 1.00 33.57 O ATOM 801 CB PRO B 120 -46.150 -1.734 2.723 1.00 49.73 C ATOM 802 CG PRO B 120 -47.506 -1.948 3.345 1.00 49.00 C ATOM 803 CD PRO B 120 -47.574 -3.445 3.560 1.00 48.70 C ATOM 0 HA PRO B 120 -44.459 -2.977 2.891 1.00 46.37 H new ATOM 0 HB2 PRO B 120 -45.829 -0.832 2.877 1.00 49.73 H new ATOM 0 HB3 PRO B 120 -46.176 -1.866 1.762 1.00 49.73 H new ATOM 0 HG2 PRO B 120 -47.594 -1.464 4.181 1.00 49.00 H new ATOM 0 HG3 PRO B 120 -48.217 -1.640 2.762 1.00 49.00 H new ATOM 0 HD2 PRO B 120 -48.036 -3.662 4.385 1.00 48.70 H new ATOM 0 HD3 PRO B 120 -48.057 -3.883 2.841 1.00 48.70 H new ATOM 804 N SER B 121 -43.506 -2.037 4.926 1.00 39.31 N ATOM 805 CA ASER B 121 -42.961 -1.449 6.164 0.43 40.61 C ATOM 806 CA BSER B 121 -42.951 -1.451 6.156 0.57 41.26 C ATOM 807 C SER B 121 -43.048 -2.376 7.405 1.00 42.40 C ATOM 808 O SER B 121 -43.084 -1.898 8.557 1.00 37.60 O ATOM 809 CB ASER B 121 -43.650 -0.100 6.461 0.43 38.17 C ATOM 810 CB BSER B 121 -43.573 -0.049 6.407 0.57 38.53 C ATOM 811 OG ASER B 121 -44.771 -0.280 7.301 0.43 34.46 O ATOM 812 OG BSER B 121 -43.303 0.819 5.313 0.57 34.04 O ATOM 0 H ASER B 121 -42.914 -2.219 4.329 0.43 39.31 H new ATOM 0 H BSER B 121 -42.917 -2.221 4.327 0.57 39.31 H new ATOM 0 HA ASER B 121 -42.015 -1.316 5.998 0.43 41.26 H new ATOM 0 HA BSER B 121 -41.997 -1.349 6.011 0.57 41.26 H new ATOM 0 HB2ASER B 121 -43.019 0.504 6.883 0.43 38.53 H new ATOM 0 HB2BSER B 121 -44.531 -0.132 6.532 0.57 38.53 H new ATOM 0 HB3ASER B 121 -43.928 0.315 5.630 0.43 38.53 H new ATOM 0 HB3BSER B 121 -43.212 0.329 7.224 0.57 38.53 H new ATOM 0 HG ASER B 121 -45.258 -0.891 6.992 0.43 34.04 H new ATOM 0 HG BSER B 121 -43.487 1.609 5.530 0.57 34.04 H new ATOM 813 N SER B 122 -43.087 -3.704 7.174 1.00 37.22 N ATOM 814 CA SER B 122 -43.156 -4.713 8.240 1.00 31.47 C ATOM 815 C SER B 122 -41.695 -5.125 8.537 1.00 27.35 C ATOM 816 O SER B 122 -40.803 -4.907 7.716 1.00 26.98 O ATOM 817 CB SER B 122 -44.008 -5.911 7.763 1.00 36.18 C ATOM 818 OG SER B 122 -43.357 -6.664 6.711 1.00 35.03 O ATOM 0 H SER B 122 -43.074 -4.042 6.383 1.00 37.22 H new ATOM 0 HA SER B 122 -43.577 -4.374 9.045 1.00 31.47 H new ATOM 0 HB2 SER B 122 -44.187 -6.498 8.515 1.00 36.18 H new ATOM 0 HB3 SER B 122 -44.866 -5.589 7.444 1.00 36.18 H new ATOM 0 HG SER B 122 -43.589 -6.359 5.963 1.00 35.03 H new ATOM 819 N PRO B 123 -41.430 -5.702 9.707 1.00 25.67 N ATOM 820 CA PRO B 123 -40.079 -6.284 9.925 1.00 26.78 C ATOM 821 C PRO B 123 -39.554 -7.180 8.800 1.00 25.29 C ATOM 822 O PRO B 123 -38.350 -7.134 8.467 1.00 26.65 O ATOM 823 CB PRO B 123 -40.259 -7.128 11.181 1.00 26.80 C ATOM 824 CG PRO B 123 -41.396 -6.445 11.872 1.00 26.19 C ATOM 825 CD PRO B 123 -42.341 -6.001 10.821 1.00 23.89 C ATOM 0 HA PRO B 123 -39.425 -5.569 9.980 1.00 26.78 H new ATOM 0 HB2 PRO B 123 -40.468 -8.051 10.969 1.00 26.80 H new ATOM 0 HB3 PRO B 123 -39.458 -7.137 11.728 1.00 26.80 H new ATOM 0 HG2 PRO B 123 -41.833 -7.049 12.493 1.00 26.19 H new ATOM 0 HG3 PRO B 123 -41.078 -5.688 12.389 1.00 26.19 H new ATOM 0 HD2 PRO B 123 -42.982 -6.692 10.592 1.00 23.89 H new ATOM 0 HD3 PRO B 123 -42.850 -5.222 11.094 1.00 23.89 H new ATOM 826 N ALA B 124 -40.441 -7.995 8.237 1.00 24.83 N ATOM 827 CA ALA B 124 -40.058 -8.832 7.064 1.00 25.34 C ATOM 828 C ALA B 124 -39.673 -7.966 5.906 1.00 24.17 C ATOM 829 O ALA B 124 -38.654 -8.219 5.278 1.00 20.89 O ATOM 830 CB ALA B 124 -41.215 -9.728 6.656 1.00 23.85 C ATOM 0 H ALA B 124 -41.254 -8.088 8.500 1.00 24.83 H new ATOM 0 HA ALA B 124 -39.300 -9.380 7.319 1.00 25.34 H new ATOM 0 HB1 ALA B 124 -40.954 -10.267 5.893 1.00 23.85 H new ATOM 0 HB2 ALA B 124 -41.451 -10.309 7.396 1.00 23.85 H new ATOM 0 HB3 ALA B 124 -41.980 -9.181 6.418 1.00 23.85 H new ATOM 831 N ALA B 125 -40.489 -6.935 5.634 1.00 24.87 N ATOM 832 CA ALA B 125 -40.148 -5.951 4.546 1.00 31.18 C ATOM 833 C ALA B 125 -38.792 -5.269 4.758 1.00 32.83 C ATOM 834 O ALA B 125 -37.909 -5.272 3.887 1.00 35.26 O ATOM 835 CB ALA B 125 -41.234 -4.917 4.394 1.00 31.90 C ATOM 0 H ALA B 125 -41.227 -6.777 6.046 1.00 24.87 H new ATOM 0 HA ALA B 125 -40.081 -6.466 3.727 1.00 31.18 H new ATOM 0 HB1 ALA B 125 -40.993 -4.296 3.689 1.00 31.90 H new ATOM 0 HB2 ALA B 125 -42.069 -5.355 4.166 1.00 31.90 H new ATOM 0 HB3 ALA B 125 -41.340 -4.434 5.228 1.00 31.90 H new ATOM 836 N LEU B 126 -38.560 -4.831 5.978 1.00 35.68 N ATOM 837 CA LEU B 126 -37.276 -4.157 6.336 1.00 31.53 C ATOM 838 C LEU B 126 -36.074 -5.078 6.182 1.00 31.44 C ATOM 839 O LEU B 126 -34.916 -4.660 5.869 1.00 33.01 O ATOM 840 CB LEU B 126 -37.408 -3.622 7.753 1.00 29.77 C ATOM 841 CG LEU B 126 -38.461 -2.509 7.738 1.00 31.42 C ATOM 842 CD1 LEU B 126 -38.952 -2.080 9.128 1.00 29.70 C ATOM 843 CD2 LEU B 126 -37.896 -1.318 6.930 1.00 38.17 C ATOM 0 H LEU B 126 -39.118 -4.903 6.629 1.00 35.68 H new ATOM 0 HA LEU B 126 -37.113 -3.425 5.721 1.00 31.53 H new ATOM 0 HB2 LEU B 126 -37.671 -4.331 8.361 1.00 29.77 H new ATOM 0 HB3 LEU B 126 -36.557 -3.280 8.068 1.00 29.77 H new ATOM 0 HG LEU B 126 -39.258 -2.861 7.311 1.00 31.42 H new ATOM 0 HD11 LEU B 126 -39.613 -1.376 9.035 1.00 29.70 H new ATOM 0 HD12 LEU B 126 -39.351 -2.840 9.579 1.00 29.70 H new ATOM 0 HD13 LEU B 126 -38.202 -1.752 9.649 1.00 29.70 H new ATOM 0 HD21 LEU B 126 -38.550 -0.602 6.909 1.00 38.17 H new ATOM 0 HD22 LEU B 126 -37.081 -1.000 7.349 1.00 38.17 H new ATOM 0 HD23 LEU B 126 -37.702 -1.604 6.024 1.00 38.17 H new ATOM 844 N ALA B 127 -36.333 -6.362 6.389 1.00 28.22 N ATOM 845 CA ALA B 127 -35.317 -7.353 6.185 1.00 25.05 C ATOM 846 C ALA B 127 -35.093 -7.613 4.725 1.00 26.16 C ATOM 847 O ALA B 127 -34.083 -8.216 4.349 1.00 31.18 O ATOM 848 CB ALA B 127 -35.692 -8.601 6.931 1.00 27.44 C ATOM 0 H ALA B 127 -37.093 -6.670 6.647 1.00 28.22 H new ATOM 0 HA ALA B 127 -34.473 -7.026 6.534 1.00 25.05 H new ATOM 0 HB1 ALA B 127 -35.008 -9.276 6.797 1.00 27.44 H new ATOM 0 HB2 ALA B 127 -35.768 -8.402 7.877 1.00 27.44 H new ATOM 0 HB3 ALA B 127 -36.542 -8.932 6.601 1.00 27.44 H new ATOM 849 N GLY B 128 -35.992 -7.144 3.863 1.00 29.39 N ATOM 850 CA GLY B 128 -35.864 -7.392 2.406 1.00 28.28 C ATOM 851 C GLY B 128 -36.414 -8.752 2.003 1.00 29.43 C ATOM 852 O GLY B 128 -35.971 -9.334 1.019 1.00 27.60 O ATOM 0 H GLY B 128 -36.682 -6.682 4.088 1.00 29.39 H new ATOM 0 HA2 GLY B 128 -36.335 -6.698 1.919 1.00 28.28 H new ATOM 0 HA3 GLY B 128 -34.930 -7.334 2.151 1.00 28.28 H new ATOM 853 N LEU B 129 -37.358 -9.310 2.775 1.00 32.08 N ATOM 854 CA LEU B 129 -37.975 -10.583 2.335 1.00 31.02 C ATOM 855 C LEU B 129 -38.820 -10.384 1.010 1.00 31.14 C ATOM 856 O LEU B 129 -39.798 -9.639 1.019 1.00 35.56 O ATOM 857 CB LEU B 129 -38.801 -11.240 3.447 1.00 28.33 C ATOM 858 CG LEU B 129 -37.904 -11.721 4.559 1.00 27.11 C ATOM 859 CD1 LEU B 129 -38.697 -12.279 5.726 1.00 27.96 C ATOM 860 CD2 LEU B 129 -36.886 -12.731 4.032 1.00 29.99 C ATOM 0 H LEU B 129 -37.647 -8.991 3.520 1.00 32.08 H new ATOM 0 HA LEU B 129 -37.252 -11.196 2.130 1.00 31.02 H new ATOM 0 HB2 LEU B 129 -39.446 -10.605 3.796 1.00 28.33 H new ATOM 0 HB3 LEU B 129 -39.305 -11.986 3.085 1.00 28.33 H new ATOM 0 HG LEU B 129 -37.416 -10.954 4.898 1.00 27.11 H new ATOM 0 HD11 LEU B 129 -38.087 -12.577 6.419 1.00 27.96 H new ATOM 0 HD12 LEU B 129 -39.278 -11.589 6.082 1.00 27.96 H new ATOM 0 HD13 LEU B 129 -39.234 -13.028 5.424 1.00 27.96 H new ATOM 0 HD21 LEU B 129 -36.319 -13.029 4.760 1.00 29.99 H new ATOM 0 HD22 LEU B 129 -37.352 -13.493 3.653 1.00 29.99 H new ATOM 0 HD23 LEU B 129 -36.340 -12.313 3.347 1.00 29.99 H new ATOM 861 N ARG B 130 -38.423 -11.084 -0.065 1.00 28.74 N ATOM 862 CA ARG B 130 -39.102 -11.040 -1.394 1.00 30.86 C ATOM 863 C ARG B 130 -40.345 -12.012 -1.465 1.00 30.73 C ATOM 864 O ARG B 130 -40.223 -13.257 -1.279 1.00 31.55 O ATOM 865 CB ARG B 130 -38.066 -11.333 -2.481 1.00 29.05 C ATOM 866 CG ARG B 130 -36.847 -10.385 -2.437 1.00 25.97 C ATOM 867 CD ARG B 130 -35.747 -10.966 -3.301 1.00 27.67 C ATOM 868 NE ARG B 130 -34.450 -10.277 -3.156 1.00 28.59 N ATOM 869 CZ ARG B 130 -33.283 -10.817 -3.486 1.00 27.45 C ATOM 870 NH1 ARG B 130 -33.197 -11.994 -4.134 1.00 28.23 N ATOM 871 NH2 ARG B 130 -32.168 -10.133 -3.249 1.00 35.58 N ATOM 0 H ARG B 130 -37.742 -11.608 -0.051 1.00 28.74 H new ATOM 0 HA ARG B 130 -39.468 -10.153 -1.537 1.00 30.86 H new ATOM 0 HB2 ARG B 130 -37.759 -12.248 -2.388 1.00 29.05 H new ATOM 0 HB3 ARG B 130 -38.490 -11.263 -3.350 1.00 29.05 H new ATOM 0 HG2 ARG B 130 -37.095 -9.503 -2.757 1.00 25.97 H new ATOM 0 HG3 ARG B 130 -36.537 -10.279 -1.524 1.00 25.97 H new ATOM 0 HD2 ARG B 130 -35.633 -11.903 -3.078 1.00 27.67 H new ATOM 0 HD3 ARG B 130 -36.022 -10.927 -4.230 1.00 27.67 H new ATOM 0 HE ARG B 130 -34.450 -9.478 -2.839 1.00 28.59 H new ATOM 0 HH11 ARG B 130 -33.913 -12.421 -4.347 1.00 28.23 H new ATOM 0 HH12 ARG B 130 -32.427 -12.319 -4.335 1.00 28.23 H new ATOM 0 HH21 ARG B 130 -32.210 -9.354 -2.887 1.00 35.58 H new ATOM 0 HH22 ARG B 130 -31.405 -10.470 -3.457 1.00 35.58 H new ATOM 872 N PRO B 131 -41.533 -11.446 -1.580 1.00 28.53 N ATOM 873 CA PRO B 131 -42.772 -12.244 -1.441 1.00 30.77 C ATOM 874 C PRO B 131 -42.848 -13.340 -2.480 1.00 31.31 C ATOM 875 O PRO B 131 -42.327 -13.168 -3.617 1.00 28.92 O ATOM 876 CB PRO B 131 -43.895 -11.268 -1.688 1.00 31.83 C ATOM 877 CG PRO B 131 -43.276 -9.889 -1.677 1.00 31.76 C ATOM 878 CD PRO B 131 -41.778 -10.004 -1.673 1.00 31.84 C ATOM 0 HA PRO B 131 -42.811 -12.669 -0.570 1.00 30.77 H new ATOM 0 HB2 PRO B 131 -44.326 -11.446 -2.538 1.00 31.83 H new ATOM 0 HB3 PRO B 131 -44.577 -11.346 -1.003 1.00 31.83 H new ATOM 0 HG2 PRO B 131 -43.568 -9.388 -2.454 1.00 31.76 H new ATOM 0 HG3 PRO B 131 -43.573 -9.398 -0.895 1.00 31.76 H new ATOM 0 HD2 PRO B 131 -41.391 -9.629 -2.480 1.00 31.84 H new ATOM 0 HD3 PRO B 131 -41.387 -9.528 -0.923 1.00 31.84 H new ATOM 879 N TYR B 132 -43.406 -14.486 -2.066 1.00 26.90 N ATOM 880 CA TYR B 132 -43.650 -15.660 -2.953 1.00 22.75 C ATOM 881 C TYR B 132 -42.391 -16.328 -3.529 1.00 22.41 C ATOM 882 O TYR B 132 -42.487 -17.449 -3.893 1.00 20.45 O ATOM 883 CB TYR B 132 -44.673 -15.292 -4.020 1.00 22.76 C ATOM 884 CG TYR B 132 -45.930 -14.684 -3.419 1.00 22.77 C ATOM 885 CD1 TYR B 132 -46.726 -15.416 -2.570 1.00 21.95 C ATOM 886 CD2 TYR B 132 -46.279 -13.357 -3.671 1.00 28.77 C ATOM 887 CE1 TYR B 132 -47.828 -14.876 -1.974 1.00 24.07 C ATOM 888 CE2 TYR B 132 -47.414 -12.768 -3.114 1.00 26.04 C ATOM 889 CZ TYR B 132 -48.174 -13.558 -2.235 1.00 28.99 C ATOM 890 OH TYR B 132 -49.300 -13.045 -1.636 1.00 29.17 O ATOM 0 H TYR B 132 -43.660 -14.614 -1.254 1.00 26.90 H new ATOM 0 HA TYR B 132 -44.016 -16.359 -2.388 1.00 22.75 H new ATOM 0 HB2 TYR B 132 -44.277 -14.663 -4.643 1.00 22.76 H new ATOM 0 HB3 TYR B 132 -44.909 -16.084 -4.528 1.00 22.76 H new ATOM 0 HD1 TYR B 132 -46.507 -16.303 -2.397 1.00 21.95 H new ATOM 0 HD2 TYR B 132 -45.737 -12.848 -4.229 1.00 28.77 H new ATOM 0 HE1 TYR B 132 -48.345 -15.389 -1.395 1.00 24.07 H new ATOM 0 HE2 TYR B 132 -47.657 -11.893 -3.315 1.00 26.04 H new ATOM 0 HH TYR B 132 -49.402 -12.245 -1.870 1.00 29.17 H new ATOM 891 N THR B 133 -41.197 -15.702 -3.504 1.00 22.98 N ATOM 892 CA THR B 133 -39.963 -16.318 -4.055 1.00 21.13 C ATOM 893 C THR B 133 -38.903 -16.660 -3.109 1.00 23.38 C ATOM 894 O THR B 133 -37.922 -17.379 -3.481 1.00 20.46 O ATOM 895 CB THR B 133 -39.351 -15.423 -5.156 1.00 27.08 C ATOM 896 OG1 THR B 133 -38.744 -14.198 -4.612 1.00 28.30 O ATOM 897 CG2 THR B 133 -40.488 -15.061 -6.173 1.00 29.91 C ATOM 0 H THR B 133 -41.079 -14.918 -3.172 1.00 22.98 H new ATOM 0 HA THR B 133 -40.287 -17.166 -4.396 1.00 21.13 H new ATOM 0 HB THR B 133 -38.636 -15.911 -5.593 1.00 27.08 H new ATOM 0 HG1 THR B 133 -39.350 -13.665 -4.377 1.00 28.30 H new ATOM 0 HG21 THR B 133 -40.127 -14.498 -6.875 1.00 29.91 H new ATOM 0 HG22 THR B 133 -40.845 -15.874 -6.563 1.00 29.91 H new ATOM 0 HG23 THR B 133 -41.197 -14.586 -5.711 1.00 29.91 H new ATOM 898 N ASP B 134 -39.024 -16.149 -1.880 1.00 24.78 N ATOM 899 CA ASP B 134 -38.058 -16.472 -0.848 1.00 22.96 C ATOM 900 C ASP B 134 -38.502 -17.656 -0.019 1.00 23.98 C ATOM 901 O ASP B 134 -39.676 -17.828 0.206 1.00 24.21 O ATOM 902 CB ASP B 134 -37.876 -15.306 0.101 1.00 24.78 C ATOM 903 CG ASP B 134 -36.876 -14.256 -0.392 1.00 26.88 C ATOM 904 OD1 ASP B 134 -36.019 -14.526 -1.274 1.00 23.15 O ATOM 905 OD2 ASP B 134 -36.923 -13.149 0.224 1.00 31.45 O ATOM 0 H ASP B 134 -39.655 -15.619 -1.633 1.00 24.78 H new ATOM 0 HA ASP B 134 -37.228 -16.679 -1.306 1.00 22.96 H new ATOM 0 HB2 ASP B 134 -38.735 -14.879 0.244 1.00 24.78 H new ATOM 0 HB3 ASP B 134 -37.580 -15.643 0.961 1.00 24.78 H new ATOM 906 N TYR B 135 -37.523 -18.440 0.438 1.00 23.15 N ATOM 907 CA TYR B 135 -37.750 -19.565 1.274 1.00 22.08 C ATOM 908 C TYR B 135 -36.681 -19.547 2.296 1.00 21.91 C ATOM 909 O TYR B 135 -35.531 -19.535 1.952 1.00 26.31 O ATOM 910 CB TYR B 135 -37.636 -20.892 0.495 1.00 23.06 C ATOM 911 CG TYR B 135 -38.574 -20.983 -0.647 1.00 21.99 C ATOM 912 CD1 TYR B 135 -38.339 -20.310 -1.859 1.00 23.05 C ATOM 913 CD2 TYR B 135 -39.682 -21.810 -0.578 1.00 23.55 C ATOM 914 CE1 TYR B 135 -39.256 -20.385 -2.925 1.00 23.43 C ATOM 915 CE2 TYR B 135 -40.588 -21.875 -1.616 1.00 23.43 C ATOM 916 CZ TYR B 135 -40.365 -21.213 -2.784 1.00 23.92 C ATOM 917 OH TYR B 135 -41.315 -21.339 -3.752 1.00 26.30 O ATOM 0 H TYR B 135 -36.693 -18.310 0.253 1.00 23.15 H new ATOM 0 HA TYR B 135 -38.643 -19.513 1.650 1.00 22.08 H new ATOM 0 HB2 TYR B 135 -36.728 -20.991 0.168 1.00 23.06 H new ATOM 0 HB3 TYR B 135 -37.802 -21.631 1.101 1.00 23.06 H new ATOM 0 HD1 TYR B 135 -37.564 -19.806 -1.958 1.00 23.05 H new ATOM 0 HD2 TYR B 135 -39.818 -22.330 0.181 1.00 23.55 H new ATOM 0 HE1 TYR B 135 -39.124 -19.894 -3.703 1.00 23.43 H new ATOM 0 HE2 TYR B 135 -41.363 -22.379 -1.516 1.00 23.43 H new ATOM 0 HH TYR B 135 -41.157 -20.795 -4.372 1.00 26.30 H new ATOM 918 N VAL B 136 -37.075 -19.622 3.557 1.00 23.88 N ATOM 919 CA VAL B 136 -36.208 -19.784 4.671 1.00 23.37 C ATOM 920 C VAL B 136 -35.796 -21.266 4.761 1.00 25.68 C ATOM 921 O VAL B 136 -36.598 -22.143 4.986 1.00 20.14 O ATOM 922 CB VAL B 136 -36.930 -19.373 5.999 1.00 23.14 C ATOM 923 CG1 VAL B 136 -36.034 -19.578 7.247 1.00 22.35 C ATOM 924 CG2 VAL B 136 -37.494 -17.961 5.909 1.00 20.64 C ATOM 0 H VAL B 136 -37.904 -19.576 3.783 1.00 23.88 H new ATOM 0 HA VAL B 136 -35.430 -19.217 4.553 1.00 23.37 H new ATOM 0 HB VAL B 136 -37.684 -19.973 6.114 1.00 23.14 H new ATOM 0 HG11 VAL B 136 -36.521 -19.311 8.042 1.00 22.35 H new ATOM 0 HG12 VAL B 136 -35.787 -20.513 7.318 1.00 22.35 H new ATOM 0 HG13 VAL B 136 -35.233 -19.038 7.163 1.00 22.35 H new ATOM 0 HG21 VAL B 136 -37.934 -17.734 6.743 1.00 20.64 H new ATOM 0 HG22 VAL B 136 -36.772 -17.334 5.744 1.00 20.64 H new ATOM 0 HG23 VAL B 136 -38.135 -17.914 5.183 1.00 20.64 H new ATOM 925 N VAL B 137 -34.504 -21.513 4.628 1.00 28.16 N ATOM 926 CA VAL B 137 -33.958 -22.850 4.560 1.00 31.14 C ATOM 927 C VAL B 137 -32.969 -23.083 5.704 1.00 36.90 C ATOM 928 O VAL B 137 -32.278 -24.082 5.704 1.00 43.90 O ATOM 929 CB VAL B 137 -33.274 -23.074 3.189 1.00 34.35 C ATOM 930 CG1 VAL B 137 -34.315 -23.220 2.091 1.00 35.52 C ATOM 931 CG2 VAL B 137 -32.371 -21.913 2.776 1.00 35.84 C ATOM 0 H VAL B 137 -33.910 -20.894 4.574 1.00 28.16 H new ATOM 0 HA VAL B 137 -34.682 -23.489 4.652 1.00 31.14 H new ATOM 0 HB VAL B 137 -32.742 -23.878 3.296 1.00 34.35 H new ATOM 0 HG11 VAL B 137 -33.871 -23.359 1.240 1.00 35.52 H new ATOM 0 HG12 VAL B 137 -34.886 -23.980 2.285 1.00 35.52 H new ATOM 0 HG13 VAL B 137 -34.853 -22.414 2.046 1.00 35.52 H new ATOM 0 HG21 VAL B 137 -31.970 -22.105 1.914 1.00 35.84 H new ATOM 0 HG22 VAL B 137 -32.897 -21.100 2.713 1.00 35.84 H new ATOM 0 HG23 VAL B 137 -31.672 -21.795 3.438 1.00 35.84 H new ATOM 932 N GLY B 138 -32.899 -22.164 6.675 1.00 41.43 N ATOM 933 CA GLY B 138 -31.959 -22.257 7.822 1.00 47.84 C ATOM 934 C GLY B 138 -31.838 -21.119 8.862 1.00 49.97 C ATOM 935 O GLY B 138 -32.232 -19.964 8.584 1.00 36.79 O ATOM 0 H GLY B 138 -33.396 -21.462 6.693 1.00 41.43 H new ATOM 0 HA2 GLY B 138 -32.190 -23.062 8.311 1.00 47.84 H new ATOM 0 HA3 GLY B 138 -31.074 -22.395 7.450 1.00 47.84 H new ATOM 936 N SER B 139 -31.289 -21.520 10.042 1.00 64.12 N ATOM 937 CA SER B 139 -30.959 -20.722 11.280 1.00 62.71 C ATOM 938 C SER B 139 -31.886 -19.561 11.619 1.00 66.96 C ATOM 939 O SER B 139 -33.073 -19.745 11.873 1.00 60.77 O ATOM 940 CB SER B 139 -29.503 -20.216 11.248 1.00 67.69 C ATOM 941 OG SER B 139 -29.003 -20.000 12.568 1.00 70.65 O ATOM 0 H SER B 139 -31.078 -22.346 10.153 1.00 64.12 H new ATOM 0 HA SER B 139 -31.094 -21.368 11.991 1.00 62.71 H new ATOM 0 HB2 SER B 139 -28.943 -20.862 10.789 1.00 67.69 H new ATOM 0 HB3 SER B 139 -29.456 -19.390 10.742 1.00 67.69 H new ATOM 0 HG SER B 139 -28.210 -19.727 12.526 1.00 70.65 H new ATOM 942 N ASP B 148 -40.100 -24.604 16.673 1.00 62.80 N ATOM 943 CA ASP B 148 -39.642 -24.737 15.274 1.00 71.98 C ATOM 944 C ASP B 148 -39.204 -23.340 14.695 1.00 68.44 C ATOM 945 O ASP B 148 -38.470 -22.615 15.373 1.00 69.94 O ATOM 946 CB ASP B 148 -40.715 -25.467 14.439 1.00 69.70 C ATOM 947 CG ASP B 148 -42.071 -24.767 14.470 1.00 76.83 C ATOM 948 OD1 ASP B 148 -42.309 -23.965 15.410 1.00 83.08 O ATOM 949 OD2 ASP B 148 -42.910 -25.029 13.571 1.00 83.16 O ATOM 0 HA ASP B 148 -38.846 -25.289 15.233 1.00 71.98 H new ATOM 0 HB2 ASP B 148 -40.412 -25.535 13.520 1.00 69.70 H new ATOM 0 HB3 ASP B 148 -40.816 -26.373 14.772 1.00 69.70 H new ATOM 950 N PHE B 149 -39.584 -22.974 13.467 1.00 52.88 N ATOM 951 CA PHE B 149 -39.369 -21.606 12.988 1.00 44.37 C ATOM 952 C PHE B 149 -40.246 -20.592 13.785 1.00 45.07 C ATOM 953 O PHE B 149 -39.781 -19.490 14.110 1.00 38.09 O ATOM 954 CB PHE B 149 -39.628 -21.552 11.498 1.00 38.71 C ATOM 955 CG PHE B 149 -39.381 -20.219 10.872 1.00 34.59 C ATOM 956 CD1 PHE B 149 -38.106 -19.646 10.889 1.00 36.08 C ATOM 957 CD2 PHE B 149 -40.403 -19.537 10.266 1.00 30.90 C ATOM 958 CE1 PHE B 149 -37.881 -18.405 10.325 1.00 32.27 C ATOM 959 CE2 PHE B 149 -40.186 -18.309 9.695 1.00 34.70 C ATOM 960 CZ PHE B 149 -38.920 -17.728 9.735 1.00 33.25 C ATOM 0 H PHE B 149 -39.964 -23.498 12.901 1.00 52.88 H new ATOM 0 HA PHE B 149 -38.447 -21.346 13.142 1.00 44.37 H new ATOM 0 HB2 PHE B 149 -39.067 -22.211 11.060 1.00 38.71 H new ATOM 0 HB3 PHE B 149 -40.549 -21.808 11.332 1.00 38.71 H new ATOM 0 HD1 PHE B 149 -37.401 -20.106 11.285 1.00 36.08 H new ATOM 0 HD2 PHE B 149 -41.254 -19.911 10.242 1.00 30.90 H new ATOM 0 HE1 PHE B 149 -37.030 -18.030 10.345 1.00 32.27 H new ATOM 0 HE2 PHE B 149 -40.887 -17.862 9.279 1.00 34.70 H new ATOM 0 HZ PHE B 149 -38.780 -16.887 9.364 1.00 33.25 H new ATOM 961 N PHE B 150 -41.462 -20.986 14.159 1.00 41.77 N ATOM 962 CA PHE B 150 -42.353 -20.078 14.877 1.00 47.23 C ATOM 963 C PHE B 150 -41.849 -19.786 16.275 1.00 44.82 C ATOM 964 O PHE B 150 -42.041 -18.682 16.773 1.00 44.28 O ATOM 965 CB PHE B 150 -43.829 -20.574 14.887 1.00 48.15 C ATOM 966 CG PHE B 150 -44.393 -20.785 13.498 1.00 46.25 C ATOM 967 CD1 PHE B 150 -44.315 -19.754 12.532 1.00 49.55 C ATOM 968 CD2 PHE B 150 -44.942 -22.001 13.132 1.00 43.50 C ATOM 969 CE1 PHE B 150 -44.785 -19.947 11.243 1.00 47.70 C ATOM 970 CE2 PHE B 150 -45.403 -22.203 11.848 1.00 47.31 C ATOM 971 CZ PHE B 150 -45.326 -21.169 10.897 1.00 48.61 C ATOM 0 H PHE B 150 -41.788 -21.768 14.008 1.00 41.77 H new ATOM 0 HA PHE B 150 -42.347 -19.241 14.387 1.00 47.23 H new ATOM 0 HB2 PHE B 150 -43.881 -21.407 15.382 1.00 48.15 H new ATOM 0 HB3 PHE B 150 -44.378 -19.929 15.359 1.00 48.15 H new ATOM 0 HD1 PHE B 150 -43.943 -18.934 12.766 1.00 49.55 H new ATOM 0 HD2 PHE B 150 -45.001 -22.688 13.757 1.00 43.50 H new ATOM 0 HE1 PHE B 150 -44.737 -19.261 10.617 1.00 47.70 H new ATOM 0 HE2 PHE B 150 -45.766 -23.025 11.610 1.00 47.31 H new ATOM 0 HZ PHE B 150 -45.640 -21.309 10.033 1.00 48.61 H new ATOM 972 N THR B 151 -41.197 -20.776 16.876 1.00 46.64 N ATOM 973 CA THR B 151 -40.725 -20.703 18.259 1.00 45.80 C ATOM 974 C THR B 151 -39.531 -19.798 18.269 1.00 38.50 C ATOM 975 O THR B 151 -39.386 -18.960 19.120 1.00 38.25 O ATOM 976 CB THR B 151 -40.329 -22.122 18.794 1.00 52.18 C ATOM 977 OG1 THR B 151 -41.526 -22.853 19.094 1.00 58.09 O ATOM 978 CG2 THR B 151 -39.449 -22.081 20.079 1.00 54.28 C ATOM 0 H THR B 151 -41.013 -21.521 16.488 1.00 46.64 H new ATOM 0 HA THR B 151 -41.427 -20.364 18.836 1.00 45.80 H new ATOM 0 HB THR B 151 -39.804 -22.546 18.098 1.00 52.18 H new ATOM 0 HG1 THR B 151 -41.324 -23.616 19.380 1.00 58.09 H new ATOM 0 HG21 THR B 151 -39.240 -22.986 20.357 1.00 54.28 H new ATOM 0 HG22 THR B 151 -38.626 -21.602 19.893 1.00 54.28 H new ATOM 0 HG23 THR B 151 -39.932 -21.629 20.788 1.00 54.28 H new ATOM 979 N LEU B 152 -38.658 -20.063 17.321 1.00 33.34 N ATOM 980 CA LEU B 152 -37.490 -19.263 17.081 1.00 35.58 C ATOM 981 C LEU B 152 -37.830 -17.773 16.860 1.00 31.82 C ATOM 982 O LEU B 152 -37.124 -16.887 17.371 1.00 32.16 O ATOM 983 CB LEU B 152 -36.748 -19.826 15.869 1.00 36.21 C ATOM 984 CG LEU B 152 -35.234 -19.676 15.741 1.00 41.75 C ATOM 985 CD1 LEU B 152 -34.472 -20.339 16.875 1.00 42.67 C ATOM 986 CD2 LEU B 152 -34.867 -20.311 14.420 1.00 40.56 C ATOM 0 H LEU B 152 -38.733 -20.732 16.786 1.00 33.34 H new ATOM 0 HA LEU B 152 -36.927 -19.303 17.870 1.00 35.58 H new ATOM 0 HB2 LEU B 152 -36.945 -20.775 15.830 1.00 36.21 H new ATOM 0 HB3 LEU B 152 -37.142 -19.422 15.080 1.00 36.21 H new ATOM 0 HG LEU B 152 -34.991 -18.738 15.784 1.00 41.75 H new ATOM 0 HD11 LEU B 152 -33.519 -20.213 16.742 1.00 42.67 H new ATOM 0 HD12 LEU B 152 -34.736 -19.941 17.719 1.00 42.67 H new ATOM 0 HD13 LEU B 152 -34.673 -21.288 16.889 1.00 42.67 H new ATOM 0 HD21 LEU B 152 -33.909 -20.245 14.284 1.00 40.56 H new ATOM 0 HD22 LEU B 152 -35.128 -21.245 14.426 1.00 40.56 H new ATOM 0 HD23 LEU B 152 -35.328 -19.851 13.701 1.00 40.56 H new ATOM 987 N ILE B 153 -38.887 -17.502 16.100 1.00 29.99 N ATOM 988 CA ILE B 153 -39.403 -16.128 15.940 1.00 34.12 C ATOM 989 C ILE B 153 -39.790 -15.495 17.266 1.00 35.68 C ATOM 990 O ILE B 153 -39.323 -14.396 17.582 1.00 34.79 O ATOM 991 CB ILE B 153 -40.611 -16.076 14.987 1.00 36.08 C ATOM 992 CG1 ILE B 153 -40.114 -16.231 13.529 1.00 40.24 C ATOM 993 CG2 ILE B 153 -41.412 -14.780 15.183 1.00 34.52 C ATOM 994 CD1 ILE B 153 -41.080 -16.938 12.613 1.00 43.02 C ATOM 0 H ILE B 153 -39.327 -18.098 15.663 1.00 29.99 H new ATOM 0 HA ILE B 153 -38.672 -15.619 15.556 1.00 34.12 H new ATOM 0 HB ILE B 153 -41.214 -16.809 15.188 1.00 36.08 H new ATOM 0 HG12 ILE B 153 -39.928 -15.350 13.167 1.00 40.24 H new ATOM 0 HG13 ILE B 153 -39.275 -16.718 13.535 1.00 40.24 H new ATOM 0 HG21 ILE B 153 -42.166 -14.770 14.573 1.00 34.52 H new ATOM 0 HG22 ILE B 153 -41.735 -14.734 16.097 1.00 34.52 H new ATOM 0 HG23 ILE B 153 -40.841 -14.016 15.003 1.00 34.52 H new ATOM 0 HD11 ILE B 153 -40.699 -16.996 11.723 1.00 43.02 H new ATOM 0 HD12 ILE B 153 -41.251 -17.832 12.950 1.00 43.02 H new ATOM 0 HD13 ILE B 153 -41.913 -16.442 12.576 1.00 43.02 H new ATOM 995 N GLU B 154 -40.629 -16.198 18.020 1.00 36.22 N ATOM 996 CA GLU B 154 -41.132 -15.716 19.308 1.00 43.67 C ATOM 997 C GLU B 154 -40.000 -15.459 20.279 1.00 38.13 C ATOM 998 O GLU B 154 -39.898 -14.362 20.873 1.00 47.13 O ATOM 999 CB GLU B 154 -42.176 -16.670 19.893 1.00 52.41 C ATOM 1000 CG GLU B 154 -43.482 -16.625 19.097 1.00 65.11 C ATOM 1001 CD GLU B 154 -44.522 -17.614 19.588 1.00 72.11 C ATOM 1002 OE1 GLU B 154 -44.786 -17.591 20.819 1.00 76.83 O ATOM 1003 OE2 GLU B 154 -45.077 -18.387 18.749 1.00 70.09 O ATOM 0 H GLU B 154 -40.926 -16.974 17.799 1.00 36.22 H new ATOM 0 HA GLU B 154 -41.576 -14.868 19.152 1.00 43.67 H new ATOM 0 HB2 GLU B 154 -41.826 -17.575 19.893 1.00 52.41 H new ATOM 0 HB3 GLU B 154 -42.350 -16.434 20.817 1.00 52.41 H new ATOM 0 HG2 GLU B 154 -43.850 -15.729 19.144 1.00 65.11 H new ATOM 0 HG3 GLU B 154 -43.290 -16.805 18.163 1.00 65.11 H new ATOM 1004 N SER B 155 -39.089 -16.403 20.352 1.00 33.68 N ATOM 1005 CA SER B 155 -37.955 -16.233 21.224 1.00 36.13 C ATOM 1006 C SER B 155 -37.030 -15.091 20.790 1.00 34.60 C ATOM 1007 O SER B 155 -36.242 -14.648 21.603 1.00 35.71 O ATOM 1008 CB SER B 155 -37.162 -17.524 21.351 1.00 38.73 C ATOM 1009 OG SER B 155 -36.602 -17.871 20.101 1.00 46.67 O ATOM 0 H SER B 155 -39.107 -17.141 19.911 1.00 33.68 H new ATOM 0 HA SER B 155 -38.319 -15.994 22.091 1.00 36.13 H new ATOM 0 HB2 SER B 155 -36.459 -17.417 22.011 1.00 38.73 H new ATOM 0 HB3 SER B 155 -37.739 -18.238 21.665 1.00 38.73 H new ATOM 0 HG SER B 155 -36.970 -17.422 19.494 1.00 46.67 H new ATOM 1010 N HIS B 156 -37.117 -14.593 19.556 1.00 27.20 N ATOM 1011 CA HIS B 156 -36.336 -13.414 19.162 1.00 28.45 C ATOM 1012 C HIS B 156 -37.151 -12.097 19.062 1.00 29.40 C ATOM 1013 O HIS B 156 -36.734 -11.152 18.391 1.00 32.04 O ATOM 1014 CB HIS B 156 -35.619 -13.684 17.831 1.00 29.17 C ATOM 1015 CG HIS B 156 -34.503 -14.644 17.938 1.00 27.94 C ATOM 1016 ND1 HIS B 156 -34.702 -16.005 18.053 1.00 29.74 N ATOM 1017 CD2 HIS B 156 -33.162 -14.448 17.913 1.00 30.22 C ATOM 1018 CE1 HIS B 156 -33.521 -16.601 18.125 1.00 32.75 C ATOM 1019 NE2 HIS B 156 -32.569 -15.678 18.035 1.00 30.59 N ATOM 0 H HIS B 156 -37.617 -14.918 18.936 1.00 27.20 H new ATOM 0 HA HIS B 156 -35.698 -13.273 19.879 1.00 28.45 H new ATOM 0 HB2 HIS B 156 -36.263 -14.021 17.189 1.00 29.17 H new ATOM 0 HB3 HIS B 156 -35.280 -12.845 17.480 1.00 29.17 H new ATOM 0 HD1 HIS B 156 -35.465 -16.400 18.074 1.00 29.74 H new ATOM 0 HD2 HIS B 156 -32.725 -13.631 17.829 1.00 30.22 H new ATOM 0 HE1 HIS B 156 -33.381 -17.515 18.223 1.00 32.75 H new ATOM 1020 N GLU B 157 -38.293 -12.019 19.717 1.00 31.81 N ATOM 1021 CA GLU B 157 -38.990 -10.754 19.822 1.00 34.95 C ATOM 1022 C GLU B 157 -38.049 -9.560 20.154 1.00 35.27 C ATOM 1023 O GLU B 157 -37.289 -9.581 21.111 1.00 29.32 O ATOM 1024 CB GLU B 157 -40.124 -10.904 20.808 1.00 41.21 C ATOM 1025 CG GLU B 157 -40.813 -9.629 21.261 1.00 50.20 C ATOM 1026 CD GLU B 157 -41.419 -8.832 20.145 1.00 59.12 C ATOM 1027 OE1 GLU B 157 -41.731 -9.463 19.110 1.00 73.44 O ATOM 1028 OE2 GLU B 157 -41.610 -7.582 20.297 1.00 63.25 O ATOM 0 H GLU B 157 -38.680 -12.681 20.106 1.00 31.81 H new ATOM 0 HA GLU B 157 -39.357 -10.529 18.953 1.00 34.95 H new ATOM 0 HB2 GLU B 157 -40.793 -11.485 20.413 1.00 41.21 H new ATOM 0 HB3 GLU B 157 -39.783 -11.358 21.594 1.00 41.21 H new ATOM 0 HG2 GLU B 157 -41.508 -9.857 21.898 1.00 50.20 H new ATOM 0 HG3 GLU B 157 -40.170 -9.074 21.730 1.00 50.20 H new ATOM 1029 N GLY B 158 -38.090 -8.523 19.317 1.00 33.54 N ATOM 1030 CA GLY B 158 -37.202 -7.363 19.440 1.00 32.82 C ATOM 1031 C GLY B 158 -35.701 -7.594 19.336 1.00 32.04 C ATOM 1032 O GLY B 158 -34.894 -6.759 19.804 1.00 28.00 O ATOM 0 H GLY B 158 -38.638 -8.472 18.656 1.00 33.54 H new ATOM 0 HA2 GLY B 158 -37.452 -6.724 18.754 1.00 32.82 H new ATOM 0 HA3 GLY B 158 -37.379 -6.944 20.297 1.00 32.82 H new ATOM 1033 N LYS B 159 -35.323 -8.687 18.676 1.00 35.10 N ATOM 1034 CA LYS B 159 -33.931 -9.151 18.632 1.00 37.90 C ATOM 1035 C LYS B 159 -33.609 -9.674 17.234 1.00 33.98 C ATOM 1036 O LYS B 159 -34.408 -10.393 16.683 1.00 31.29 O ATOM 1037 CB LYS B 159 -33.740 -10.266 19.699 1.00 46.18 C ATOM 1038 CG LYS B 159 -32.388 -10.990 19.715 1.00 54.43 C ATOM 1039 CD LYS B 159 -32.347 -12.050 20.844 1.00 61.15 C ATOM 1040 CE LYS B 159 -31.023 -12.024 21.627 1.00 64.58 C ATOM 1041 NZ LYS B 159 -31.174 -12.188 23.104 1.00 61.24 N ATOM 0 H LYS B 159 -35.869 -9.186 18.237 1.00 35.10 H new ATOM 0 HA LYS B 159 -33.326 -8.419 18.828 1.00 37.90 H new ATOM 0 HB2 LYS B 159 -33.882 -9.873 20.574 1.00 46.18 H new ATOM 0 HB3 LYS B 159 -34.436 -10.929 19.570 1.00 46.18 H new ATOM 0 HG2 LYS B 159 -32.235 -11.418 18.858 1.00 54.43 H new ATOM 0 HG3 LYS B 159 -31.673 -10.347 19.843 1.00 54.43 H new ATOM 0 HD2 LYS B 159 -33.084 -11.896 21.455 1.00 61.15 H new ATOM 0 HD3 LYS B 159 -32.476 -12.932 20.461 1.00 61.15 H new ATOM 0 HE2 LYS B 159 -30.448 -12.730 21.292 1.00 64.58 H new ATOM 0 HE3 LYS B 159 -30.572 -11.183 21.451 1.00 64.58 H new ATOM 0 HZ1 LYS B 159 -30.372 -12.163 23.489 1.00 61.24 H new ATOM 0 HZ2 LYS B 159 -31.678 -11.529 23.426 1.00 61.24 H new ATOM 0 HZ3 LYS B 159 -31.562 -12.970 23.278 1.00 61.24 H new ATOM 1042 N PRO B 160 -32.432 -9.308 16.676 1.00 34.84 N ATOM 1043 CA PRO B 160 -32.054 -9.764 15.361 1.00 34.76 C ATOM 1044 C PRO B 160 -31.870 -11.286 15.274 1.00 32.13 C ATOM 1045 O PRO B 160 -31.245 -11.912 16.142 1.00 31.47 O ATOM 1046 CB PRO B 160 -30.720 -9.028 15.083 1.00 35.71 C ATOM 1047 CG PRO B 160 -30.196 -8.611 16.404 1.00 32.41 C ATOM 1048 CD PRO B 160 -31.390 -8.419 17.260 1.00 32.69 C ATOM 0 HA PRO B 160 -32.747 -9.572 14.710 1.00 34.76 H new ATOM 0 HB2 PRO B 160 -30.091 -9.610 14.629 1.00 35.71 H new ATOM 0 HB3 PRO B 160 -30.861 -8.260 14.508 1.00 35.71 H new ATOM 0 HG2 PRO B 160 -29.605 -9.286 16.774 1.00 32.41 H new ATOM 0 HG3 PRO B 160 -29.682 -7.792 16.333 1.00 32.41 H new ATOM 0 HD2 PRO B 160 -31.203 -8.656 18.182 1.00 32.69 H new ATOM 0 HD3 PRO B 160 -31.678 -7.493 17.258 1.00 32.69 H new ATOM 1049 N LEU B 161 -32.426 -11.841 14.199 1.00 27.01 N ATOM 1050 CA LEU B 161 -32.425 -13.264 13.918 1.00 25.22 C ATOM 1051 C LEU B 161 -31.777 -13.462 12.588 1.00 26.17 C ATOM 1052 O LEU B 161 -32.269 -12.905 11.586 1.00 24.50 O ATOM 1053 CB LEU B 161 -33.869 -13.726 13.802 1.00 24.55 C ATOM 1054 CG LEU B 161 -34.049 -15.184 13.390 1.00 27.65 C ATOM 1055 CD1 LEU B 161 -33.359 -16.123 14.373 1.00 25.45 C ATOM 1056 CD2 LEU B 161 -35.544 -15.493 13.264 1.00 27.63 C ATOM 0 H LEU B 161 -32.827 -11.378 13.595 1.00 27.01 H new ATOM 0 HA LEU B 161 -31.960 -13.754 14.614 1.00 25.22 H new ATOM 0 HB2 LEU B 161 -34.308 -13.589 14.656 1.00 24.55 H new ATOM 0 HB3 LEU B 161 -34.324 -13.163 13.156 1.00 24.55 H new ATOM 0 HG LEU B 161 -33.629 -15.327 12.527 1.00 27.65 H new ATOM 0 HD11 LEU B 161 -33.488 -17.041 14.089 1.00 25.45 H new ATOM 0 HD12 LEU B 161 -32.410 -15.924 14.399 1.00 25.45 H new ATOM 0 HD13 LEU B 161 -33.739 -16.002 15.257 1.00 25.45 H new ATOM 0 HD21 LEU B 161 -35.662 -16.419 13.002 1.00 27.63 H new ATOM 0 HD22 LEU B 161 -35.979 -15.341 14.117 1.00 27.63 H new ATOM 0 HD23 LEU B 161 -35.939 -14.915 12.593 1.00 27.63 H new ATOM 1057 N LYS B 162 -30.728 -14.278 12.521 1.00 24.88 N ATOM 1058 CA LYS B 162 -30.071 -14.510 11.246 1.00 29.52 C ATOM 1059 C LYS B 162 -30.866 -15.627 10.520 1.00 29.35 C ATOM 1060 O LYS B 162 -31.197 -16.607 11.115 1.00 31.71 O ATOM 1061 CB LYS B 162 -28.641 -14.899 11.477 1.00 33.03 C ATOM 1062 CG LYS B 162 -27.712 -14.686 10.287 1.00 38.06 C ATOM 1063 CD LYS B 162 -26.438 -15.564 10.410 1.00 40.16 C ATOM 1064 CE LYS B 162 -25.693 -15.383 11.747 1.00 45.34 C ATOM 1065 NZ LYS B 162 -24.516 -16.284 11.945 1.00 44.90 N ATOM 0 H LYS B 162 -30.389 -14.698 13.190 1.00 24.88 H new ATOM 0 HA LYS B 162 -30.060 -13.711 10.696 1.00 29.52 H new ATOM 0 HB2 LYS B 162 -28.300 -14.392 12.230 1.00 33.03 H new ATOM 0 HB3 LYS B 162 -28.612 -15.835 11.729 1.00 33.03 H new ATOM 0 HG2 LYS B 162 -28.179 -14.902 9.465 1.00 38.06 H new ATOM 0 HG3 LYS B 162 -27.460 -13.751 10.233 1.00 38.06 H new ATOM 0 HD2 LYS B 162 -26.686 -16.496 10.310 1.00 40.16 H new ATOM 0 HD3 LYS B 162 -25.835 -15.351 9.681 1.00 40.16 H new ATOM 0 HE2 LYS B 162 -25.393 -14.463 11.812 1.00 45.34 H new ATOM 0 HE3 LYS B 162 -26.320 -15.529 12.473 1.00 45.34 H new ATOM 0 HZ1 LYS B 162 -24.144 -16.117 12.736 1.00 44.90 H new ATOM 0 HZ2 LYS B 162 -24.783 -17.132 11.916 1.00 44.90 H new ATOM 0 HZ3 LYS B 162 -23.919 -16.139 11.301 1.00 44.90 H new ATOM 1066 N LEU B 163 -31.260 -15.408 9.277 1.00 29.85 N ATOM 1067 CA LEU B 163 -31.886 -16.459 8.437 1.00 30.45 C ATOM 1068 C LEU B 163 -31.057 -16.687 7.169 1.00 28.92 C ATOM 1069 O LEU B 163 -30.414 -15.734 6.685 1.00 28.27 O ATOM 1070 CB LEU B 163 -33.309 -16.086 8.078 1.00 29.42 C ATOM 1071 CG LEU B 163 -34.240 -15.778 9.254 1.00 32.21 C ATOM 1072 CD1 LEU B 163 -35.586 -15.254 8.793 1.00 33.24 C ATOM 1073 CD2 LEU B 163 -34.478 -17.000 10.121 1.00 31.96 C ATOM 0 H LEU B 163 -31.178 -14.649 8.882 1.00 29.85 H new ATOM 0 HA LEU B 163 -31.910 -17.284 8.947 1.00 30.45 H new ATOM 0 HB2 LEU B 163 -33.284 -15.310 7.497 1.00 29.42 H new ATOM 0 HB3 LEU B 163 -33.695 -16.813 7.565 1.00 29.42 H new ATOM 0 HG LEU B 163 -33.788 -15.094 9.772 1.00 32.21 H new ATOM 0 HD11 LEU B 163 -36.144 -15.072 9.565 1.00 33.24 H new ATOM 0 HD12 LEU B 163 -35.459 -14.437 8.286 1.00 33.24 H new ATOM 0 HD13 LEU B 163 -36.017 -15.918 8.232 1.00 33.24 H new ATOM 0 HD21 LEU B 163 -35.070 -16.767 10.853 1.00 31.96 H new ATOM 0 HD22 LEU B 163 -34.884 -17.701 9.588 1.00 31.96 H new ATOM 0 HD23 LEU B 163 -33.632 -17.314 10.477 1.00 31.96 H new ATOM 1074 N MET B 164 -30.999 -17.953 6.720 1.00 28.24 N ATOM 1075 CA MET B 164 -30.453 -18.347 5.418 1.00 33.12 C ATOM 1076 C MET B 164 -31.618 -18.571 4.449 1.00 32.02 C ATOM 1077 O MET B 164 -32.498 -19.407 4.687 1.00 29.51 O ATOM 1078 CB MET B 164 -29.576 -19.606 5.539 1.00 42.01 C ATOM 1079 CG MET B 164 -28.639 -19.873 4.336 1.00 53.16 C ATOM 1080 SD MET B 164 -27.595 -18.510 3.663 1.00 75.17 S ATOM 1081 CE MET B 164 -26.086 -19.336 3.097 1.00 71.88 C ATOM 0 H MET B 164 -31.285 -18.620 7.181 1.00 28.24 H new ATOM 0 HA MET B 164 -29.881 -17.641 5.079 1.00 33.12 H new ATOM 0 HB2 MET B 164 -29.036 -19.531 6.341 1.00 42.01 H new ATOM 0 HB3 MET B 164 -30.154 -20.376 5.658 1.00 42.01 H new ATOM 0 HG2 MET B 164 -28.043 -20.595 4.589 1.00 53.16 H new ATOM 0 HG3 MET B 164 -29.190 -20.201 3.608 1.00 53.16 H new ATOM 0 HE1 MET B 164 -25.477 -18.679 2.725 1.00 71.88 H new ATOM 0 HE2 MET B 164 -25.661 -19.782 3.846 1.00 71.88 H new ATOM 0 HE3 MET B 164 -26.311 -19.990 2.417 1.00 71.88 H new ATOM 1082 N VAL B 165 -31.638 -17.780 3.386 1.00 30.10 N ATOM 1083 CA VAL B 165 -32.754 -17.682 2.467 1.00 31.58 C ATOM 1084 C VAL B 165 -32.395 -18.009 0.983 1.00 33.95 C ATOM 1085 O VAL B 165 -31.593 -17.327 0.359 1.00 31.76 O ATOM 1086 CB VAL B 165 -33.421 -16.295 2.524 1.00 27.18 C ATOM 1087 CG1 VAL B 165 -34.647 -16.217 1.628 1.00 29.27 C ATOM 1088 CG2 VAL B 165 -33.805 -15.912 3.955 1.00 28.82 C ATOM 0 H VAL B 165 -30.979 -17.269 3.175 1.00 30.10 H new ATOM 0 HA VAL B 165 -33.373 -18.363 2.772 1.00 31.58 H new ATOM 0 HB VAL B 165 -32.762 -15.662 2.198 1.00 27.18 H new ATOM 0 HG11 VAL B 165 -35.038 -15.332 1.691 1.00 29.27 H new ATOM 0 HG12 VAL B 165 -34.388 -16.392 0.710 1.00 29.27 H new ATOM 0 HG13 VAL B 165 -35.298 -16.878 1.911 1.00 29.27 H new ATOM 0 HG21 VAL B 165 -34.221 -15.036 3.955 1.00 28.82 H new ATOM 0 HG22 VAL B 165 -34.428 -16.566 4.309 1.00 28.82 H new ATOM 0 HG23 VAL B 165 -33.009 -15.891 4.509 1.00 28.82 H new ATOM 1089 N TYR B 166 -33.125 -18.992 0.436 1.00 33.69 N ATOM 1090 CA TYR B 166 -33.156 -19.324 -0.979 1.00 28.22 C ATOM 1091 C TYR B 166 -34.162 -18.554 -1.690 1.00 25.92 C ATOM 1092 O TYR B 166 -35.359 -18.526 -1.312 1.00 25.92 O ATOM 1093 CB TYR B 166 -33.509 -20.788 -1.171 1.00 32.86 C ATOM 1094 CG TYR B 166 -33.548 -21.233 -2.617 1.00 33.48 C ATOM 1095 CD1 TYR B 166 -34.734 -21.129 -3.373 1.00 37.72 C ATOM 1096 CD2 TYR B 166 -32.407 -21.780 -3.227 1.00 33.16 C ATOM 1097 CE1 TYR B 166 -34.783 -21.529 -4.707 1.00 37.62 C ATOM 1098 CE2 TYR B 166 -32.454 -22.175 -4.560 1.00 37.18 C ATOM 1099 CZ TYR B 166 -33.659 -22.059 -5.281 1.00 35.97 C ATOM 1100 OH TYR B 166 -33.712 -22.412 -6.587 1.00 41.77 O ATOM 0 H TYR B 166 -33.634 -19.500 0.908 1.00 33.69 H new ATOM 0 HA TYR B 166 -32.274 -19.123 -1.328 1.00 28.22 H new ATOM 0 HB2 TYR B 166 -32.863 -21.331 -0.693 1.00 32.86 H new ATOM 0 HB3 TYR B 166 -34.375 -20.957 -0.768 1.00 32.86 H new ATOM 0 HD1 TYR B 166 -35.500 -20.786 -2.973 1.00 37.72 H new ATOM 0 HD2 TYR B 166 -31.621 -21.878 -2.740 1.00 33.16 H new ATOM 0 HE1 TYR B 166 -35.567 -21.437 -5.199 1.00 37.62 H new ATOM 0 HE2 TYR B 166 -31.693 -22.514 -4.974 1.00 37.18 H new ATOM 0 HH TYR B 166 -32.934 -22.553 -6.871 1.00 41.77 H new ATOM 1101 N ASN B 167 -33.726 -17.918 -2.771 1.00 26.51 N ATOM 1102 CA ASN B 167 -34.682 -17.331 -3.657 1.00 28.55 C ATOM 1103 C ASN B 167 -34.838 -18.098 -5.037 1.00 29.76 C ATOM 1104 O ASN B 167 -33.861 -18.517 -5.660 1.00 35.40 O ATOM 1105 CB ASN B 167 -34.315 -15.875 -3.808 1.00 28.15 C ATOM 1106 CG ASN B 167 -35.290 -15.155 -4.620 1.00 25.53 C ATOM 1107 OD1 ASN B 167 -35.190 -15.244 -5.854 1.00 28.88 O ATOM 1108 ND2 ASN B 167 -36.274 -14.462 -3.990 1.00 23.42 N ATOM 0 H ASN B 167 -32.901 -17.823 -2.995 1.00 26.51 H new ATOM 0 HA ASN B 167 -35.570 -17.408 -3.275 1.00 28.55 H new ATOM 0 HB2 ASN B 167 -34.256 -15.463 -2.932 1.00 28.15 H new ATOM 0 HB3 ASN B 167 -33.438 -15.803 -4.215 1.00 28.15 H new ATOM 0 HD21 ASN B 167 -36.874 -14.053 -4.450 1.00 23.42 H new ATOM 0 HD22 ASN B 167 -36.297 -14.433 -3.131 1.00 23.42 H new ATOM 1109 N SER B 168 -36.066 -18.255 -5.508 1.00 32.51 N ATOM 1110 CA SER B 168 -36.353 -19.133 -6.683 1.00 30.43 C ATOM 1111 C SER B 168 -36.103 -18.469 -8.056 1.00 36.39 C ATOM 1112 O SER B 168 -35.967 -19.162 -9.048 1.00 44.04 O ATOM 1113 CB SER B 168 -37.798 -19.678 -6.607 1.00 27.07 C ATOM 1114 OG SER B 168 -38.822 -18.656 -6.651 1.00 23.53 O ATOM 0 H SER B 168 -36.760 -17.871 -5.175 1.00 32.51 H new ATOM 0 HA SER B 168 -35.716 -19.862 -6.625 1.00 30.43 H new ATOM 0 HB2 SER B 168 -37.939 -20.295 -7.342 1.00 27.07 H new ATOM 0 HB3 SER B 168 -37.898 -20.187 -5.787 1.00 27.07 H new ATOM 0 HG SER B 168 -39.559 -18.987 -6.421 1.00 23.53 H new ATOM 1115 N LYS B 169 -36.075 -17.142 -8.131 1.00 36.42 N ATOM 1116 CA LYS B 169 -35.587 -16.442 -9.358 1.00 37.00 C ATOM 1117 C LYS B 169 -34.039 -16.466 -9.506 1.00 36.75 C ATOM 1118 O LYS B 169 -33.535 -16.745 -10.535 1.00 35.06 O ATOM 1119 CB LYS B 169 -36.131 -15.036 -9.429 1.00 30.63 C ATOM 1120 CG LYS B 169 -37.642 -15.030 -9.326 1.00 31.69 C ATOM 1121 CD LYS B 169 -38.149 -13.610 -9.344 1.00 37.98 C ATOM 1122 CE LYS B 169 -39.655 -13.488 -9.551 1.00 39.86 C ATOM 1123 NZ LYS B 169 -40.129 -14.086 -10.809 1.00 40.60 N ATOM 0 H LYS B 169 -36.328 -16.618 -7.498 1.00 36.42 H new ATOM 0 HA LYS B 169 -35.931 -16.941 -10.115 1.00 37.00 H new ATOM 0 HB2 LYS B 169 -35.753 -14.503 -8.712 1.00 30.63 H new ATOM 0 HB3 LYS B 169 -35.859 -14.623 -10.263 1.00 30.63 H new ATOM 0 HG2 LYS B 169 -38.027 -15.529 -10.063 1.00 31.69 H new ATOM 0 HG3 LYS B 169 -37.921 -15.472 -8.508 1.00 31.69 H new ATOM 0 HD2 LYS B 169 -37.912 -13.182 -8.507 1.00 37.98 H new ATOM 0 HD3 LYS B 169 -37.695 -13.124 -10.050 1.00 37.98 H new ATOM 0 HE2 LYS B 169 -40.111 -13.913 -8.808 1.00 39.86 H new ATOM 0 HE3 LYS B 169 -39.901 -12.550 -9.535 1.00 39.86 H new ATOM 0 HZ1 LYS B 169 -40.955 -13.802 -10.981 1.00 40.60 H new ATOM 0 HZ2 LYS B 169 -39.589 -13.846 -11.474 1.00 40.60 H new ATOM 0 HZ3 LYS B 169 -40.131 -14.973 -10.734 1.00 40.60 H new ATOM 1124 N SER B 170 -33.315 -16.261 -8.447 1.00 34.71 N ATOM 1125 CA SER B 170 -31.900 -16.259 -8.514 1.00 37.31 C ATOM 1126 C SER B 170 -31.355 -17.676 -8.466 1.00 41.10 C ATOM 1127 O SER B 170 -30.218 -17.887 -8.871 1.00 49.51 O ATOM 1128 CB SER B 170 -31.300 -15.382 -7.343 1.00 38.33 C ATOM 1129 OG SER B 170 -31.128 -16.039 -6.059 1.00 35.37 O ATOM 0 H SER B 170 -33.637 -16.118 -7.662 1.00 34.71 H new ATOM 0 HA SER B 170 -31.631 -15.867 -9.360 1.00 37.31 H new ATOM 0 HB2 SER B 170 -30.437 -15.045 -7.629 1.00 38.33 H new ATOM 0 HB3 SER B 170 -31.877 -14.613 -7.215 1.00 38.33 H new ATOM 0 HG SER B 170 -31.001 -15.461 -5.463 1.00 35.37 H new ATOM 1130 N ASP B 171 -32.084 -18.627 -7.905 1.00 35.40 N ATOM 1131 CA ASP B 171 -31.505 -19.955 -7.665 1.00 40.05 C ATOM 1132 C ASP B 171 -30.192 -19.853 -6.851 1.00 43.18 C ATOM 1133 O ASP B 171 -29.241 -20.644 -7.032 1.00 48.97 O ATOM 1134 CB ASP B 171 -31.343 -20.820 -8.978 1.00 39.16 C ATOM 1135 CG ASP B 171 -30.750 -22.285 -8.692 1.00 44.60 C ATOM 1136 OD1 ASP B 171 -31.026 -22.916 -7.619 1.00 42.06 O ATOM 1137 OD2 ASP B 171 -29.978 -22.816 -9.543 1.00 47.90 O ATOM 0 H ASP B 171 -32.902 -18.535 -7.657 1.00 35.40 H new ATOM 0 HA ASP B 171 -32.146 -20.443 -7.125 1.00 40.05 H new ATOM 0 HB2 ASP B 171 -32.206 -20.905 -9.413 1.00 39.16 H new ATOM 0 HB3 ASP B 171 -30.758 -20.354 -9.596 1.00 39.16 H new ATOM 1138 N SER B 172 -30.178 -18.909 -5.911 1.00 45.12 N ATOM 1139 CA SER B 172 -29.027 -18.649 -5.076 1.00 49.56 C ATOM 1140 C SER B 172 -29.510 -18.390 -3.654 1.00 47.14 C ATOM 1141 O SER B 172 -30.610 -17.916 -3.467 1.00 35.63 O ATOM 1142 CB SER B 172 -28.249 -17.397 -5.559 1.00 57.19 C ATOM 1143 OG SER B 172 -28.207 -17.265 -6.982 1.00 70.00 O ATOM 0 H SER B 172 -30.850 -18.399 -5.744 1.00 45.12 H new ATOM 0 HA SER B 172 -28.437 -19.418 -5.119 1.00 49.56 H new ATOM 0 HB2 SER B 172 -28.659 -16.604 -5.180 1.00 57.19 H new ATOM 0 HB3 SER B 172 -27.342 -17.438 -5.218 1.00 57.19 H new ATOM 0 HG SER B 172 -28.975 -17.389 -7.298 1.00 70.00 H new ATOM 1144 N CYS B 173 -28.642 -18.675 -2.682 1.00 46.82 N ATOM 1145 CA CYS B 173 -28.887 -18.407 -1.276 1.00 45.02 C ATOM 1146 C CYS B 173 -28.212 -17.087 -0.829 1.00 42.35 C ATOM 1147 O CYS B 173 -27.179 -16.662 -1.395 1.00 35.06 O ATOM 1148 CB CYS B 173 -28.391 -19.572 -0.445 1.00 52.07 C ATOM 1149 SG CYS B 173 -29.583 -20.925 -0.372 1.00 65.23 S ATOM 0 H CYS B 173 -27.877 -19.038 -2.832 1.00 46.82 H new ATOM 0 HA CYS B 173 -29.842 -18.303 -1.142 1.00 45.02 H new ATOM 0 HB2 CYS B 173 -27.557 -19.899 -0.817 1.00 52.07 H new ATOM 0 HB3 CYS B 173 -28.199 -19.265 0.455 1.00 52.07 H new ATOM 0 HG CYS B 173 -29.136 -21.817 0.295 1.00 65.23 H new ATOM 1150 N ARG B 174 -28.838 -16.444 0.171 1.00 36.41 N ATOM 1151 CA ARG B 174 -28.295 -15.262 0.879 1.00 29.83 C ATOM 1152 C ARG B 174 -28.670 -15.241 2.385 1.00 34.11 C ATOM 1153 O ARG B 174 -29.664 -15.823 2.816 1.00 30.53 O ATOM 1154 CB ARG B 174 -28.782 -14.012 0.215 1.00 26.20 C ATOM 1155 CG ARG B 174 -30.197 -13.619 0.566 1.00 23.97 C ATOM 1156 CD ARG B 174 -30.631 -12.462 -0.240 1.00 24.42 C ATOM 1157 NE ARG B 174 -31.959 -11.924 0.134 1.00 27.04 N ATOM 1158 CZ ARG B 174 -33.137 -12.450 -0.204 1.00 29.00 C ATOM 1159 NH1 ARG B 174 -33.185 -13.547 -0.963 1.00 32.19 N ATOM 1160 NH2 ARG B 174 -34.276 -11.854 0.192 1.00 26.94 N ATOM 0 H ARG B 174 -29.609 -16.687 0.465 1.00 36.41 H new ATOM 0 HA ARG B 174 -27.328 -15.314 0.829 1.00 29.83 H new ATOM 0 HB2 ARG B 174 -28.189 -13.282 0.453 1.00 26.20 H new ATOM 0 HB3 ARG B 174 -28.720 -14.126 -0.746 1.00 26.20 H new ATOM 0 HG2 ARG B 174 -30.793 -14.368 0.412 1.00 23.97 H new ATOM 0 HG3 ARG B 174 -30.253 -13.401 1.510 1.00 23.97 H new ATOM 0 HD2 ARG B 174 -29.972 -11.756 -0.154 1.00 24.42 H new ATOM 0 HD3 ARG B 174 -30.650 -12.721 -1.175 1.00 24.42 H new ATOM 0 HE ARG B 174 -31.972 -11.209 0.612 1.00 27.04 H new ATOM 0 HH11 ARG B 174 -32.456 -13.915 -1.234 1.00 32.19 H new ATOM 0 HH12 ARG B 174 -33.945 -13.886 -1.181 1.00 32.19 H new ATOM 0 HH21 ARG B 174 -34.244 -11.135 0.662 1.00 26.94 H new ATOM 0 HH22 ARG B 174 -35.036 -12.192 -0.025 1.00 26.94 H new ATOM 1161 N GLU B 175 -27.836 -14.587 3.185 1.00 37.82 N ATOM 1162 CA GLU B 175 -28.095 -14.416 4.601 1.00 40.89 C ATOM 1163 C GLU B 175 -28.993 -13.161 4.714 1.00 39.70 C ATOM 1164 O GLU B 175 -28.712 -12.135 4.113 1.00 46.07 O ATOM 1165 CB GLU B 175 -26.769 -14.324 5.371 1.00 47.34 C ATOM 1166 CG GLU B 175 -26.911 -14.086 6.880 1.00 59.31 C ATOM 1167 CD GLU B 175 -25.636 -13.502 7.552 1.00 69.65 C ATOM 1168 OE1 GLU B 175 -24.654 -14.282 7.806 1.00 65.59 O ATOM 1169 OE2 GLU B 175 -25.646 -12.268 7.860 1.00 70.55 O ATOM 0 H GLU B 175 -27.101 -14.230 2.917 1.00 37.82 H new ATOM 0 HA GLU B 175 -28.556 -15.169 5.003 1.00 40.89 H new ATOM 0 HB2 GLU B 175 -26.272 -15.145 5.232 1.00 47.34 H new ATOM 0 HB3 GLU B 175 -26.240 -13.605 4.992 1.00 47.34 H new ATOM 0 HG2 GLU B 175 -27.653 -13.480 7.034 1.00 59.31 H new ATOM 0 HG3 GLU B 175 -27.136 -14.925 7.311 1.00 59.31 H new ATOM 1170 N VAL B 176 -30.131 -13.292 5.394 1.00 39.03 N ATOM 1171 CA VAL B 176 -30.998 -12.169 5.792 1.00 36.40 C ATOM 1172 C VAL B 176 -30.986 -12.056 7.351 1.00 34.59 C ATOM 1173 O VAL B 176 -30.686 -13.043 8.049 1.00 29.84 O ATOM 1174 CB VAL B 176 -32.430 -12.441 5.319 1.00 40.08 C ATOM 1175 CG1 VAL B 176 -33.369 -11.264 5.623 1.00 39.33 C ATOM 1176 CG2 VAL B 176 -32.433 -12.791 3.825 1.00 44.19 C ATOM 0 H VAL B 176 -30.433 -14.057 5.646 1.00 39.03 H new ATOM 0 HA VAL B 176 -30.676 -11.345 5.394 1.00 36.40 H new ATOM 0 HB VAL B 176 -32.771 -13.201 5.815 1.00 40.08 H new ATOM 0 HG11 VAL B 176 -34.263 -11.474 5.310 1.00 39.33 H new ATOM 0 HG12 VAL B 176 -33.391 -11.106 6.580 1.00 39.33 H new ATOM 0 HG13 VAL B 176 -33.047 -10.468 5.172 1.00 39.33 H new ATOM 0 HG21 VAL B 176 -33.343 -12.962 3.534 1.00 44.19 H new ATOM 0 HG22 VAL B 176 -32.065 -12.050 3.318 1.00 44.19 H new ATOM 0 HG23 VAL B 176 -31.893 -13.583 3.677 1.00 44.19 H new ATOM 1177 N THR B 177 -31.277 -10.868 7.897 1.00 32.92 N ATOM 1178 CA THR B 177 -31.353 -10.695 9.382 1.00 29.78 C ATOM 1179 C THR B 177 -32.611 -9.978 9.568 1.00 25.11 C ATOM 1180 O THR B 177 -32.805 -8.926 9.007 1.00 28.28 O ATOM 1181 CB THR B 177 -30.201 -9.886 10.068 1.00 29.07 C ATOM 1182 OG1 THR B 177 -29.019 -10.653 10.072 1.00 30.95 O ATOM 1183 CG2 THR B 177 -30.478 -9.632 11.556 1.00 29.49 C ATOM 0 H THR B 177 -31.433 -10.154 7.445 1.00 32.92 H new ATOM 0 HA THR B 177 -31.279 -11.568 9.799 1.00 29.78 H new ATOM 0 HB THR B 177 -30.129 -9.055 9.572 1.00 29.07 H new ATOM 0 HG1 THR B 177 -28.381 -10.184 10.354 1.00 30.95 H new ATOM 0 HG21 THR B 177 -29.743 -9.130 11.941 1.00 29.49 H new ATOM 0 HG22 THR B 177 -31.300 -9.125 11.650 1.00 29.49 H new ATOM 0 HG23 THR B 177 -30.567 -10.480 12.018 1.00 29.49 H new ATOM 1184 N VAL B 178 -33.485 -10.546 10.360 1.00 24.14 N ATOM 1185 CA VAL B 178 -34.784 -9.920 10.635 1.00 23.20 C ATOM 1186 C VAL B 178 -34.933 -9.659 12.147 1.00 22.24 C ATOM 1187 O VAL B 178 -34.317 -10.327 12.921 1.00 22.19 O ATOM 1188 CB VAL B 178 -35.899 -10.777 10.064 1.00 22.02 C ATOM 1189 CG1 VAL B 178 -35.927 -12.151 10.750 1.00 24.15 C ATOM 1190 CG2 VAL B 178 -37.212 -10.075 10.213 1.00 24.44 C ATOM 0 H VAL B 178 -33.359 -11.298 10.758 1.00 24.14 H new ATOM 0 HA VAL B 178 -34.840 -9.057 10.197 1.00 23.20 H new ATOM 0 HB VAL B 178 -35.734 -10.920 9.119 1.00 22.02 H new ATOM 0 HG11 VAL B 178 -36.644 -12.686 10.375 1.00 24.15 H new ATOM 0 HG12 VAL B 178 -35.080 -12.601 10.608 1.00 24.15 H new ATOM 0 HG13 VAL B 178 -36.075 -12.035 11.702 1.00 24.15 H new ATOM 0 HG21 VAL B 178 -37.919 -10.629 9.846 1.00 24.44 H new ATOM 0 HG22 VAL B 178 -37.386 -9.910 11.153 1.00 24.44 H new ATOM 0 HG23 VAL B 178 -37.183 -9.230 9.737 1.00 24.44 H new ATOM 1191 N THR B 179 -35.743 -8.680 12.543 1.00 21.27 N ATOM 1192 CA THR B 179 -35.839 -8.263 13.907 1.00 20.57 C ATOM 1193 C THR B 179 -37.318 -8.223 14.166 1.00 20.83 C ATOM 1194 O THR B 179 -37.923 -7.210 13.885 1.00 20.92 O ATOM 1195 CB THR B 179 -35.197 -6.864 14.184 1.00 20.85 C ATOM 1196 OG1 THR B 179 -33.790 -6.875 13.915 1.00 22.03 O ATOM 1197 CG2 THR B 179 -35.339 -6.536 15.650 1.00 23.83 C ATOM 0 H THR B 179 -36.254 -8.242 12.008 1.00 21.27 H new ATOM 0 HA THR B 179 -35.352 -8.868 14.488 1.00 20.57 H new ATOM 0 HB THR B 179 -35.646 -6.220 13.614 1.00 20.85 H new ATOM 0 HG1 THR B 179 -33.623 -6.361 13.272 1.00 22.03 H new ATOM 0 HG21 THR B 179 -34.942 -5.669 15.828 1.00 23.83 H new ATOM 0 HG22 THR B 179 -36.279 -6.516 15.888 1.00 23.83 H new ATOM 0 HG23 THR B 179 -34.887 -7.212 16.178 1.00 23.83 H new ATOM 1198 N PRO B 180 -37.915 -9.343 14.677 1.00 21.09 N ATOM 1199 CA PRO B 180 -39.321 -9.402 14.825 1.00 21.51 C ATOM 1200 C PRO B 180 -39.795 -8.349 15.782 1.00 25.98 C ATOM 1201 O PRO B 180 -39.025 -7.979 16.689 1.00 22.62 O ATOM 1202 CB PRO B 180 -39.544 -10.787 15.437 1.00 22.00 C ATOM 1203 CG PRO B 180 -38.387 -11.604 15.062 1.00 21.30 C ATOM 1204 CD PRO B 180 -37.281 -10.608 15.119 1.00 22.28 C ATOM 0 HA PRO B 180 -39.796 -9.258 13.992 1.00 21.51 H new ATOM 0 HB2 PRO B 180 -39.626 -10.728 16.402 1.00 22.00 H new ATOM 0 HB3 PRO B 180 -40.366 -11.182 15.106 1.00 22.00 H new ATOM 0 HG2 PRO B 180 -38.246 -12.340 15.678 1.00 21.30 H new ATOM 0 HG3 PRO B 180 -38.485 -11.989 14.177 1.00 21.30 H new ATOM 0 HD2 PRO B 180 -36.919 -10.530 16.016 1.00 22.28 H new ATOM 0 HD3 PRO B 180 -36.546 -10.859 14.538 1.00 22.28 H new ATOM 1205 N ASN B 181 -41.044 -7.895 15.608 1.00 25.45 N ATOM 1206 CA ASN B 181 -41.571 -6.856 16.447 1.00 24.73 C ATOM 1207 C ASN B 181 -43.036 -7.030 16.543 1.00 24.27 C ATOM 1208 O ASN B 181 -43.791 -6.572 15.703 1.00 24.79 O ATOM 1209 CB ASN B 181 -41.161 -5.455 15.899 1.00 25.80 C ATOM 1210 CG ASN B 181 -41.842 -4.262 16.668 1.00 28.39 C ATOM 1211 OD1 ASN B 181 -42.545 -4.424 17.675 1.00 22.82 O ATOM 1212 ND2 ASN B 181 -41.642 -3.078 16.142 1.00 25.93 N ATOM 0 H ASN B 181 -41.587 -8.185 15.008 1.00 25.45 H new ATOM 0 HA ASN B 181 -41.200 -6.915 17.341 1.00 24.73 H new ATOM 0 HB2 ASN B 181 -40.197 -5.361 15.957 1.00 25.80 H new ATOM 0 HB3 ASN B 181 -41.395 -5.401 14.959 1.00 25.80 H new ATOM 0 HD21 ASN B 181 -42.004 -2.383 16.497 1.00 25.93 H new ATOM 0 HD22 ASN B 181 -41.149 -2.996 15.442 1.00 25.93 H new ATOM 1213 N ALA B 182 -43.437 -7.686 17.606 1.00 25.78 N ATOM 1214 CA ALA B 182 -44.835 -7.909 17.942 1.00 28.67 C ATOM 1215 C ALA B 182 -45.652 -6.649 17.935 1.00 28.82 C ATOM 1216 O ALA B 182 -46.821 -6.695 17.681 1.00 37.82 O ATOM 1217 CB ALA B 182 -44.899 -8.532 19.314 1.00 29.44 C ATOM 0 H ALA B 182 -42.891 -8.028 18.176 1.00 25.78 H new ATOM 0 HA ALA B 182 -45.212 -8.492 17.264 1.00 28.67 H new ATOM 0 HB1 ALA B 182 -45.825 -8.688 19.556 1.00 29.44 H new ATOM 0 HB2 ALA B 182 -44.420 -9.375 19.309 1.00 29.44 H new ATOM 0 HB3 ALA B 182 -44.493 -7.934 19.961 1.00 29.44 H new ATOM 1218 N ALA B 183 -45.013 -5.523 18.209 1.00 32.11 N ATOM 1219 CA ALA B 183 -45.647 -4.206 18.207 1.00 32.83 C ATOM 1220 C ALA B 183 -45.601 -3.501 16.865 1.00 32.24 C ATOM 1221 O ALA B 183 -46.030 -2.408 16.760 1.00 31.55 O ATOM 1222 CB ALA B 183 -44.993 -3.326 19.280 1.00 35.73 C ATOM 0 H ALA B 183 -44.176 -5.498 18.407 1.00 32.11 H new ATOM 0 HA ALA B 183 -46.586 -4.351 18.401 1.00 32.83 H new ATOM 0 HB1 ALA B 183 -45.412 -2.451 19.281 1.00 35.73 H new ATOM 0 HB2 ALA B 183 -45.106 -3.739 20.150 1.00 35.73 H new ATOM 0 HB3 ALA B 183 -44.047 -3.231 19.088 1.00 35.73 H new ATOM 1223 N TRP B 184 -45.123 -4.123 15.810 1.00 36.38 N ATOM 1224 CA TRP B 184 -44.971 -3.431 14.533 1.00 33.70 C ATOM 1225 C TRP B 184 -46.285 -2.814 14.083 1.00 36.10 C ATOM 1226 O TRP B 184 -46.284 -1.952 13.265 1.00 38.84 O ATOM 1227 CB TRP B 184 -44.359 -4.369 13.482 1.00 34.68 C ATOM 1228 CG TRP B 184 -45.355 -5.334 12.898 1.00 38.10 C ATOM 1229 CD1 TRP B 184 -45.877 -6.502 13.457 1.00 33.23 C ATOM 1230 CD2 TRP B 184 -45.963 -5.190 11.621 1.00 37.57 C ATOM 1231 NE1 TRP B 184 -46.795 -7.038 12.607 1.00 36.32 N ATOM 1232 CE2 TRP B 184 -46.865 -6.259 11.468 1.00 39.08 C ATOM 1233 CE3 TRP B 184 -45.815 -4.259 10.579 1.00 35.95 C ATOM 1234 CZ2 TRP B 184 -47.625 -6.421 10.296 1.00 42.33 C ATOM 1235 CZ3 TRP B 184 -46.588 -4.404 9.436 1.00 40.92 C ATOM 1236 CH2 TRP B 184 -47.467 -5.483 9.297 1.00 39.84 C ATOM 0 H TRP B 184 -44.878 -4.947 15.804 1.00 36.38 H new ATOM 0 HA TRP B 184 -44.351 -2.694 14.648 1.00 33.70 H new ATOM 0 HB2 TRP B 184 -43.975 -3.838 12.767 1.00 34.68 H new ATOM 0 HB3 TRP B 184 -43.632 -4.868 13.886 1.00 34.68 H new ATOM 0 HD1 TRP B 184 -45.635 -6.858 14.281 1.00 33.23 H new ATOM 0 HE1 TRP B 184 -47.257 -7.748 12.755 1.00 36.32 H new ATOM 0 HE3 TRP B 184 -45.209 -3.557 10.654 1.00 35.95 H new ATOM 0 HZ2 TRP B 184 -48.213 -7.135 10.198 1.00 42.33 H new ATOM 0 HZ3 TRP B 184 -46.521 -3.776 8.754 1.00 40.92 H new ATOM 0 HH2 TRP B 184 -47.957 -5.570 8.511 1.00 39.84 H new ATOM 1237 N GLY B 185 -47.404 -3.279 14.608 1.00 39.67 N ATOM 1238 CA GLY B 185 -48.680 -2.555 14.524 1.00 42.28 C ATOM 1239 C GLY B 185 -49.655 -3.275 13.628 1.00 46.86 C ATOM 1240 O GLY B 185 -50.300 -2.687 12.795 1.00 53.61 O ATOM 0 H GLY B 185 -47.455 -4.028 15.028 1.00 39.67 H new ATOM 0 HA2 GLY B 185 -49.061 -2.461 15.411 1.00 42.28 H new ATOM 0 HA3 GLY B 185 -48.525 -1.659 14.185 1.00 42.28 H new ATOM 1241 N GLY B 186 -49.775 -4.567 13.847 1.00 52.24 N ATOM 1242 CA GLY B 186 -50.209 -5.483 12.824 1.00 46.71 C ATOM 1243 C GLY B 186 -50.150 -6.857 13.441 1.00 47.61 C ATOM 1244 O GLY B 186 -49.627 -7.037 14.562 1.00 38.35 O ATOM 0 H GLY B 186 -49.604 -4.940 14.603 1.00 52.24 H new ATOM 0 HA2 GLY B 186 -51.109 -5.273 12.530 1.00 46.71 H new ATOM 0 HA3 GLY B 186 -49.636 -5.428 12.044 1.00 46.71 H new ATOM 1245 N GLU B 187 -50.717 -7.807 12.698 1.00 51.37 N ATOM 1246 CA GLU B 187 -50.751 -9.208 13.082 1.00 49.24 C ATOM 1247 C GLU B 187 -49.320 -9.794 13.126 1.00 43.05 C ATOM 1248 O GLU B 187 -48.426 -9.447 12.298 1.00 43.98 O ATOM 1249 CB GLU B 187 -51.632 -9.948 12.067 1.00 55.02 C ATOM 1250 CG GLU B 187 -51.946 -11.395 12.375 1.00 55.38 C ATOM 1251 CD GLU B 187 -53.067 -11.950 11.481 1.00 57.34 C ATOM 1252 OE1 GLU B 187 -53.651 -12.963 11.927 1.00 54.28 O ATOM 1253 OE2 GLU B 187 -53.337 -11.420 10.338 1.00 51.01 O ATOM 0 H GLU B 187 -51.098 -7.648 11.944 1.00 51.37 H new ATOM 0 HA GLU B 187 -51.122 -9.310 13.972 1.00 49.24 H new ATOM 0 HB2 GLU B 187 -52.470 -9.466 11.984 1.00 55.02 H new ATOM 0 HB3 GLU B 187 -51.196 -9.909 11.201 1.00 55.02 H new ATOM 0 HG2 GLU B 187 -51.146 -11.930 12.257 1.00 55.38 H new ATOM 0 HG3 GLU B 187 -52.207 -11.477 13.306 1.00 55.38 H new ATOM 1254 N GLY B 188 -49.108 -10.640 14.127 1.00 34.91 N ATOM 1255 CA GLY B 188 -47.855 -11.317 14.306 1.00 36.33 C ATOM 1256 C GLY B 188 -46.739 -10.379 14.726 1.00 33.17 C ATOM 1257 O GLY B 188 -46.955 -9.287 15.275 1.00 35.47 O ATOM 0 H GLY B 188 -49.699 -10.832 14.721 1.00 34.91 H new ATOM 0 HA2 GLY B 188 -47.959 -12.011 14.976 1.00 36.33 H new ATOM 0 HA3 GLY B 188 -47.608 -11.757 13.478 1.00 36.33 H new ATOM 1258 N SER B 189 -45.536 -10.845 14.511 1.00 25.97 N ATOM 1259 CA SER B 189 -44.395 -10.034 14.774 1.00 25.70 C ATOM 1260 C SER B 189 -43.504 -9.897 13.557 1.00 29.21 C ATOM 1261 O SER B 189 -42.514 -9.131 13.587 1.00 27.44 O ATOM 1262 CB SER B 189 -43.638 -10.613 15.964 1.00 22.65 C ATOM 1263 OG SER B 189 -42.939 -11.798 15.637 1.00 25.00 O ATOM 0 H SER B 189 -45.363 -11.632 14.212 1.00 25.97 H new ATOM 0 HA SER B 189 -44.692 -9.136 14.991 1.00 25.70 H new ATOM 0 HB2 SER B 189 -43.011 -9.952 16.297 1.00 22.65 H new ATOM 0 HB3 SER B 189 -44.263 -10.798 16.682 1.00 22.65 H new ATOM 0 HG SER B 189 -42.465 -12.033 16.289 1.00 25.00 H new ATOM 1264 N LEU B 190 -43.824 -10.607 12.467 1.00 30.16 N ATOM 1265 CA LEU B 190 -43.082 -10.431 11.219 1.00 31.76 C ATOM 1266 C LEU B 190 -43.838 -9.610 10.162 1.00 25.51 C ATOM 1267 O LEU B 190 -43.236 -8.871 9.379 1.00 24.23 O ATOM 1268 CB LEU B 190 -42.638 -11.812 10.668 1.00 34.18 C ATOM 1269 CG LEU B 190 -41.527 -12.599 11.369 1.00 35.78 C ATOM 1270 CD1 LEU B 190 -41.150 -13.790 10.491 1.00 35.78 C ATOM 1271 CD2 LEU B 190 -40.306 -11.737 11.705 1.00 37.80 C ATOM 0 H LEU B 190 -44.458 -11.187 12.432 1.00 30.16 H new ATOM 0 HA LEU B 190 -42.294 -9.905 11.428 1.00 31.76 H new ATOM 0 HB2 LEU B 190 -43.424 -12.380 10.648 1.00 34.18 H new ATOM 0 HB3 LEU B 190 -42.360 -11.679 9.748 1.00 34.18 H new ATOM 0 HG LEU B 190 -41.862 -12.911 12.224 1.00 35.78 H new ATOM 0 HD11 LEU B 190 -40.446 -14.300 10.922 1.00 35.78 H new ATOM 0 HD12 LEU B 190 -41.927 -14.357 10.363 1.00 35.78 H new ATOM 0 HD13 LEU B 190 -40.837 -13.471 9.630 1.00 35.78 H new ATOM 0 HD21 LEU B 190 -39.636 -12.283 12.146 1.00 37.80 H new ATOM 0 HD22 LEU B 190 -39.936 -11.368 10.888 1.00 37.80 H new ATOM 0 HD23 LEU B 190 -40.572 -11.014 12.294 1.00 37.80 H new ATOM 1272 N GLY B 191 -45.139 -9.792 10.096 1.00 27.60 N ATOM 1273 CA GLY B 191 -45.961 -9.160 9.018 1.00 29.68 C ATOM 1274 C GLY B 191 -45.705 -9.756 7.637 1.00 32.81 C ATOM 1275 O GLY B 191 -45.640 -9.040 6.601 1.00 30.25 O ATOM 0 H GLY B 191 -45.587 -10.272 10.652 1.00 27.60 H new ATOM 0 HA2 GLY B 191 -46.901 -9.258 9.237 1.00 29.68 H new ATOM 0 HA3 GLY B 191 -45.774 -8.209 8.993 1.00 29.68 H new ATOM 1276 N CYS B 192 -45.466 -11.068 7.627 1.00 30.62 N ATOM 1277 CA CYS B 192 -45.571 -11.820 6.416 1.00 29.48 C ATOM 1278 C CYS B 192 -46.370 -13.095 6.621 1.00 29.35 C ATOM 1279 O CYS B 192 -46.668 -13.524 7.750 1.00 27.54 O ATOM 1280 CB CYS B 192 -44.221 -12.103 5.805 1.00 30.01 C ATOM 1281 SG CYS B 192 -43.183 -13.165 6.767 1.00 32.38 S ATOM 0 H CYS B 192 -45.243 -11.527 8.319 1.00 30.62 H new ATOM 0 HA CYS B 192 -46.057 -11.270 5.782 1.00 29.48 H new ATOM 0 HB2 CYS B 192 -44.352 -12.504 4.932 1.00 30.01 H new ATOM 0 HB3 CYS B 192 -43.760 -11.261 5.664 1.00 30.01 H new ATOM 0 HG CYS B 192 -42.140 -13.329 6.197 1.00 32.38 H new ATOM 1282 N GLY B 193 -46.809 -13.636 5.487 1.00 26.82 N ATOM 1283 CA GLY B 193 -47.502 -14.902 5.469 1.00 25.20 C ATOM 1284 C GLY B 193 -46.448 -15.947 5.266 1.00 23.11 C ATOM 1285 O GLY B 193 -45.437 -15.661 4.663 1.00 20.71 O ATOM 0 H GLY B 193 -46.710 -13.274 4.713 1.00 26.82 H new ATOM 0 HA2 GLY B 193 -47.980 -15.048 6.300 1.00 25.20 H new ATOM 0 HA3 GLY B 193 -48.159 -14.928 4.756 1.00 25.20 H new ATOM 1286 N ILE B 194 -46.677 -17.135 5.855 1.00 23.58 N ATOM 1287 CA ILE B 194 -45.751 -18.212 5.826 1.00 23.49 C ATOM 1288 C ILE B 194 -46.524 -19.524 5.511 1.00 24.33 C ATOM 1289 O ILE B 194 -47.634 -19.773 6.001 1.00 18.01 O ATOM 1290 CB ILE B 194 -45.061 -18.274 7.161 1.00 26.83 C ATOM 1291 CG1 ILE B 194 -43.989 -17.186 7.269 1.00 28.42 C ATOM 1292 CG2 ILE B 194 -44.429 -19.615 7.401 1.00 30.33 C ATOM 1293 CD1 ILE B 194 -42.713 -17.468 6.505 1.00 31.11 C ATOM 0 H ILE B 194 -47.400 -17.314 6.285 1.00 23.58 H new ATOM 0 HA ILE B 194 -45.078 -18.088 5.138 1.00 23.49 H new ATOM 0 HB ILE B 194 -45.742 -18.129 7.837 1.00 26.83 H new ATOM 0 HG12 ILE B 194 -44.363 -16.350 6.950 1.00 28.42 H new ATOM 0 HG13 ILE B 194 -43.768 -17.060 8.205 1.00 28.42 H new ATOM 0 HG21 ILE B 194 -43.995 -19.618 8.268 1.00 30.33 H new ATOM 0 HG22 ILE B 194 -45.112 -20.303 7.379 1.00 30.33 H new ATOM 0 HG23 ILE B 194 -43.771 -19.791 6.710 1.00 30.33 H new ATOM 0 HD11 ILE B 194 -42.093 -16.732 6.628 1.00 31.11 H new ATOM 0 HD12 ILE B 194 -42.312 -18.287 6.836 1.00 31.11 H new ATOM 0 HD13 ILE B 194 -42.915 -17.566 5.561 1.00 31.11 H new ATOM 1294 N GLY B 195 -45.916 -20.327 4.640 1.00 22.15 N ATOM 1295 CA GLY B 195 -46.385 -21.647 4.362 1.00 21.11 C ATOM 1296 C GLY B 195 -45.326 -22.670 4.563 1.00 20.06 C ATOM 1297 O GLY B 195 -44.110 -22.361 4.430 1.00 20.07 O ATOM 0 H GLY B 195 -45.213 -20.104 4.197 1.00 22.15 H new ATOM 0 HA2 GLY B 195 -47.141 -21.848 4.936 1.00 21.11 H new ATOM 0 HA3 GLY B 195 -46.705 -21.689 3.447 1.00 21.11 H new ATOM 1298 N TYR B 196 -45.739 -23.893 4.925 1.00 18.41 N ATOM 1299 CA TYR B 196 -44.758 -24.986 5.076 1.00 18.93 C ATOM 1300 C TYR B 196 -44.336 -25.584 3.735 1.00 17.21 C ATOM 1301 O TYR B 196 -45.174 -26.146 2.977 1.00 14.83 O ATOM 1302 CB TYR B 196 -45.285 -26.111 6.020 1.00 24.02 C ATOM 1303 CG TYR B 196 -44.189 -27.004 6.618 1.00 26.12 C ATOM 1304 CD1 TYR B 196 -43.452 -26.611 7.686 1.00 34.92 C ATOM 1305 CD2 TYR B 196 -43.924 -28.238 6.118 1.00 31.97 C ATOM 1306 CE1 TYR B 196 -42.472 -27.420 8.258 1.00 37.41 C ATOM 1307 CE2 TYR B 196 -42.958 -29.066 6.665 1.00 34.10 C ATOM 1308 CZ TYR B 196 -42.231 -28.650 7.726 1.00 39.50 C ATOM 1309 OH TYR B 196 -41.283 -29.487 8.220 1.00 47.66 O ATOM 0 H TYR B 196 -46.556 -24.109 5.084 1.00 18.41 H new ATOM 0 HA TYR B 196 -43.974 -24.584 5.481 1.00 18.93 H new ATOM 0 HB2 TYR B 196 -45.785 -25.702 6.744 1.00 24.02 H new ATOM 0 HB3 TYR B 196 -45.906 -26.668 5.526 1.00 24.02 H new ATOM 0 HD1 TYR B 196 -43.606 -25.770 8.051 1.00 34.92 H new ATOM 0 HD2 TYR B 196 -44.408 -28.538 5.383 1.00 31.97 H new ATOM 0 HE1 TYR B 196 -41.988 -27.123 8.995 1.00 37.41 H new ATOM 0 HE2 TYR B 196 -42.809 -29.909 6.302 1.00 34.10 H new ATOM 0 HH TYR B 196 -41.275 -30.197 7.772 1.00 47.66 H new ATOM 1310 N GLY B 197 -43.052 -25.457 3.439 1.00 16.18 N ATOM 1311 CA GLY B 197 -42.463 -25.945 2.226 1.00 16.97 C ATOM 1312 C GLY B 197 -42.778 -25.149 0.944 1.00 16.38 C ATOM 1313 O GLY B 197 -41.949 -24.396 0.463 1.00 14.58 O ATOM 0 H GLY B 197 -42.489 -25.071 3.961 1.00 16.18 H new ATOM 0 HA2 GLY B 197 -41.500 -25.966 2.342 1.00 16.97 H new ATOM 0 HA3 GLY B 197 -42.753 -26.861 2.094 1.00 16.97 H new ATOM 1314 N TYR B 198 -43.977 -25.325 0.410 1.00 15.19 N ATOM 1315 CA TYR B 198 -44.430 -24.569 -0.739 1.00 14.94 C ATOM 1316 C TYR B 198 -45.952 -24.601 -0.783 1.00 16.17 C ATOM 1317 O TYR B 198 -46.543 -25.662 -0.511 1.00 15.75 O ATOM 1318 CB TYR B 198 -43.804 -25.226 -1.996 1.00 14.53 C ATOM 1319 CG TYR B 198 -44.262 -24.652 -3.267 1.00 15.43 C ATOM 1320 CD1 TYR B 198 -43.705 -23.450 -3.748 1.00 14.18 C ATOM 1321 CD2 TYR B 198 -45.337 -25.248 -3.997 1.00 14.54 C ATOM 1322 CE1 TYR B 198 -44.164 -22.880 -4.889 1.00 14.63 C ATOM 1323 CE2 TYR B 198 -45.788 -24.673 -5.148 1.00 14.09 C ATOM 1324 CZ TYR B 198 -45.159 -23.520 -5.627 1.00 14.67 C ATOM 1325 OH TYR B 198 -45.663 -22.896 -6.741 1.00 14.83 O ATOM 0 H TYR B 198 -44.553 -25.890 0.708 1.00 15.19 H new ATOM 0 HA TYR B 198 -44.158 -23.639 -0.695 1.00 14.94 H new ATOM 0 HB2 TYR B 198 -42.839 -25.144 -1.945 1.00 14.53 H new ATOM 0 HB3 TYR B 198 -44.009 -26.174 -1.989 1.00 14.53 H new ATOM 0 HD1 TYR B 198 -43.014 -23.043 -3.277 1.00 14.18 H new ATOM 0 HD2 TYR B 198 -45.730 -26.031 -3.686 1.00 14.54 H new ATOM 0 HE1 TYR B 198 -43.817 -22.067 -5.178 1.00 14.63 H new ATOM 0 HE2 TYR B 198 -46.506 -25.043 -5.609 1.00 14.09 H new ATOM 0 HH TYR B 198 -46.324 -23.327 -7.029 1.00 14.83 H new ATOM 1326 N LEU B 199 -46.561 -23.431 -0.994 1.00 15.84 N ATOM 1327 CA LEU B 199 -47.964 -23.249 -1.222 1.00 16.19 C ATOM 1328 C LEU B 199 -48.123 -22.756 -2.648 1.00 17.69 C ATOM 1329 O LEU B 199 -47.461 -21.749 -3.040 1.00 15.78 O ATOM 1330 CB LEU B 199 -48.558 -22.252 -0.270 1.00 16.44 C ATOM 1331 CG LEU B 199 -48.549 -22.571 1.243 1.00 18.92 C ATOM 1332 CD1 LEU B 199 -49.476 -21.610 1.978 1.00 18.78 C ATOM 1333 CD2 LEU B 199 -48.883 -24.039 1.634 1.00 18.13 C ATOM 0 H LEU B 199 -46.127 -22.689 -1.005 1.00 15.84 H new ATOM 0 HA LEU B 199 -48.430 -24.088 -1.079 1.00 16.19 H new ATOM 0 HB2 LEU B 199 -48.091 -21.411 -0.396 1.00 16.44 H new ATOM 0 HB3 LEU B 199 -49.480 -22.107 -0.534 1.00 16.44 H new ATOM 0 HG LEU B 199 -47.626 -22.452 1.516 1.00 18.92 H new ATOM 0 HD11 LEU B 199 -49.467 -21.814 2.926 1.00 18.78 H new ATOM 0 HD12 LEU B 199 -49.173 -20.699 1.840 1.00 18.78 H new ATOM 0 HD13 LEU B 199 -50.379 -21.705 1.636 1.00 18.78 H new ATOM 0 HD21 LEU B 199 -48.851 -24.132 2.599 1.00 18.13 H new ATOM 0 HD22 LEU B 199 -49.772 -24.264 1.317 1.00 18.13 H new ATOM 0 HD23 LEU B 199 -48.235 -24.637 1.230 1.00 18.13 H new ATOM 1334 N HIS B 200 -48.911 -23.507 -3.432 1.00 16.83 N ATOM 1335 CA HIS B 200 -49.074 -23.260 -4.834 1.00 19.25 C ATOM 1336 C HIS B 200 -50.095 -22.167 -5.095 1.00 18.57 C ATOM 1337 O HIS B 200 -51.202 -22.427 -5.422 1.00 17.62 O ATOM 1338 CB HIS B 200 -49.409 -24.542 -5.640 1.00 19.14 C ATOM 1339 CG HIS B 200 -49.250 -24.379 -7.118 1.00 20.20 C ATOM 1340 ND1 HIS B 200 -48.093 -23.875 -7.692 1.00 23.10 N ATOM 1341 CD2 HIS B 200 -50.109 -24.619 -8.144 1.00 22.25 C ATOM 1342 CE1 HIS B 200 -48.261 -23.819 -9.006 1.00 23.76 C ATOM 1343 NE2 HIS B 200 -49.470 -24.278 -9.305 1.00 21.49 N ATOM 0 H HIS B 200 -49.364 -24.178 -3.142 1.00 16.83 H new ATOM 0 HA HIS B 200 -48.212 -22.950 -5.153 1.00 19.25 H new ATOM 0 HB2 HIS B 200 -48.835 -25.264 -5.338 1.00 19.14 H new ATOM 0 HB3 HIS B 200 -50.322 -24.806 -5.448 1.00 19.14 H new ATOM 0 HD2 HIS B 200 -50.973 -24.954 -8.070 1.00 22.25 H new ATOM 0 HE1 HIS B 200 -47.634 -23.509 -9.619 1.00 23.76 H new ATOM 0 HE2 HIS B 200 -49.797 -24.349 -10.097 1.00 21.49 H new ATOM 1344 N ARG B 201 -49.647 -20.936 -4.993 1.00 22.17 N ATOM 1345 CA ARG B 201 -50.476 -19.768 -5.315 1.00 23.92 C ATOM 1346 C ARG B 201 -50.371 -19.377 -6.758 1.00 22.58 C ATOM 1347 O ARG B 201 -49.284 -19.229 -7.263 1.00 24.31 O ATOM 1348 CB ARG B 201 -49.976 -18.580 -4.493 1.00 25.80 C ATOM 1349 CG ARG B 201 -50.665 -17.238 -4.843 1.00 30.18 C ATOM 1350 CD ARG B 201 -50.071 -16.132 -4.008 1.00 28.90 C ATOM 1351 NE ARG B 201 -50.467 -14.784 -4.455 1.00 28.49 N ATOM 1352 CZ ARG B 201 -49.797 -14.100 -5.372 1.00 27.72 C ATOM 1353 NH1 ARG B 201 -48.713 -14.580 -5.986 1.00 22.12 N ATOM 1354 NH2 ARG B 201 -50.215 -12.906 -5.657 1.00 30.37 N ATOM 0 H ARG B 201 -48.851 -20.740 -4.735 1.00 22.17 H new ATOM 0 HA ARG B 201 -51.397 -20.000 -5.118 1.00 23.92 H new ATOM 0 HB2 ARG B 201 -50.115 -18.768 -3.552 1.00 25.80 H new ATOM 0 HB3 ARG B 201 -49.020 -18.486 -4.626 1.00 25.80 H new ATOM 0 HG2 ARG B 201 -50.550 -17.041 -5.786 1.00 30.18 H new ATOM 0 HG3 ARG B 201 -51.619 -17.302 -4.681 1.00 30.18 H new ATOM 0 HD2 ARG B 201 -50.342 -16.252 -3.084 1.00 28.90 H new ATOM 0 HD3 ARG B 201 -49.104 -16.202 -4.031 1.00 28.90 H new ATOM 0 HE ARG B 201 -51.165 -14.425 -4.105 1.00 28.49 H new ATOM 0 HH11 ARG B 201 -48.421 -15.365 -5.792 1.00 22.12 H new ATOM 0 HH12 ARG B 201 -48.307 -14.104 -6.576 1.00 22.12 H new ATOM 0 HH21 ARG B 201 -50.904 -12.585 -5.256 1.00 30.37 H new ATOM 0 HH22 ARG B 201 -49.803 -12.436 -6.247 1.00 30.37 H new ATOM 1355 N ILE B 202 -51.507 -19.099 -7.359 1.00 23.31 N ATOM 1356 CA ILE B 202 -51.625 -18.714 -8.705 1.00 24.33 C ATOM 1357 C ILE B 202 -52.099 -17.263 -8.769 1.00 26.58 C ATOM 1358 O ILE B 202 -53.205 -16.947 -8.339 1.00 22.43 O ATOM 1359 CB ILE B 202 -52.639 -19.603 -9.421 1.00 24.49 C ATOM 1360 CG1 ILE B 202 -52.193 -21.046 -9.337 1.00 27.88 C ATOM 1361 CG2 ILE B 202 -52.790 -19.186 -10.900 1.00 24.74 C ATOM 1362 CD1 ILE B 202 -53.393 -21.908 -9.045 1.00 32.47 C ATOM 0 H ILE B 202 -52.264 -19.137 -6.953 1.00 23.31 H new ATOM 0 HA ILE B 202 -50.762 -18.805 -9.138 1.00 24.33 H new ATOM 0 HB ILE B 202 -53.501 -19.501 -8.987 1.00 24.49 H new ATOM 0 HG12 ILE B 202 -51.778 -21.319 -10.170 1.00 27.88 H new ATOM 0 HG13 ILE B 202 -51.526 -21.152 -8.641 1.00 27.88 H new ATOM 0 HG21 ILE B 202 -53.438 -19.763 -11.335 1.00 24.74 H new ATOM 0 HG22 ILE B 202 -53.094 -18.266 -10.948 1.00 24.74 H new ATOM 0 HG23 ILE B 202 -51.934 -19.267 -11.348 1.00 24.74 H new ATOM 0 HD11 ILE B 202 -53.119 -22.837 -8.989 1.00 32.47 H new ATOM 0 HD12 ILE B 202 -53.789 -21.637 -8.202 1.00 32.47 H new ATOM 0 HD13 ILE B 202 -54.045 -21.806 -9.756 1.00 32.47 H new ATOM 1363 N PRO B 203 -51.235 -16.362 -9.262 1.00 30.83 N ATOM 1364 CA PRO B 203 -51.718 -15.014 -9.485 1.00 34.03 C ATOM 1365 C PRO B 203 -52.686 -15.041 -10.669 1.00 38.15 C ATOM 1366 O PRO B 203 -52.333 -15.575 -11.735 1.00 41.07 O ATOM 1367 CB PRO B 203 -50.453 -14.244 -9.822 1.00 31.79 C ATOM 1368 CG PRO B 203 -49.552 -15.253 -10.458 1.00 34.16 C ATOM 1369 CD PRO B 203 -49.847 -16.546 -9.735 1.00 33.99 C ATOM 0 HA PRO B 203 -52.193 -14.622 -8.736 1.00 34.03 H new ATOM 0 HB2 PRO B 203 -50.639 -13.508 -10.426 1.00 31.79 H new ATOM 0 HB3 PRO B 203 -50.050 -13.863 -9.026 1.00 31.79 H new ATOM 0 HG2 PRO B 203 -49.729 -15.333 -11.408 1.00 34.16 H new ATOM 0 HG3 PRO B 203 -48.620 -15.002 -10.363 1.00 34.16 H new ATOM 0 HD2 PRO B 203 -49.768 -17.312 -10.325 1.00 33.99 H new ATOM 0 HD3 PRO B 203 -49.234 -16.692 -8.998 1.00 33.99 H new ATOM 1370 N THR B 204 -53.906 -14.562 -10.455 1.00 39.07 N ATOM 1371 CA THR B 204 -54.924 -14.541 -11.515 1.00 48.09 C ATOM 1372 C THR B 204 -55.522 -13.140 -11.686 1.00 50.60 C ATOM 1373 O THR B 204 -55.228 -12.142 -11.004 1.00 49.95 O ATOM 1374 CB THR B 204 -56.097 -15.535 -11.278 1.00 53.99 C ATOM 1375 OG1 THR B 204 -57.301 -14.819 -10.942 1.00 60.55 O ATOM 1376 CG2 THR B 204 -55.778 -16.540 -10.187 1.00 51.65 C ATOM 1377 OXT THR B 204 -56.379 -13.000 -12.542 1.00 55.74 O ATOM 0 H THR B 204 -54.171 -14.242 -9.702 1.00 39.07 H new ATOM 0 HA THR B 204 -54.450 -14.815 -12.316 1.00 48.09 H new ATOM 0 HB THR B 204 -56.230 -16.025 -12.105 1.00 53.99 H new ATOM 0 HG1 THR B 204 -57.927 -15.365 -10.818 1.00 60.55 H new ATOM 0 HG21 THR B 204 -56.531 -17.140 -10.069 1.00 51.65 H new ATOM 0 HG22 THR B 204 -54.993 -17.052 -10.438 1.00 51.65 H new ATOM 0 HG23 THR B 204 -55.606 -16.071 -9.355 1.00 51.65 H new TER 1378 THR B 204 HETATM 1379 C1 EDO B 301 -44.222 -27.860 -9.048 1.00 36.88 C HETATM 1380 O1 EDO B 301 -44.537 -26.444 -9.223 1.00 35.62 O HETATM 1381 C2 EDO B 301 -44.217 -28.818 -10.268 1.00 38.45 C HETATM 1382 O2 EDO B 301 -42.972 -29.615 -10.453 1.00 35.82 O HETATM 0 HO2 EDO B 301 -42.305 -29.139 -10.269 1.00 35.82 H new HETATM 0 HO1 EDO B 301 -43.838 -26.024 -9.424 1.00 35.62 H new HETATM 0 H22 EDO B 301 -44.964 -29.430 -10.182 1.00 38.45 H new HETATM 0 H21 EDO B 301 -44.370 -28.295 -11.071 1.00 38.45 H new HETATM 0 H12 EDO B 301 -43.343 -27.910 -8.640 1.00 36.88 H new HETATM 0 H11 EDO B 301 -44.854 -28.217 -8.405 1.00 36.88 H new HETATM 1383 C1 EDO B 302 -29.782 -13.815 -10.602 1.00 66.88 C HETATM 1384 O1 EDO B 302 -31.166 -14.129 -10.701 1.00 62.61 O HETATM 1385 C2 EDO B 302 -28.936 -14.925 -11.178 1.00 71.73 C HETATM 1386 O2 EDO B 302 -29.439 -15.262 -12.468 1.00 76.50 O HETATM 0 HO2 EDO B 302 -28.974 -15.879 -12.798 1.00 76.50 H new HETATM 0 HO1 EDO B 302 -31.297 -14.607 -11.379 1.00 62.61 H new HETATM 0 H22 EDO B 302 -28.010 -14.643 -11.241 1.00 71.73 H new HETATM 0 H21 EDO B 302 -28.957 -15.701 -10.596 1.00 71.73 H new HETATM 0 H12 EDO B 302 -29.600 -12.987 -11.073 1.00 66.88 H new HETATM 0 H11 EDO B 302 -29.545 -13.671 -9.673 1.00 66.88 H new HETATM 1387 C1 EDO B 303 -37.001 -25.085 -6.852 1.00 42.70 C HETATM 1388 O1 EDO B 303 -35.982 -25.761 -6.082 1.00 43.21 O HETATM 1389 C2 EDO B 303 -37.740 -24.045 -5.986 1.00 47.14 C HETATM 1390 O2 EDO B 303 -39.054 -24.421 -5.539 1.00 44.63 O HETATM 0 HO2 EDO B 303 -39.316 -25.092 -5.971 1.00 44.63 H new HETATM 0 HO1 EDO B 303 -35.591 -26.324 -6.568 1.00 43.21 H new HETATM 0 H22 EDO B 303 -37.195 -23.852 -5.207 1.00 47.14 H new HETATM 0 H21 EDO B 303 -37.813 -23.221 -6.492 1.00 47.14 H new HETATM 0 H12 EDO B 303 -36.597 -24.647 -7.617 1.00 42.70 H new HETATM 0 H11 EDO B 303 -37.634 -25.733 -7.198 1.00 42.70 H new HETATM 1391 C1 EDO B 304 -41.559 -28.219 -5.451 1.00 35.42 C HETATM 1392 O1 EDO B 304 -40.959 -29.077 -6.461 1.00 32.90 O HETATM 1393 C2 EDO B 304 -41.997 -26.839 -5.935 1.00 34.39 C HETATM 1394 O2 EDO B 304 -41.055 -25.822 -5.501 1.00 39.17 O HETATM 0 HO2 EDO B 304 -41.315 -25.068 -5.764 1.00 39.17 H new HETATM 0 HO1 EDO B 304 -40.746 -29.812 -6.114 1.00 32.90 H new HETATM 0 H22 EDO B 304 -42.061 -26.836 -6.903 1.00 34.39 H new HETATM 0 H21 EDO B 304 -42.881 -26.636 -5.591 1.00 34.39 H new HETATM 0 H12 EDO B 304 -42.331 -28.674 -5.080 1.00 35.42 H new HETATM 0 H11 EDO B 304 -40.923 -28.104 -4.728 1.00 35.42 H new HETATM 1395 C1 EDO B 305 -38.192 -26.990 -4.317 1.00 69.78 C HETATM 1396 O1 EDO B 305 -38.143 -27.582 -5.618 1.00 66.33 O HETATM 1397 C2 EDO B 305 -37.603 -27.963 -3.250 1.00 73.22 C HETATM 1398 O2 EDO B 305 -36.180 -27.749 -3.443 1.00 67.48 O HETATM 0 HO2 EDO B 305 -36.029 -27.578 -4.252 1.00 67.48 H new HETATM 0 HO1 EDO B 305 -38.830 -27.367 -6.050 1.00 66.33 H new HETATM 0 H12 EDO B 305 -37.692 -26.159 -4.315 1.00 69.78 H new HETATM 0 H11 EDO B 305 -39.109 -26.770 -4.090 1.00 69.78 H new HETATM 1399 C1 EDO B 306 -38.738 -28.522 -2.348 1.00 52.95 C HETATM 1400 O1 EDO B 306 -39.496 -29.582 -2.964 1.00 48.50 O HETATM 1401 C2 EDO B 306 -39.723 -27.647 -1.542 1.00 42.55 C HETATM 1402 O2 EDO B 306 -39.307 -26.237 -1.475 1.00 41.97 O HETATM 0 HO2 EDO B 306 -38.472 -26.195 -1.390 1.00 41.97 H new HETATM 0 HO1 EDO B 306 -38.981 -30.072 -3.411 1.00 48.50 H new HETATM 0 H22 EDO B 306 -40.603 -27.702 -1.946 1.00 42.55 H new HETATM 0 H21 EDO B 306 -39.801 -28.000 -0.642 1.00 42.55 H new HETATM 1403 O HOH A 301 -19.748 0.999 26.137 1.00 45.27 O HETATM 1404 O HOH A 302 -19.141 -8.481 1.202 1.00 42.58 O HETATM 1405 O HOH A 303 -11.538 -7.115 17.426 1.00 39.81 O HETATM 1406 O HOH A 304 -34.802 6.801 5.371 1.00 21.94 O HETATM 1407 O HOH A 305 -11.256 -4.788 8.817 1.00 13.20 O HETATM 1408 O HOH A 306 -33.129 -5.759 11.706 1.00 22.53 O HETATM 1409 O HOH A 307 -23.051 -7.826 20.030 1.00 34.96 O HETATM 1410 O HOH A 308 -38.133 -0.888 13.186 1.00 20.61 O HETATM 1411 O HOH A 309 -11.773 -8.300 8.669 1.00 28.01 O HETATM 1412 O HOH A 310 -13.725 -0.365 16.396 1.00 28.94 O HETATM 1413 O HOH A 311 -17.753 -10.363 14.046 1.00 29.93 O HETATM 1414 O HOH A 312 -19.473 -8.804 16.049 1.00 41.96 O HETATM 1415 O HOH A 313 -19.072 -2.720 26.385 1.00 34.98 O HETATM 1416 O HOH A 314 -11.344 0.996 24.680 1.00 48.57 O HETATM 1417 O HOH A 315 -24.262 14.734 4.377 1.00 12.08 O HETATM 1418 O HOH A 316 -29.012 11.553 -4.514 1.00 8.78 O HETATM 1419 O HOH A 317 -21.677 -2.690 -0.437 1.00 38.67 O HETATM 1420 O HOH A 318 -11.729 -2.014 22.984 1.00 35.33 O HETATM 1421 O HOH A 319 -23.000 0.266 25.247 1.00 33.05 O HETATM 1422 O HOH A 320 -43.985 3.521 6.221 1.00 38.11 O HETATM 1423 O HOH A 321 -33.324 -4.514 18.091 1.00 38.69 O HETATM 1424 O HOH A 322 -39.993 8.951 8.845 1.00 38.06 O HETATM 1425 O HOH A 323 -22.748 -7.268 16.027 1.00 21.90 O HETATM 1426 O HOH A 324 -35.832 1.332 14.984 1.00 21.54 O HETATM 1427 O HOH A 325 -25.927 14.626 11.444 1.00 47.04 O HETATM 1428 O HOH A 326 -33.171 -4.520 21.084 1.00 40.56 O HETATM 1429 O HOH A 327 -26.274 15.134 2.582 1.00 10.82 O HETATM 1430 O HOH A 328 -29.218 -6.638 9.306 1.00 33.99 O HETATM 1431 O HOH A 329 -44.863 2.349 9.377 1.00 37.49 O HETATM 1432 O HOH A 330 -9.718 -6.159 7.341 1.00 46.32 O HETATM 1433 O HOH A 331 -26.746 -3.250 1.830 1.00 25.37 O HETATM 1434 O HOH A 332 -34.478 -1.586 5.061 1.00 37.19 O HETATM 1435 O HOH A 333 -25.037 9.077 23.134 1.00 35.56 O HETATM 1436 O HOH A 334 -23.148 -14.214 3.893 1.00 45.11 O HETATM 1437 O HOH A 335 -29.800 -5.682 18.409 1.00 30.30 O HETATM 1438 O HOH A 336 -15.674 6.609 22.741 1.00 53.72 O HETATM 1439 O HOH A 337 -15.759 -5.531 2.697 1.00 31.48 O HETATM 1440 O HOH A 338 -42.949 0.444 14.800 1.00 28.88 O HETATM 1441 O HOH A 339 -25.473 -4.182 0.078 0.50 88.78 O HETATM 1442 O HOH A 340 -9.467 -9.215 8.011 1.00 43.70 O HETATM 1443 O HOH A 341 -37.714 13.014 11.446 1.00 43.43 O HETATM 1444 O HOH A 342 -8.748 1.190 23.000 0.50 70.43 O HETATM 1445 O HOH B 401 -53.275 -11.414 -10.140 1.00 56.67 O HETATM 1446 O HOH B 402 -42.891 -24.887 -8.793 1.00 42.74 O HETATM 1447 O HOH B 403 -38.318 -4.779 14.024 1.00 27.36 O HETATM 1448 O HOH B 404 -48.818 -8.215 16.606 1.00 29.34 O HETATM 1449 O HOH B 405 -40.232 -12.288 -5.224 1.00 28.52 O HETATM 1450 O HOH B 406 -37.123 -24.922 -1.384 1.00 31.98 O HETATM 1451 O HOH B 407 -50.764 -14.425 -0.049 0.50 58.94 O HETATM 1452 O HOH B 408 -32.228 -25.037 8.098 1.00 44.47 O HETATM 1453 O HOH B 409 -30.925 -17.287 -11.849 1.00 55.02 O HETATM 1454 O HOH B 410 -35.908 -29.227 -5.549 1.00 45.66 O HETATM 1455 O HOH B 411 -27.565 -15.421 -14.263 1.00 46.23 O HETATM 1456 O HOH B 412 -29.483 -25.396 -9.477 1.00 45.56 O HETATM 1457 O HOH B 413 -47.386 -27.564 3.047 1.00 13.98 O HETATM 1458 O HOH B 414 -42.238 -29.508 -12.987 1.00 42.25 O HETATM 1459 O HOH B 415 -36.564 -6.548 10.343 1.00 20.92 O HETATM 1460 O HOH B 416 -41.216 -19.803 -5.929 1.00 28.29 O HETATM 1461 O HOH B 417 -47.508 -19.616 -9.262 1.00 26.42 O HETATM 1462 O HOH B 418 -41.259 -12.535 17.972 1.00 26.93 O HETATM 1463 O HOH B 419 -45.668 -4.663 0.994 1.00 55.78 O HETATM 1464 O HOH B 420 -35.774 -27.476 -0.756 1.00 38.15 O HETATM 1465 O HOH B 421 -53.193 -24.300 -5.467 1.00 11.63 O HETATM 1466 O HOH B 422 -30.696 -13.946 -4.333 1.00 26.37 O HETATM 1467 O HOH B 423 -42.332 -2.461 11.149 1.00 23.98 O HETATM 1468 O HOH B 424 -48.153 -27.759 0.275 1.00 12.09 O HETATM 1469 O HOH B 425 -49.205 -10.316 -2.058 1.00 43.10 O HETATM 1470 O HOH B 426 -32.329 -6.236 8.442 1.00 41.05 O HETATM 1471 O HOH B 427 -29.736 -15.667 14.778 1.00 38.79 O HETATM 1472 O HOH B 428 -31.139 -15.585 -1.945 1.00 42.20 O HETATM 1473 O HOH B 429 -43.854 -0.616 12.611 1.00 33.20 O HETATM 1474 O HOH B 430 -46.838 -20.152 -5.316 1.00 26.68 O HETATM 1475 O HOH B 431 -40.805 -2.687 13.444 1.00 30.15 O HETATM 1476 O HOH B 432 -32.380 -4.711 15.241 1.00 30.27 O HETATM 1477 O HOH B 433 -34.423 -6.530 9.291 1.00 26.83 O HETATM 1478 O HOH B 434 -29.228 -13.510 17.552 1.00 46.99 O HETATM 1479 O HOH B 435 -50.521 -23.861 -12.027 1.00 41.30 O HETATM 1480 O HOH B 436 -35.906 -4.138 18.794 1.00 42.39 O HETATM 1481 O HOH B 437 -46.888 -9.087 -0.763 1.00 34.60 O HETATM 1482 O HOH B 438 -31.276 -8.519 5.985 1.00 39.17 O HETATM 1483 O HOH B 439 -46.961 -13.186 -8.047 1.00 41.93 O HETATM 1484 O HOH B 440 -41.378 -27.042 -10.060 1.00 35.59 O HETATM 1485 O HOH B 441 -48.598 -1.004 17.723 1.00 37.86 O HETATM 1486 O HOH B 442 -42.562 -26.893 -11.842 1.00 21.72 O HETATM 1487 O HOH B 443 -25.902 -13.927 -2.061 1.00 22.24 O HETATM 1488 O HOH B 444 -29.516 -24.067 9.155 1.00 44.42 O HETATM 1489 O HOH B 445 -30.493 -15.059 20.557 1.00 49.21 O HETATM 1490 O HOH B 446 -27.356 -10.786 1.362 1.00 34.67 O HETATM 1491 O HOH B 447 -37.849 -3.860 17.000 1.00 28.75 O HETATM 1492 O HOH B 448 -31.895 -33.890 3.475 1.00 40.89 O HETATM 1493 O HOH B 449 -40.579 -24.521 -9.753 1.00 45.91 O HETATM 1494 O HOH B 450 -50.824 -26.908 0.000 0.50 38.76 O HETATM 1495 O HOH B 451 -25.434 -12.364 0.051 0.50 45.38 O HETATM 1496 O HOH B 452 -27.838 -23.838 -2.800 1.00 40.78 O CONECT 1379 1380 1381 CONECT 1380 1379 CONECT 1381 1379 1382 CONECT 1382 1381 CONECT 1383 1384 1385 CONECT 1384 1383 CONECT 1385 1383 1386 CONECT 1386 1385 CONECT 1387 1388 1389 CONECT 1388 1387 CONECT 1389 1387 1390 CONECT 1390 1389 CONECT 1391 1392 1393 CONECT 1392 1391 CONECT 1393 1391 1394 CONECT 1394 1393 CONECT 1395 1396 1397 CONECT 1396 1395 CONECT 1397 1395 1398 1399 CONECT 1398 1397 CONECT 1399 1397 1400 1401 CONECT 1400 1399 CONECT 1401 1399 1402 CONECT 1402 1401 END