USER MOD reduce.3.24.130724 H: found=0, std=0, add=2202, rem=0, adj=66 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER OXIDOREDUCTASE 11-MAY-09 3HF8 TITLE CRYSTAL STRUCTURE OF HUMAN TRYOPTOPHAN HYDROXYLASE TYPE 1 WITH BOUND TITLE 2 LP-533401 AND FE COMPND MOL_ID: 1; COMPND 2 MOLECULE: TRYPTOPHAN 5-HYDROXYLASE 1; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: TRYPTOPHAN 5-MONOOXYGENASE 1; COMPND 5 EC: 1.14.16.4 SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606 KEYWDS TRYOPTOPHAN HYDROXYLASE TYPE 1, IRON, METAL-BINDING, MONOOXYGENASE, KEYWDS 2 OXIDOREDUCTASE, PHOSPHOPROTEIN, SEROTONIN BIOSYNTHESIS EXPDTA X-RAY DIFFRACTION AUTHOR L.W.TARI,R.V.SWANSON,M.J.HUNTER REVDAT 2 28-MAR-12 3HF8 1 JRNL VERSN REMARK REVDAT 1 21-APR-10 3HF8 0 JRNL AUTH G.CIANCHETTA,T.STOUCH,W.YU,Z.C.SHI,L.W.TARI,R.V.SWANSON, JRNL AUTH 2 M.J.HUNTER,I.D.HOFFMAN,Q.LIU JRNL TITL MECHANISM OF INHIBITION OF NOVEL TRYPTOPHAN HYDROXYLASE JRNL TITL 2 INHIBITORS REVEALED BY CO-CRYSTAL STRUCTURES AND KINETIC JRNL TITL 3 ANALYSIS. JRNL REF CURR CHEM GENOMICS V. 4 19 2010 JRNL REFN ESSN 1875-3973 JRNL PMID 20556201 JRNL DOI 10.2174/1875397301004010019 REMARK 2 REMARK 2 RESOLUTION. 1.85 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0005 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.85 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : NULL REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 94.4 REMARK 3 NUMBER OF REFLECTIONS : 23431 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) : 0.199 REMARK 3 R VALUE (WORKING SET) : 0.197 REMARK 3 FREE R VALUE : 0.241 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100 REMARK 3 FREE R VALUE TEST SET COUNT : 1261 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.85 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.90 REMARK 3 REFLECTION IN BIN (WORKING SET) : 1093 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 59.90 REMARK 3 BIN R VALUE (WORKING SET) : 0.2650 REMARK 3 BIN FREE R VALUE SET COUNT : 60 REMARK 3 BIN FREE R VALUE : 0.3430 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2221 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 39 REMARK 3 SOLVENT ATOMS : 436 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 30.76 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -1.07000 REMARK 3 B22 (A**2) : 1.02000 REMARK 3 B33 (A**2) : 0.04000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : -0.04000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.173 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.156 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.106 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 3.466 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.954 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.926 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2301 ; 0.007 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3111 ; 1.081 ; 1.979 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 272 ; 4.840 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 108 ;28.141 ;23.333 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 376 ;15.138 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 14 ;17.058 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 323 ; 0.084 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1776 ; 0.003 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 1123 ; 0.190 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 1590 ; 0.300 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 248 ; 0.107 ; 0.200 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): 21 ; 0.144 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 9 ; 0.097 ; 0.200 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): 1396 ; 0.533 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2206 ; 0.936 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 1019 ; 1.313 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 905 ; 2.031 ; 4.500 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 : BABINET MODEL WITH MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 3HF8 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 31-MAY-09. REMARK 100 THE RCSB ID CODE IS RCSB053061. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : NULL REMARK 200 TEMPERATURE (KELVIN) : NULL REMARK 200 PH : 8.5 REMARK 200 NUMBER OF CRYSTALS USED : NULL REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ALS REMARK 200 BEAMLINE : 4.2.2 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : NULL REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : NOIR-1 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : NULL REMARK 200 DATA SCALING SOFTWARE : NULL REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 23431 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.850 REMARK 200 RESOLUTION RANGE LOW (A) : NULL REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : NULL REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : NULL REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: NULL REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 47.00 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.32 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PH 8.5, VAPOR DIFFUSION, HANGING DROP, REMARK 280 TEMPERATURE 293.15K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 21 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 29.11900 REMARK 290 SMTRY3 2 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: MONOMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 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 VAL A 122 REMARK 465 LEU A 123 REMARK 465 MET A 124 REMARK 465 TYR A 125 REMARK 465 GLY A 126 REMARK 465 SER A 127 REMARK 465 GLU A 128 REMARK 465 LEU A 129 REMARK 465 ASP A 130 REMARK 465 ALA A 131 REMARK 465 ASP A 132 REMARK 465 HIS A 133 REMARK 465 PRO A 134 REMARK 465 GLY A 135 REMARK 465 PHE A 136 REMARK 465 LYS A 137 REMARK 480 REMARK 480 ZERO OCCUPANCY ATOM REMARK 480 THE FOLLOWING RESIDUES HAVE ATOMS MODELED WITH ZERO REMARK 480 OCCUPANCY. THE LOCATION AND PROPERTIES OF THESE ATOMS REMARK 480 MAY NOT BE RELIABLE. (M=MODEL NUMBER; RES=RESIDUE NAME; REMARK 480 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 480 M RES C SSEQI ATOMS REMARK 480 SER A 104 N REMARK 480 VAL A 105 CG2 REMARK 480 CYS A 118 CB REMARK 480 ASN A 120 CG OD1 ND2 REMARK 480 MET A 153 CE REMARK 480 LYS A 195 CE NZ REMARK 480 LEU A 197 CD1 CD2 REMARK 480 GLU A 223 OE2 REMARK 480 LYS A 342 NZ REMARK 480 VAL A 351 CG1 REMARK 480 ILE A 358 CG2 CD1 REMARK 480 LYS A 391 CD CE NZ REMARK 480 THR A 392 CG2 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS 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,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) 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 RES CSSEQI ATM2 DEVIATION REMARK 500 SER A 104 N SER A 104 CA 1.006 REMARK 500 VAL A 105 CB VAL A 105 CG2 0.213 REMARK 500 CYS A 118 CB CYS A 118 SG -0.098 REMARK 500 ASN A 120 CB ASN A 120 CG -0.331 REMARK 500 LYS A 195 CD LYS A 195 CE -0.233 REMARK 500 GLU A 223 CD GLU A 223 OE2 0.286 REMARK 500 LYS A 342 CE LYS A 342 NZ 0.401 REMARK 500 VAL A 351 CB VAL A 351 CG1 -0.304 REMARK 500 LYS A 391 CG LYS A 391 CD 0.285 REMARK 500 LYS A 391 CD LYS A 391 CE 0.260 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 SER A 104 N - CA - CB ANGL. DEV. = -16.0 DEGREES REMARK 500 SER A 104 N - CA - C ANGL. DEV. = -23.5 DEGREES REMARK 500 VAL A 105 CG1 - CB - CG2 ANGL. DEV. = -16.9 DEGREES REMARK 500 CYS A 118 CB - CA - C ANGL. DEV. = -13.3 DEGREES REMARK 500 CYS A 118 CA - CB - SG ANGL. DEV. = 15.3 DEGREES REMARK 500 LEU A 197 CB - CG - CD1 ANGL. DEV. = 22.5 DEGREES REMARK 500 LYS A 342 CD - CE - NZ ANGL. DEV. = 14.1 DEGREES REMARK 500 VAL A 351 CA - CB - CG1 ANGL. DEV. = 9.3 DEGREES REMARK 500 THR A 392 OG1 - CB - CG2 ANGL. DEV. = 31.1 DEGREES REMARK 500 THR A 392 CA - CB - CG2 ANGL. DEV. = -10.7 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 ALA A 119 -7.98 -59.81 REMARK 500 ASN A 139 -38.13 -159.40 REMARK 500 ARG A 257 135.76 -27.44 REMARK 500 THR A 315 -76.03 -119.05 REMARK 500 THR A 367 -21.00 85.41 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 GLU A 223 0.08 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CHIRAL CENTERS REMARK 500 REMARK 500 UNEXPECTED CONFIGURATION OF THE FOLLOWING CHIRAL REMARK 500 CENTER(S) USING IMPROPER CA--C--CB--N CHIRALITY REMARK 500 FOR AMINO ACIDS AND C1'--O4'--N1(N9)--C2' FOR REMARK 500 NUCLEIC ACIDS OR EQUIVALENT ANGLE REMARK 500 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,A1,6X,F5.1,6X,A1,10X,A1,3X,A16) REMARK 500 REMARK 500 M RES CSSEQI IMPROPER EXPECTED FOUND DETAILS REMARK 500 SER A 104 68.8 L L OUTSIDE RANGE REMARK 500 SER A 346 24.4 L L OUTSIDE RANGE REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 461 DISTANCE = 5.09 ANGSTROMS REMARK 525 HOH A 527 DISTANCE = 8.35 ANGSTROMS REMARK 525 HOH A 528 DISTANCE = 8.09 ANGSTROMS REMARK 525 HOH A 532 DISTANCE = 5.28 ANGSTROMS REMARK 525 HOH A 542 DISTANCE = 6.52 ANGSTROMS REMARK 525 HOH A 554 DISTANCE = 5.99 ANGSTROMS REMARK 525 HOH A 556 DISTANCE = 6.70 ANGSTROMS REMARK 525 HOH A 558 DISTANCE = 8.03 ANGSTROMS REMARK 525 HOH A 559 DISTANCE = 7.98 ANGSTROMS REMARK 525 HOH A 562 DISTANCE = 5.08 ANGSTROMS REMARK 525 HOH A 565 DISTANCE = 5.48 ANGSTROMS REMARK 525 HOH A 573 DISTANCE = 9.67 ANGSTROMS REMARK 525 HOH A 574 DISTANCE = 5.28 ANGSTROMS REMARK 525 HOH A 575 DISTANCE = 6.52 ANGSTROMS REMARK 525 HOH A 581 DISTANCE = 6.86 ANGSTROMS REMARK 525 HOH A 582 DISTANCE = 6.71 ANGSTROMS REMARK 525 HOH A 587 DISTANCE = 8.07 ANGSTROMS REMARK 525 HOH A 589 DISTANCE = 13.12 ANGSTROMS REMARK 525 HOH A 592 DISTANCE = 7.48 ANGSTROMS REMARK 525 HOH A 593 DISTANCE = 7.67 ANGSTROMS REMARK 525 HOH A 595 DISTANCE = 5.30 ANGSTROMS REMARK 525 HOH A 613 DISTANCE = 5.29 ANGSTROMS REMARK 525 HOH A 614 DISTANCE = 6.27 ANGSTROMS REMARK 525 HOH A 643 DISTANCE = 9.05 ANGSTROMS REMARK 525 HOH A 644 DISTANCE = 7.28 ANGSTROMS REMARK 525 HOH A 648 DISTANCE = 6.38 ANGSTROMS REMARK 525 HOH A 661 DISTANCE = 7.02 ANGSTROMS REMARK 525 HOH A 664 DISTANCE = 5.86 ANGSTROMS REMARK 525 HOH A 667 DISTANCE = 8.44 ANGSTROMS REMARK 525 HOH A 668 DISTANCE = 5.11 ANGSTROMS REMARK 525 HOH A 670 DISTANCE = 8.11 ANGSTROMS REMARK 525 HOH A 672 DISTANCE = 5.07 ANGSTROMS REMARK 525 HOH A 675 DISTANCE = 8.31 ANGSTROMS REMARK 525 HOH A 687 DISTANCE = 5.80 ANGSTROMS REMARK 525 HOH A 694 DISTANCE = 6.35 ANGSTROMS REMARK 525 HOH A 700 DISTANCE = 5.97 ANGSTROMS REMARK 525 HOH A 702 DISTANCE = 6.58 ANGSTROMS REMARK 525 HOH A 704 DISTANCE = 6.33 ANGSTROMS REMARK 525 HOH A 707 DISTANCE = 5.74 ANGSTROMS REMARK 525 HOH A 753 DISTANCE = 5.66 ANGSTROMS REMARK 525 HOH A 755 DISTANCE = 5.25 ANGSTROMS REMARK 525 HOH A 759 DISTANCE = 8.46 ANGSTROMS REMARK 525 HOH A 782 DISTANCE = 9.77 ANGSTROMS REMARK 525 HOH A 793 DISTANCE = 11.55 ANGSTROMS REMARK 525 HOH A 801 DISTANCE = 5.80 ANGSTROMS REMARK 525 HOH A 803 DISTANCE = 6.99 ANGSTROMS REMARK 525 HOH A 805 DISTANCE = 7.91 ANGSTROMS REMARK 525 HOH A 818 DISTANCE = 8.78 ANGSTROMS REMARK 525 HOH A 822 DISTANCE = 6.82 ANGSTROMS REMARK 525 HOH A 827 DISTANCE = 7.20 ANGSTROMS REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 FE A 400 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS A 272 NE2 REMARK 620 2 HIS A 277 NE2 92.4 REMARK 620 3 GLU A 317 OE1 147.0 94.1 REMARK 620 4 GLU A 317 OE2 89.5 94.1 57.8 REMARK 620 5 HOH A 402 O 106.9 92.1 105.1 162.2 REMARK 620 6 HOH A 404 O 94.8 169.6 83.8 93.4 78.7 REMARK 620 N 1 2 3 4 5 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FE A 400 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ML0 A 401 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3HF6 RELATED DB: PDB REMARK 900 RELATED ID: 3HFB RELATED DB: PDB DBREF 3HF8 A 104 393 UNP P17752 TPH1_HUMAN 104 393 SEQADV 3HF8 SER A 104 UNP P17752 THR 104 CONFLICT SEQADV 3HF8 ARG A 179 UNP P17752 GLN 179 CONFLICT SEQRES 1 A 290 SER VAL PRO TRP PHE PRO LYS LYS ILE SER ASP LEU ASP SEQRES 2 A 290 HIS CYS ALA ASN ARG VAL LEU MET TYR GLY SER GLU LEU SEQRES 3 A 290 ASP ALA ASP HIS PRO GLY PHE LYS ASP ASN VAL TYR ARG SEQRES 4 A 290 LYS ARG ARG LYS TYR PHE ALA ASP LEU ALA MET ASN TYR SEQRES 5 A 290 LYS HIS GLY ASP PRO ILE PRO LYS VAL GLU PHE THR GLU SEQRES 6 A 290 GLU GLU ILE LYS THR TRP GLY THR VAL PHE ARG GLU LEU SEQRES 7 A 290 ASN LYS LEU TYR PRO THR HIS ALA CYS ARG GLU TYR LEU SEQRES 8 A 290 LYS ASN LEU PRO LEU LEU SER LYS TYR CYS GLY TYR ARG SEQRES 9 A 290 GLU ASP ASN ILE PRO GLN LEU GLU ASP VAL SER ASN PHE SEQRES 10 A 290 LEU LYS GLU ARG THR GLY PHE SER ILE ARG PRO VAL ALA SEQRES 11 A 290 GLY TYR LEU SER PRO ARG ASP PHE LEU SER GLY LEU ALA SEQRES 12 A 290 PHE ARG VAL PHE HIS CYS THR GLN TYR VAL ARG HIS SER SEQRES 13 A 290 SER ASP PRO PHE TYR THR PRO GLU PRO ASP THR CYS HIS SEQRES 14 A 290 GLU LEU LEU GLY HIS VAL PRO LEU LEU ALA GLU PRO SER SEQRES 15 A 290 PHE ALA GLN PHE SER GLN GLU ILE GLY LEU ALA SER LEU SEQRES 16 A 290 GLY ALA SER GLU GLU ALA VAL GLN LYS LEU ALA THR CYS SEQRES 17 A 290 TYR PHE PHE THR VAL GLU PHE GLY LEU CYS LYS GLN ASP SEQRES 18 A 290 GLY GLN LEU ARG VAL PHE GLY ALA GLY LEU LEU SER SER SEQRES 19 A 290 ILE SER GLU LEU LYS HIS ALA LEU SER GLY HIS ALA LYS SEQRES 20 A 290 VAL LYS PRO PHE ASP PRO LYS ILE THR CYS LYS GLN GLU SEQRES 21 A 290 CYS LEU ILE THR THR PHE GLN ASP VAL TYR PHE VAL SER SEQRES 22 A 290 GLU SER PHE GLU ASP ALA LYS GLU LYS MET ARG GLU PHE SEQRES 23 A 290 THR LYS THR ILE HET FE A 400 1 HET ML0 A 401 38 HETNAM FE FE (III) ION HETNAM ML0 4-{2-AMINO-6-[(1R)-2,2,2-TRIFLUORO-1-(3'- HETNAM 2 ML0 FLUOROBIPHENYL-4-YL)ETHOXY]PYRIMIDIN-4-YL}-L- HETNAM 3 ML0 PHENYLALANINE HETSYN ML0 (S)-2-AMINO-3-(4-{2-AMINO-6-[(S)-1-(3'-FLUORO-BIPHENYL- HETSYN 2 ML0 4-YL)-ETHOXY]-PYRIMIDIN-4-YL}-PHENYL)-PROPIONIC ACID FORMUL 2 FE FE 3+ FORMUL 3 ML0 C27 H22 F4 N4 O3 FORMUL 4 HOH *436(H2 O) HELIX 1 1 LYS A 111 CYS A 118 5 8 HELIX 2 2 ASN A 139 TYR A 155 1 17 HELIX 3 3 THR A 167 ALA A 189 1 23 HELIX 4 4 CYS A 190 GLY A 205 1 16 HELIX 5 5 GLN A 213 THR A 225 1 13 HELIX 6 6 SER A 237 ALA A 246 1 10 HELIX 7 7 ASP A 269 HIS A 277 1 9 HELIX 8 8 HIS A 277 ALA A 282 1 6 HELIX 9 9 GLU A 283 LEU A 298 1 16 HELIX 10 10 SER A 301 PHE A 314 1 14 HELIX 11 11 GLY A 331 SER A 336 1 6 HELIX 12 12 SER A 337 LEU A 345 1 9 HELIX 13 13 ASP A 355 CYS A 360 1 6 HELIX 14 14 SER A 378 ILE A 393 1 16 SHEET 1 A 2 SER A 228 PRO A 231 0 SHEET 2 A 2 VAL A 249 CYS A 252 1 O PHE A 250 N SER A 228 SHEET 1 B 4 GLN A 326 VAL A 329 0 SHEET 2 B 4 LEU A 320 GLN A 323 -1 N GLN A 323 O GLN A 326 SHEET 3 B 4 VAL A 372 SER A 376 1 O SER A 376 N LEU A 320 SHEET 4 B 4 LYS A 350 PRO A 353 1 N LYS A 352 O VAL A 375 LINK NE2 HIS A 272 FE FE A 400 1555 1555 2.08 LINK NE2 HIS A 277 FE FE A 400 1555 1555 2.04 LINK OE1 GLU A 317 FE FE A 400 1555 1555 2.23 LINK OE2 GLU A 317 FE FE A 400 1555 1555 2.28 LINK FE FE A 400 O HOH A 402 1555 1555 2.19 LINK FE FE A 400 O HOH A 404 1555 1555 2.08 CISPEP 1 SER A 346 GLY A 347 0 -4.62 SITE *** AC1 5 HIS A 272 HIS A 277 GLU A 317 HOH A 402 SITE *** AC1 5 HOH A 404 SITE *** AC2 20 TYR A 235 LEU A 236 PRO A 238 ARG A 257 SITE *** AC2 20 TYR A 264 THR A 265 PRO A 266 GLU A 267 SITE *** AC2 20 PRO A 268 HIS A 272 PHE A 313 GLU A 317 SITE *** AC2 20 GLY A 333 SER A 336 SER A 337 CYS A 364 SITE *** AC2 20 ILE A 366 HOH A 404 HOH A 414 HOH A 617 CRYST1 47.278 58.238 56.554 90.00 97.15 90.00 P 1 21 1 2 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.021151 0.000000 0.002654 0.00000 SCALE2 0.000000 0.017171 0.000000 0.00000 SCALE3 0.000000 0.000000 0.017821 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 272 HIS HE2 : A 272 HIS NE2 : A 400 FEFE :(H bumps) USER MOD NoAdj-H: A 277 HIS HE2 : A 277 HIS NE2 : A 400 FEFE :(H bumps) USER MOD NoAdj-H: A 401 ML0HO38 : A 401 ML0 O38 : A 401 ML0 C36 :(short bond) USER MOD Set 1.1: A 346 SER OG : rot -71:sc= 2.09 USER MOD Set 1.2: A 348 HIS : no HD1:sc= 0 X(o=2.1,f=2) USER MOD Set 2.1: A 343 HIS : no HD1:sc= -0.137 K(o=0.98,f=0.46) USER MOD Set 2.2: A 373 TYR OH : rot -177:sc= 1.12 USER MOD Set 3.1: A 258 HIS : no HD1:sc= 0.526 K(o=1.1,f=-2.2) USER MOD Set 3.2: A 260 SER OG : rot -92:sc= 0.572 USER MOD Set 4.1: A 187 THR OG1 : rot 65:sc= 1.11 USER MOD Set 4.2: A 188 HIS : no HD1:sc= 0.783 K(o=1.9,f=-6.8!) USER MOD Set 5.1: A 185 TYR OH : rot 8:sc= 1.3 USER MOD Set 5.2: A 193 TYR OH : rot -12:sc= 1.2 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0219) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot 83:sc= 0.494 USER MOD Single : A 117 HIS : no HD1:sc= -0.0116 X(o=-0.012,f=0) USER MOD Single : A 118 CYS SG : rot -179:sc=0.000609 USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 141 TYR OH : rot 180:sc= 0.258 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 LYS NZ :NH3+ -162:sc= 1.16 (180deg=0.942) USER MOD Single : A 147 TYR OH : rot 0:sc= 1.22 USER MOD Single : A 153 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 154 ASN : amide:sc=-0.00963 X(o=-0.0096,f=-0.39) USER MOD Single : A 155 TYR OH : rot 30:sc= 1.06 USER MOD Single : A 156 LYS NZ :NH3+ 151:sc= 0.642 (180deg=0.318) USER MOD Single : A 157 HIS : no HD1:sc= 1.07 K(o=1.1,f=-1.5) USER MOD Single : A 163 LYS NZ :NH3+ 176:sc= 1.06 (180deg=1.04) USER MOD Single : A 167 THR OG1 : rot 180:sc= 0.085 USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 THR OG1 : rot 75:sc= 0.924 USER MOD Single : A 176 THR OG1 : rot 75:sc= 0.746 USER MOD Single : A 182 ASN : amide:sc= 2.56 K(o=2.6,f=0.42) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 CYS SG : rot 108:sc= 0 USER MOD Single : A 195 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 196 ASN : amide:sc= 0.0625 X(o=0.063,f=-0.049) USER MOD Single : A 201 SER OG : rot -53:sc= 0.277 USER MOD Single : A 202 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 203 TYR OH : rot 180:sc= 0 USER MOD Single : A 204 CYS SG : rot 180:sc= -0.184 USER MOD Single : A 206 TYR OH : rot 179:sc= 0.932 USER MOD Single : A 210 ASN : amide:sc= 1.59 K(o=1.6,f=0.63) USER MOD Single : A 213 GLN : amide:sc= 2.27 K(o=2.3,f=-3.9!) USER MOD Single : A 218 SER OG : rot -176:sc= 0.697 USER MOD Single : A 219 ASN : amide:sc= -0.0148 K(o=-0.015,f=-0.75) USER MOD Single : A 222 LYS NZ :NH3+ 166:sc= 0.067 (180deg=0.0401) USER MOD Single : A 225 THR OG1 : rot -158:sc= 1.07 USER MOD Single : A 228 SER OG : rot -89:sc= 1 USER MOD Single : A 235 TYR OH : rot 180:sc= -0.254 USER MOD Single : A 237 SER OG : rot 173:sc= 1.61 USER MOD Single : A 243 SER OG : rot -38:sc= 1.74 USER MOD Single : A 251 HIS : no HD1:sc= 0.531 K(o=0.53,f=-3.2!) USER MOD Single : A 252 CYS SG : rot -170:sc= -0.194 USER MOD Single : A 253 THR OG1 : rot -71:sc= 0.0927 USER MOD Single : A 254 GLN : amide:sc= 1.41 K(o=1.4,f=0.71) USER MOD Single : A 255 TYR OH : rot -41:sc= 1.32 USER MOD Single : A 259 SER OG : rot -136:sc= 0.831 USER MOD Single : A 264 TYR OH : rot 30:sc= 0.625 USER MOD Single : A 265 THR OG1 : rot -158:sc= 0.909 USER MOD Single : A 270 THR OG1 : rot 75:sc= 0.23 USER MOD Single : A 271 CYS SG : rot 180:sc=-0.000155 USER MOD Single : A 285 SER OG : rot -80:sc= 0 USER MOD Single : A 288 GLN : amide:sc= 1.3 K(o=1.3,f=-1.7) USER MOD Single : A 290 SER OG : rot 77:sc= 0.0721 USER MOD Single : A 291 GLN : amide:sc= 2.32 K(o=2.3,f=-3.4!) USER MOD Single : A 297 SER OG : rot -45:sc= 2.36 USER MOD Single : A 301 SER OG : rot -76:sc= 0.211 USER MOD Single : A 306 GLN : amide:sc= -0.0362 X(o=-0.036,f=-0.28) USER MOD Single : A 307 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 310 THR OG1 : rot 74:sc= 0.529 USER MOD Single : A 311 CYS SG : rot 79:sc= 0.0224 USER MOD Single : A 312 TYR OH : rot -155:sc= 0.514 USER MOD Single : A 315 THR OG1 : rot -72:sc= 1.41 USER MOD Single : A 321 CYS SG : rot 180:sc= -0.104 USER MOD Single : A 322 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 323 GLN : amide:sc= 2.15 K(o=2.1,f=-4.6!) USER MOD Single : A 326 GLN :FLIP amide:sc= 0 F(o=-0.78,f=0) USER MOD Single : A 336 SER OG : rot 73:sc= 1.88 USER MOD Single : A 337 SER OG : rot 37:sc= 1.11 USER MOD Single : A 339 SER OG : rot 180:sc= 0.00479 USER MOD Single : A 342 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 350 LYS NZ :NH3+ -145:sc=-0.000525 (180deg=-0.483) USER MOD Single : A 352 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 357 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 359 THR OG1 : rot -67:sc= 0.593 USER MOD Single : A 360 CYS SG : rot 70:sc= -0.952 USER MOD Single : A 361 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 362 GLN : amide:sc= -0.34 K(o=-0.34,f=-0.86) USER MOD Single : A 364 CYS SG : rot -92:sc= 0.429 USER MOD Single : A 367 THR OG1 : rot 180:sc= 0 USER MOD Single : A 368 THR OG1 : rot 84:sc= 0.0541 USER MOD Single : A 370 GLN :FLIP amide:sc= 1.21 F(o=-2!,f=1.2) USER MOD Single : A 376 SER OG : rot -69:sc= 1.05 USER MOD Single : A 378 SER OG : rot 180:sc= 0.317 USER MOD Single : A 383 LYS NZ :NH3+ -166:sc= 1.11 (180deg=1.01) USER MOD Single : A 385 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00616) USER MOD Single : A 386 MET CE :methyl -161:sc=-0.00612 (180deg=-0.0723) USER MOD Single : A 390 THR OG1 : rot -78:sc= 1.09 USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 392 THR OG1 : rot -56:sc= 1.11 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 104 -15.337 -14.144 19.911 0.00 53.60 N ATOM 2 CA SER A 104 -16.170 -14.217 17.592 1.00 34.92 C ATOM 3 C SER A 104 -14.809 -13.670 17.157 1.00 34.54 C ATOM 4 O SER A 104 -13.839 -13.728 17.915 1.00 35.15 O ATOM 5 CB SER A 104 -17.165 -13.065 17.784 1.00 35.04 C ATOM 6 OG SER A 104 -16.665 -12.106 18.703 1.00 35.97 O ATOM 0 HA SER A 104 -16.545 -14.954 17.086 1.00 34.92 H new ATOM 0 HB2 SER A 104 -17.340 -12.639 16.930 1.00 35.04 H new ATOM 0 HB3 SER A 104 -18.011 -13.414 18.105 1.00 35.04 H new ATOM 0 HG SER A 104 -17.224 -11.485 18.792 1.00 35.97 H new ATOM 7 N VAL A 105 -14.755 -13.147 15.934 1.00 33.85 N ATOM 8 CA VAL A 105 -13.538 -12.559 15.373 1.00 32.96 C ATOM 9 C VAL A 105 -13.626 -11.036 15.449 1.00 32.21 C ATOM 10 O VAL A 105 -14.624 -10.456 15.018 1.00 32.01 O ATOM 11 CB VAL A 105 -13.349 -12.989 13.901 1.00 33.24 C ATOM 12 CG1 VAL A 105 -11.916 -12.726 13.431 1.00 33.38 C ATOM 13 CG2 VAL A 105 -13.113 -14.703 14.054 0.00 48.74 C ATOM 0 H VAL A 105 -15.429 -13.123 15.401 1.00 33.85 H new ATOM 0 HA VAL A 105 -12.778 -12.873 15.888 1.00 32.96 H new ATOM 0 HB VAL A 105 -14.050 -12.593 13.360 1.00 33.24 H new ATOM 0 HG11 VAL A 105 -11.822 -13.004 12.506 1.00 33.38 H new ATOM 0 HG12 VAL A 105 -11.719 -11.779 13.505 1.00 33.38 H new ATOM 0 HG13 VAL A 105 -11.297 -13.229 13.983 1.00 33.38 H new ATOM 0 HG21 VAL A 105 -12.981 -15.091 13.175 0.00 48.74 H new ATOM 0 HG22 VAL A 105 -12.332 -14.875 14.603 0.00 48.74 H new ATOM 0 HG23 VAL A 105 -13.894 -15.102 14.469 0.00 48.74 H new ATOM 14 N PRO A 106 -12.588 -10.379 16.004 1.00 31.42 N ATOM 15 CA PRO A 106 -12.582 -8.911 16.007 1.00 30.76 C ATOM 16 C PRO A 106 -12.574 -8.338 14.583 1.00 30.00 C ATOM 17 O PRO A 106 -12.232 -9.044 13.630 1.00 29.87 O ATOM 18 CB PRO A 106 -11.280 -8.562 16.748 1.00 30.85 C ATOM 19 CG PRO A 106 -10.433 -9.784 16.652 1.00 31.25 C ATOM 20 CD PRO A 106 -11.385 -10.937 16.653 1.00 31.39 C ATOM 0 HA PRO A 106 -13.373 -8.538 16.425 1.00 30.76 H new ATOM 0 HB2 PRO A 106 -10.840 -7.799 16.342 1.00 30.85 H new ATOM 0 HB3 PRO A 106 -11.455 -8.330 17.673 1.00 30.85 H new ATOM 0 HG2 PRO A 106 -9.898 -9.775 15.843 1.00 31.25 H new ATOM 0 HG3 PRO A 106 -9.817 -9.840 17.399 1.00 31.25 H new ATOM 0 HD2 PRO A 106 -11.031 -11.695 16.162 1.00 31.39 H new ATOM 0 HD3 PRO A 106 -11.574 -11.246 17.553 1.00 31.39 H new ATOM 21 N TRP A 107 -12.974 -7.079 14.436 1.00 29.19 N ATOM 22 CA TRP A 107 -12.895 -6.420 13.136 1.00 28.38 C ATOM 23 C TRP A 107 -11.439 -6.353 12.690 1.00 28.02 C ATOM 24 O TRP A 107 -10.546 -6.089 13.504 1.00 27.90 O ATOM 25 CB TRP A 107 -13.468 -5.003 13.180 1.00 28.39 C ATOM 26 CG TRP A 107 -13.275 -4.271 11.873 1.00 28.11 C ATOM 27 CD1 TRP A 107 -14.104 -4.298 10.792 1.00 28.38 C ATOM 28 CD2 TRP A 107 -12.164 -3.439 11.506 1.00 28.36 C ATOM 29 NE1 TRP A 107 -13.590 -3.525 9.779 1.00 28.31 N ATOM 30 CE2 TRP A 107 -12.401 -2.984 10.191 1.00 28.42 C ATOM 31 CE3 TRP A 107 -10.996 -3.028 12.164 1.00 28.51 C ATOM 32 CZ2 TRP A 107 -11.510 -2.142 9.515 1.00 28.35 C ATOM 33 CZ3 TRP A 107 -10.108 -2.184 11.490 1.00 28.34 C ATOM 34 CH2 TRP A 107 -10.375 -1.752 10.181 1.00 28.53 C ATOM 0 H TRP A 107 -13.292 -6.592 15.070 1.00 29.19 H new ATOM 0 HA TRP A 107 -13.422 -6.940 12.509 1.00 28.38 H new ATOM 0 HB2 TRP A 107 -14.414 -5.044 13.389 1.00 28.39 H new ATOM 0 HB3 TRP A 107 -13.041 -4.505 13.894 1.00 28.39 H new ATOM 0 HD1 TRP A 107 -14.903 -4.772 10.746 1.00 28.38 H new ATOM 0 HE1 TRP A 107 -13.956 -3.401 9.011 1.00 28.31 H new ATOM 0 HE3 TRP A 107 -10.816 -3.311 13.031 1.00 28.51 H new ATOM 0 HZ2 TRP A 107 -11.681 -1.857 8.646 1.00 28.35 H new ATOM 0 HZ3 TRP A 107 -9.329 -1.905 11.915 1.00 28.34 H new ATOM 0 HH2 TRP A 107 -9.769 -1.189 9.756 1.00 28.53 H new ATOM 35 N PHE A 108 -11.218 -6.605 11.404 1.00 27.18 N ATOM 36 CA PHE A 108 -9.923 -6.369 10.776 1.00 26.90 C ATOM 37 C PHE A 108 -10.095 -5.928 9.317 1.00 26.61 C ATOM 38 O PHE A 108 -11.105 -6.263 8.684 1.00 26.32 O ATOM 39 CB PHE A 108 -9.013 -7.604 10.900 1.00 26.76 C ATOM 40 CG PHE A 108 -9.519 -8.816 10.177 1.00 26.84 C ATOM 41 CD1 PHE A 108 -10.330 -9.738 10.828 1.00 26.98 C ATOM 42 CD2 PHE A 108 -9.161 -9.055 8.855 1.00 26.47 C ATOM 43 CE1 PHE A 108 -10.790 -10.873 10.169 1.00 27.96 C ATOM 44 CE2 PHE A 108 -9.619 -10.182 8.188 1.00 27.10 C ATOM 45 CZ PHE A 108 -10.441 -11.093 8.851 1.00 27.34 C ATOM 0 H PHE A 108 -11.815 -6.918 10.870 1.00 27.18 H new ATOM 0 HA PHE A 108 -9.485 -5.644 11.248 1.00 26.90 H new ATOM 0 HB2 PHE A 108 -8.133 -7.380 10.559 1.00 26.76 H new ATOM 0 HB3 PHE A 108 -8.906 -7.821 11.839 1.00 26.76 H new ATOM 0 HD1 PHE A 108 -10.568 -9.594 11.715 1.00 26.98 H new ATOM 0 HD2 PHE A 108 -8.608 -8.452 8.413 1.00 26.47 H new ATOM 0 HE1 PHE A 108 -11.332 -11.483 10.615 1.00 27.96 H new ATOM 0 HE2 PHE A 108 -9.379 -10.330 7.302 1.00 27.10 H new ATOM 0 HZ PHE A 108 -10.754 -11.848 8.406 1.00 27.34 H new ATOM 46 N PRO A 109 -9.120 -5.165 8.782 1.00 26.15 N ATOM 47 CA PRO A 109 -9.170 -4.713 7.391 1.00 26.03 C ATOM 48 C PRO A 109 -9.097 -5.854 6.371 1.00 25.96 C ATOM 49 O PRO A 109 -8.317 -6.798 6.541 1.00 26.32 O ATOM 50 CB PRO A 109 -7.934 -3.803 7.273 1.00 25.86 C ATOM 51 CG PRO A 109 -7.022 -4.258 8.346 1.00 25.85 C ATOM 52 CD PRO A 109 -7.919 -4.654 9.475 1.00 26.02 C ATOM 0 HA PRO A 109 -10.012 -4.273 7.193 1.00 26.03 H new ATOM 0 HB2 PRO A 109 -7.519 -3.885 6.400 1.00 25.86 H new ATOM 0 HB3 PRO A 109 -8.172 -2.870 7.387 1.00 25.86 H new ATOM 0 HG2 PRO A 109 -6.478 -5.005 8.051 1.00 25.85 H new ATOM 0 HG3 PRO A 109 -6.413 -3.551 8.612 1.00 25.85 H new ATOM 0 HD2 PRO A 109 -7.512 -5.333 10.036 1.00 26.02 H new ATOM 0 HD3 PRO A 109 -8.129 -3.900 10.048 1.00 26.02 H new ATOM 53 N LYS A 110 -9.911 -5.753 5.325 1.00 25.69 N ATOM 54 CA LYS A 110 -9.979 -6.764 4.267 1.00 25.73 C ATOM 55 C LYS A 110 -9.336 -6.265 2.982 1.00 25.54 C ATOM 56 O LYS A 110 -9.005 -7.053 2.098 1.00 25.04 O ATOM 57 CB LYS A 110 -11.439 -7.171 4.013 1.00 26.00 C ATOM 58 CG LYS A 110 -11.990 -8.146 5.045 1.00 27.64 C ATOM 59 CD LYS A 110 -11.932 -9.587 4.530 1.00 30.76 C ATOM 60 CE LYS A 110 -12.196 -10.618 5.631 1.00 31.81 C ATOM 61 NZ LYS A 110 -13.447 -10.365 6.396 1.00 33.44 N ATOM 0 H LYS A 110 -10.446 -5.090 5.206 1.00 25.69 H new ATOM 0 HA LYS A 110 -9.482 -7.542 4.564 1.00 25.73 H new ATOM 0 HB2 LYS A 110 -11.992 -6.374 4.005 1.00 26.00 H new ATOM 0 HB3 LYS A 110 -11.506 -7.572 3.132 1.00 26.00 H new ATOM 0 HG2 LYS A 110 -11.481 -8.073 5.867 1.00 27.64 H new ATOM 0 HG3 LYS A 110 -12.907 -7.912 5.258 1.00 27.64 H new ATOM 0 HD2 LYS A 110 -12.586 -9.700 3.822 1.00 30.76 H new ATOM 0 HD3 LYS A 110 -11.060 -9.752 4.140 1.00 30.76 H new ATOM 0 HE2 LYS A 110 -12.243 -11.501 5.232 1.00 31.81 H new ATOM 0 HE3 LYS A 110 -11.445 -10.623 6.245 1.00 31.81 H new ATOM 0 HZ1 LYS A 110 -13.616 -11.059 6.928 1.00 33.44 H new ATOM 0 HZ2 LYS A 110 -13.350 -9.630 6.889 1.00 33.44 H new ATOM 0 HZ3 LYS A 110 -14.124 -10.254 5.829 1.00 33.44 H new ATOM 62 N LYS A 111 -9.167 -4.947 2.893 1.00 25.19 N ATOM 63 CA LYS A 111 -8.501 -4.301 1.765 1.00 25.31 C ATOM 64 C LYS A 111 -7.671 -3.111 2.252 1.00 24.48 C ATOM 65 O LYS A 111 -7.831 -2.659 3.380 1.00 24.14 O ATOM 66 CB LYS A 111 -9.508 -3.892 0.674 1.00 25.24 C ATOM 67 CG LYS A 111 -10.633 -2.962 1.104 1.00 26.30 C ATOM 68 CD LYS A 111 -11.710 -2.886 0.012 1.00 26.96 C ATOM 69 CE LYS A 111 -12.647 -1.700 0.219 1.00 30.54 C ATOM 70 NZ LYS A 111 -13.725 -1.614 -0.828 1.00 32.40 N ATOM 0 H LYS A 111 -9.440 -4.396 3.494 1.00 25.19 H new ATOM 0 HA LYS A 111 -7.896 -4.941 1.358 1.00 25.31 H new ATOM 0 HB2 LYS A 111 -9.019 -3.464 -0.046 1.00 25.24 H new ATOM 0 HB3 LYS A 111 -9.904 -4.698 0.308 1.00 25.24 H new ATOM 0 HG2 LYS A 111 -11.025 -3.280 1.932 1.00 26.30 H new ATOM 0 HG3 LYS A 111 -10.279 -2.076 1.280 1.00 26.30 H new ATOM 0 HD2 LYS A 111 -11.285 -2.814 -0.857 1.00 26.96 H new ATOM 0 HD3 LYS A 111 -12.225 -3.708 0.008 1.00 26.96 H new ATOM 0 HE2 LYS A 111 -13.058 -1.768 1.095 1.00 30.54 H new ATOM 0 HE3 LYS A 111 -12.129 -0.880 0.211 1.00 30.54 H new ATOM 0 HZ1 LYS A 111 -14.243 -0.909 -0.664 1.00 32.40 H new ATOM 0 HZ2 LYS A 111 -13.352 -1.527 -1.632 1.00 32.40 H new ATOM 0 HZ3 LYS A 111 -14.218 -2.355 -0.808 1.00 32.40 H new ATOM 71 N ILE A 112 -6.780 -2.613 1.401 1.00 24.38 N ATOM 72 CA ILE A 112 -5.868 -1.537 1.794 1.00 24.33 C ATOM 73 C ILE A 112 -6.613 -0.275 2.275 1.00 23.85 C ATOM 74 O ILE A 112 -6.193 0.355 3.241 1.00 23.01 O ATOM 75 CB ILE A 112 -4.811 -1.244 0.683 1.00 24.64 C ATOM 76 CG1 ILE A 112 -3.725 -0.288 1.185 1.00 25.79 C ATOM 77 CG2 ILE A 112 -5.468 -0.729 -0.589 1.00 25.07 C ATOM 78 CD1 ILE A 112 -2.435 -0.372 0.385 1.00 27.18 C ATOM 0 H ILE A 112 -6.685 -2.883 0.590 1.00 24.38 H new ATOM 0 HA ILE A 112 -5.372 -1.850 2.567 1.00 24.33 H new ATOM 0 HB ILE A 112 -4.378 -2.084 0.463 1.00 24.64 H new ATOM 0 HG12 ILE A 112 -4.062 0.621 1.150 1.00 25.79 H new ATOM 0 HG13 ILE A 112 -3.535 -0.484 2.116 1.00 25.79 H new ATOM 0 HG21 ILE A 112 -4.787 -0.557 -1.258 1.00 25.07 H new ATOM 0 HG22 ILE A 112 -6.090 -1.394 -0.924 1.00 25.07 H new ATOM 0 HG23 ILE A 112 -5.947 0.092 -0.396 1.00 25.07 H new ATOM 0 HD11 ILE A 112 -1.788 0.253 0.748 1.00 27.18 H new ATOM 0 HD12 ILE A 112 -2.079 -1.273 0.438 1.00 27.18 H new ATOM 0 HD13 ILE A 112 -2.614 -0.150 -0.542 1.00 27.18 H new ATOM 79 N SER A 113 -7.738 0.058 1.636 1.00 23.66 N ATOM 80 CA SER A 113 -8.501 1.253 2.019 1.00 23.47 C ATOM 81 C SER A 113 -9.176 1.138 3.393 1.00 23.44 C ATOM 82 O SER A 113 -9.535 2.155 3.998 1.00 23.36 O ATOM 83 CB SER A 113 -9.517 1.636 0.935 1.00 23.42 C ATOM 84 OG SER A 113 -10.435 0.583 0.693 1.00 23.97 O ATOM 0 H SER A 113 -8.075 -0.390 0.984 1.00 23.66 H new ATOM 0 HA SER A 113 -7.850 1.967 2.100 1.00 23.47 H new ATOM 0 HB2 SER A 113 -10.000 2.432 1.208 1.00 23.42 H new ATOM 0 HB3 SER A 113 -9.050 1.855 0.114 1.00 23.42 H new ATOM 0 HG SER A 113 -11.049 0.610 1.265 1.00 23.97 H new ATOM 85 N ASP A 114 -9.346 -0.089 3.892 1.00 23.09 N ATOM 86 CA ASP A 114 -9.951 -0.295 5.214 1.00 22.99 C ATOM 87 C ASP A 114 -9.078 0.262 6.341 1.00 22.65 C ATOM 88 O ASP A 114 -9.549 0.465 7.453 1.00 22.45 O ATOM 89 CB ASP A 114 -10.250 -1.781 5.470 1.00 23.03 C ATOM 90 CG ASP A 114 -11.490 -2.281 4.738 1.00 24.69 C ATOM 91 OD1 ASP A 114 -12.264 -1.463 4.195 1.00 25.25 O ATOM 92 OD2 ASP A 114 -11.696 -3.516 4.713 1.00 26.99 O ATOM 0 H ASP A 114 -9.120 -0.812 3.485 1.00 23.09 H new ATOM 0 HA ASP A 114 -10.788 0.196 5.211 1.00 22.99 H new ATOM 0 HB2 ASP A 114 -9.485 -2.310 5.196 1.00 23.03 H new ATOM 0 HB3 ASP A 114 -10.366 -1.922 6.423 1.00 23.03 H new ATOM 93 N LEU A 115 -7.800 0.514 6.056 1.00 22.59 N ATOM 94 CA LEU A 115 -6.914 1.097 7.062 1.00 22.73 C ATOM 95 C LEU A 115 -7.322 2.534 7.412 1.00 22.78 C ATOM 96 O LEU A 115 -6.915 3.058 8.445 1.00 22.30 O ATOM 97 CB LEU A 115 -5.445 1.020 6.623 1.00 22.47 C ATOM 98 CG LEU A 115 -4.857 -0.379 6.381 1.00 21.59 C ATOM 99 CD1 LEU A 115 -3.476 -0.277 5.744 1.00 22.34 C ATOM 100 CD2 LEU A 115 -4.794 -1.211 7.651 1.00 21.45 C ATOM 0 H LEU A 115 -7.431 0.357 5.295 1.00 22.59 H new ATOM 0 HA LEU A 115 -7.006 0.569 7.870 1.00 22.73 H new ATOM 0 HB2 LEU A 115 -5.348 1.532 5.805 1.00 22.47 H new ATOM 0 HB3 LEU A 115 -4.906 1.460 7.299 1.00 22.47 H new ATOM 0 HG LEU A 115 -5.457 -0.835 5.770 1.00 21.59 H new ATOM 0 HD11 LEU A 115 -3.120 -1.167 5.598 1.00 22.34 H new ATOM 0 HD12 LEU A 115 -3.545 0.186 4.895 1.00 22.34 H new ATOM 0 HD13 LEU A 115 -2.883 0.215 6.333 1.00 22.34 H new ATOM 0 HD21 LEU A 115 -4.418 -2.082 7.449 1.00 21.45 H new ATOM 0 HD22 LEU A 115 -4.236 -0.762 8.305 1.00 21.45 H new ATOM 0 HD23 LEU A 115 -5.688 -1.321 8.011 1.00 21.45 H new ATOM 101 N ASP A 116 -8.132 3.152 6.550 1.00 23.75 N ATOM 102 CA ASP A 116 -8.768 4.443 6.855 1.00 25.23 C ATOM 103 C ASP A 116 -9.546 4.394 8.168 1.00 26.40 C ATOM 104 O ASP A 116 -9.651 5.398 8.869 1.00 26.45 O ATOM 105 CB ASP A 116 -9.754 4.846 5.753 1.00 24.55 C ATOM 106 CG ASP A 116 -9.078 5.367 4.499 1.00 24.70 C ATOM 107 OD1 ASP A 116 -7.846 5.603 4.498 1.00 23.70 O ATOM 108 OD2 ASP A 116 -9.808 5.553 3.508 1.00 22.95 O ATOM 0 H ASP A 116 -8.329 2.838 5.774 1.00 23.75 H new ATOM 0 HA ASP A 116 -8.048 5.089 6.921 1.00 25.23 H new ATOM 0 HB2 ASP A 116 -10.301 4.079 5.522 1.00 24.55 H new ATOM 0 HB3 ASP A 116 -10.352 5.528 6.097 1.00 24.55 H new ATOM 109 N HIS A 117 -10.098 3.226 8.491 1.00 28.15 N ATOM 110 CA HIS A 117 -10.989 3.095 9.646 1.00 29.88 C ATOM 111 C HIS A 117 -10.294 2.872 10.997 1.00 31.35 C ATOM 112 O HIS A 117 -10.957 2.859 12.037 1.00 31.70 O ATOM 113 CB HIS A 117 -12.047 2.011 9.389 1.00 29.77 C ATOM 114 CG HIS A 117 -12.716 2.130 8.055 1.00 29.37 C ATOM 115 ND1 HIS A 117 -13.432 3.247 7.677 1.00 29.51 N ATOM 116 CD2 HIS A 117 -12.773 1.276 7.007 1.00 29.34 C ATOM 117 CE1 HIS A 117 -13.892 3.079 6.451 1.00 28.74 C ATOM 118 NE2 HIS A 117 -13.515 1.888 6.025 1.00 29.68 N ATOM 0 H HIS A 117 -9.970 2.496 8.055 1.00 28.15 H new ATOM 0 HA HIS A 117 -11.413 3.963 9.733 1.00 29.88 H new ATOM 0 HB2 HIS A 117 -11.628 1.139 9.455 1.00 29.77 H new ATOM 0 HB3 HIS A 117 -12.721 2.056 10.085 1.00 29.77 H new ATOM 0 HD2 HIS A 117 -12.383 0.433 6.960 1.00 29.34 H new ATOM 0 HE1 HIS A 117 -14.396 3.695 5.970 1.00 28.74 H new ATOM 0 HE2 HIS A 117 -13.703 1.550 5.257 1.00 29.68 H new ATOM 119 N CYS A 118 -8.971 2.724 10.995 1.00 32.87 N ATOM 120 CA CYS A 118 -8.233 2.530 12.244 1.00 34.74 C ATOM 121 C CYS A 118 -7.017 3.444 12.412 1.00 36.30 C ATOM 122 O CYS A 118 -6.628 3.768 13.537 1.00 36.28 O ATOM 123 CB CYS A 118 -7.452 1.144 12.337 0.00 46.79 C ATOM 124 SG CYS A 118 -6.683 0.240 11.101 1.00 39.89 S ATOM 0 H CYS A 118 -8.483 2.733 10.287 1.00 32.87 H new ATOM 0 HA CYS A 118 -8.955 2.660 12.878 1.00 34.74 H new ATOM 0 HB2 CYS A 118 -6.759 1.296 12.998 0.00 46.79 H new ATOM 0 HB3 CYS A 118 -8.090 0.528 12.731 0.00 46.79 H new ATOM 0 HG CYS A 118 -6.219 -0.763 11.568 1.00 39.89 H new ATOM 125 N ALA A 119 -6.426 3.858 11.292 1.00 37.56 N ATOM 126 CA ALA A 119 -5.189 4.649 11.299 1.00 38.78 C ATOM 127 C ALA A 119 -5.310 5.988 12.040 1.00 39.68 C ATOM 128 O ALA A 119 -4.308 6.678 12.248 1.00 40.11 O ATOM 129 CB ALA A 119 -4.687 4.863 9.873 1.00 38.57 C ATOM 0 H ALA A 119 -6.729 3.689 10.505 1.00 37.56 H new ATOM 0 HA ALA A 119 -4.540 4.130 11.799 1.00 38.78 H new ATOM 0 HB1 ALA A 119 -3.870 5.386 9.892 1.00 38.57 H new ATOM 0 HB2 ALA A 119 -4.510 4.004 9.460 1.00 38.57 H new ATOM 0 HB3 ALA A 119 -5.361 5.335 9.360 1.00 38.57 H new ATOM 130 N ASN A 120 -6.534 6.341 12.433 1.00 40.66 N ATOM 131 CA ASN A 120 -6.799 7.560 13.196 1.00 41.40 C ATOM 132 C ASN A 120 -7.081 7.306 14.683 1.00 42.02 C ATOM 133 O ASN A 120 -7.389 8.240 15.430 1.00 42.14 O ATOM 134 CB ASN A 120 -7.952 8.344 12.558 1.00 41.33 C ATOM 135 CG ASN A 120 -7.832 9.206 11.768 0.00 58.06 C ATOM 136 OD1 ASN A 120 -6.740 9.300 11.168 0.00 65.51 O ATOM 137 ND2 ASN A 120 -8.864 9.825 11.156 0.00 64.40 N ATOM 0 H ASN A 120 -7.238 5.877 12.263 1.00 40.66 H new ATOM 0 HA ASN A 120 -5.985 8.086 13.162 1.00 41.40 H new ATOM 0 HB2 ASN A 120 -8.525 7.681 12.142 1.00 41.33 H new ATOM 0 HB3 ASN A 120 -8.451 8.728 13.296 1.00 41.33 H new ATOM 0 HD21 ASN A 120 -8.737 10.240 10.413 0.00 64.40 H new ATOM 0 HD22 ASN A 120 -9.648 9.804 11.509 0.00 64.40 H new ATOM 138 N ARG A 121 -6.970 6.047 15.109 1.00 42.63 N ATOM 139 CA ARG A 121 -7.166 5.680 16.518 1.00 43.16 C ATOM 140 C ARG A 121 -5.867 5.776 17.324 1.00 43.01 C ATOM 141 O ARG A 121 -5.174 4.779 17.543 1.00 43.03 O ATOM 142 CB ARG A 121 -7.787 4.279 16.646 1.00 43.36 C ATOM 143 CG ARG A 121 -9.315 4.253 16.592 1.00 45.08 C ATOM 144 CD ARG A 121 -9.852 4.380 15.171 1.00 47.82 C ATOM 145 NE ARG A 121 -11.235 4.861 15.148 1.00 50.11 N ATOM 146 CZ ARG A 121 -11.588 6.142 15.041 1.00 50.82 C ATOM 147 NH1 ARG A 121 -10.665 7.093 14.938 1.00 51.25 N ATOM 148 NH2 ARG A 121 -12.872 6.472 15.036 1.00 51.17 N ATOM 0 H ARG A 121 -6.780 5.384 14.595 1.00 42.63 H new ATOM 0 HA ARG A 121 -7.787 6.323 16.894 1.00 43.16 H new ATOM 0 HB2 ARG A 121 -7.440 3.718 15.935 1.00 43.36 H new ATOM 0 HB3 ARG A 121 -7.498 3.885 17.484 1.00 43.36 H new ATOM 0 HG2 ARG A 121 -9.635 3.425 16.983 1.00 45.08 H new ATOM 0 HG3 ARG A 121 -9.667 4.977 17.133 1.00 45.08 H new ATOM 0 HD2 ARG A 121 -9.290 4.989 14.667 1.00 47.82 H new ATOM 0 HD3 ARG A 121 -9.803 3.518 14.729 1.00 47.82 H new ATOM 0 HE ARG A 121 -11.863 4.276 15.208 1.00 50.11 H new ATOM 0 HH11 ARG A 121 -9.831 6.884 14.940 1.00 51.25 H new ATOM 0 HH12 ARG A 121 -10.902 7.917 14.869 1.00 51.25 H new ATOM 0 HH21 ARG A 121 -13.473 5.861 15.102 1.00 51.17 H new ATOM 0 HH22 ARG A 121 -13.104 7.297 14.967 1.00 51.17 H new ATOM 149 N ASP A 138 8.083 22.557 24.231 1.00 49.51 N ATOM 150 CA ASP A 138 7.835 23.928 24.673 1.00 49.35 C ATOM 151 C ASP A 138 6.379 24.349 24.465 1.00 49.27 C ATOM 152 O ASP A 138 5.538 24.114 25.334 1.00 49.67 O ATOM 153 CB ASP A 138 8.800 24.910 23.990 1.00 49.51 C ATOM 154 CG ASP A 138 9.122 24.521 22.557 1.00 49.43 C ATOM 155 OD1 ASP A 138 9.922 23.579 22.362 1.00 49.31 O ATOM 156 OD2 ASP A 138 8.587 25.168 21.632 1.00 49.85 O ATOM 0 HA ASP A 138 8.002 23.954 25.628 1.00 49.35 H new ATOM 0 HB2 ASP A 138 8.411 25.798 24.000 1.00 49.51 H new ATOM 0 HB3 ASP A 138 9.623 24.956 24.501 1.00 49.51 H new ATOM 157 N ASN A 139 6.098 24.975 23.321 1.00 48.85 N ATOM 158 CA ASN A 139 4.750 25.408 22.937 1.00 48.35 C ATOM 159 C ASN A 139 4.676 25.610 21.426 1.00 47.56 C ATOM 160 O ASN A 139 3.662 25.299 20.795 1.00 47.54 O ATOM 161 CB ASN A 139 4.358 26.699 23.663 1.00 48.69 C ATOM 162 CG ASN A 139 2.851 26.903 23.732 1.00 49.42 C ATOM 163 OD1 ASN A 139 2.175 27.035 22.707 1.00 50.65 O ATOM 164 ND2 ASN A 139 2.319 26.941 24.950 1.00 50.05 N ATOM 0 H ASN A 139 6.697 25.164 22.734 1.00 48.85 H new ATOM 0 HA ASN A 139 4.123 24.715 23.196 1.00 48.35 H new ATOM 0 HB2 ASN A 139 4.719 26.681 24.563 1.00 48.69 H new ATOM 0 HB3 ASN A 139 4.762 27.455 23.210 1.00 48.69 H new ATOM 0 HD21 ASN A 139 1.473 27.061 25.046 1.00 50.05 H new ATOM 0 HD22 ASN A 139 2.821 26.845 25.642 1.00 50.05 H new ATOM 165 N VAL A 140 5.757 26.143 20.859 1.00 46.56 N ATOM 166 CA VAL A 140 5.954 26.173 19.410 1.00 45.58 C ATOM 167 C VAL A 140 6.064 24.728 18.904 1.00 44.77 C ATOM 168 O VAL A 140 5.540 24.396 17.838 1.00 44.41 O ATOM 169 CB VAL A 140 7.216 26.995 19.018 1.00 45.70 C ATOM 170 CG1 VAL A 140 7.539 26.852 17.533 1.00 45.44 C ATOM 171 CG2 VAL A 140 7.034 28.466 19.377 1.00 45.87 C ATOM 0 H VAL A 140 6.400 26.499 21.306 1.00 46.56 H new ATOM 0 HA VAL A 140 5.196 26.613 18.995 1.00 45.58 H new ATOM 0 HB VAL A 140 7.964 26.639 19.523 1.00 45.70 H new ATOM 0 HG11 VAL A 140 8.328 27.375 17.322 1.00 45.44 H new ATOM 0 HG12 VAL A 140 7.705 25.919 17.326 1.00 45.44 H new ATOM 0 HG13 VAL A 140 6.790 27.171 17.006 1.00 45.44 H new ATOM 0 HG21 VAL A 140 7.829 28.961 19.126 1.00 45.87 H new ATOM 0 HG22 VAL A 140 6.268 28.823 18.902 1.00 45.87 H new ATOM 0 HG23 VAL A 140 6.889 28.551 20.332 1.00 45.87 H new ATOM 172 N TYR A 141 6.735 23.880 19.687 1.00 43.78 N ATOM 173 CA TYR A 141 6.830 22.448 19.399 1.00 43.01 C ATOM 174 C TYR A 141 5.458 21.768 19.426 1.00 42.36 C ATOM 175 O TYR A 141 5.203 20.864 18.632 1.00 42.24 O ATOM 176 CB TYR A 141 7.796 21.743 20.367 1.00 43.04 C ATOM 177 CG TYR A 141 8.076 20.296 20.004 1.00 43.04 C ATOM 178 CD1 TYR A 141 7.450 19.248 20.682 1.00 43.09 C ATOM 179 CD2 TYR A 141 8.960 19.975 18.972 1.00 43.53 C ATOM 180 CE1 TYR A 141 7.705 17.910 20.346 1.00 43.24 C ATOM 181 CE2 TYR A 141 9.217 18.644 18.625 1.00 43.40 C ATOM 182 CZ TYR A 141 8.586 17.620 19.315 1.00 43.37 C ATOM 183 OH TYR A 141 8.842 16.309 18.964 1.00 43.51 O ATOM 0 H TYR A 141 7.149 24.121 20.402 1.00 43.78 H new ATOM 0 HA TYR A 141 7.185 22.367 18.500 1.00 43.01 H new ATOM 0 HB2 TYR A 141 8.634 22.231 20.387 1.00 43.04 H new ATOM 0 HB3 TYR A 141 7.426 21.778 21.263 1.00 43.04 H new ATOM 0 HD1 TYR A 141 6.853 19.440 21.369 1.00 43.09 H new ATOM 0 HD2 TYR A 141 9.386 20.658 18.507 1.00 43.53 H new ATOM 0 HE1 TYR A 141 7.286 17.222 20.811 1.00 43.24 H new ATOM 0 HE2 TYR A 141 9.808 18.447 17.935 1.00 43.40 H new ATOM 0 HH TYR A 141 9.390 16.291 18.328 1.00 43.51 H new ATOM 184 N ARG A 142 4.588 22.205 20.339 1.00 41.46 N ATOM 185 CA ARG A 142 3.240 21.639 20.473 1.00 40.69 C ATOM 186 C ARG A 142 2.337 21.962 19.286 1.00 39.84 C ATOM 187 O ARG A 142 1.590 21.099 18.825 1.00 39.84 O ATOM 188 CB ARG A 142 2.574 22.098 21.774 1.00 40.78 C ATOM 189 CG ARG A 142 2.894 21.234 22.984 1.00 41.23 C ATOM 190 CD ARG A 142 2.101 21.699 24.203 1.00 41.55 C ATOM 191 NE ARG A 142 2.152 20.730 25.297 1.00 43.24 N ATOM 192 CZ ARG A 142 1.298 19.723 25.460 1.00 43.11 C ATOM 193 NH1 ARG A 142 1.444 18.901 26.487 1.00 43.98 N ATOM 194 NH2 ARG A 142 0.302 19.528 24.603 1.00 43.69 N ATOM 0 H ARG A 142 4.761 22.836 20.897 1.00 41.46 H new ATOM 0 HA ARG A 142 3.356 20.676 20.494 1.00 40.69 H new ATOM 0 HB2 ARG A 142 2.848 23.010 21.960 1.00 40.78 H new ATOM 0 HB3 ARG A 142 1.613 22.111 21.645 1.00 40.78 H new ATOM 0 HG2 ARG A 142 2.684 20.307 22.790 1.00 41.23 H new ATOM 0 HG3 ARG A 142 3.844 21.276 23.175 1.00 41.23 H new ATOM 0 HD2 ARG A 142 2.452 22.550 24.510 1.00 41.55 H new ATOM 0 HD3 ARG A 142 1.177 21.848 23.948 1.00 41.55 H new ATOM 0 HE ARG A 142 2.780 20.818 25.878 1.00 43.24 H new ATOM 0 HH11 ARG A 142 2.088 19.019 27.044 1.00 43.98 H new ATOM 0 HH12 ARG A 142 0.895 18.248 26.597 1.00 43.98 H new ATOM 0 HH21 ARG A 142 0.203 20.056 23.932 1.00 43.69 H new ATOM 0 HH22 ARG A 142 -0.243 18.873 24.719 1.00 43.69 H new ATOM 195 N LYS A 143 2.397 23.206 18.810 1.00 38.84 N ATOM 196 CA LYS A 143 1.637 23.633 17.631 1.00 37.97 C ATOM 197 C LYS A 143 2.143 22.945 16.363 1.00 36.90 C ATOM 198 O LYS A 143 1.366 22.645 15.457 1.00 36.66 O ATOM 199 CB LYS A 143 1.708 25.152 17.459 1.00 38.15 C ATOM 200 CG LYS A 143 0.918 25.941 18.495 1.00 39.39 C ATOM 201 CD LYS A 143 0.597 27.352 17.999 1.00 41.62 C ATOM 202 CE LYS A 143 -0.656 27.374 17.124 1.00 42.62 C ATOM 203 NZ LYS A 143 -1.042 28.759 16.717 1.00 43.52 N ATOM 0 H LYS A 143 2.879 23.826 19.160 1.00 38.84 H new ATOM 0 HA LYS A 143 0.713 23.374 17.773 1.00 37.97 H new ATOM 0 HB2 LYS A 143 2.637 25.428 17.498 1.00 38.15 H new ATOM 0 HB3 LYS A 143 1.381 25.382 16.575 1.00 38.15 H new ATOM 0 HG2 LYS A 143 0.093 25.473 18.700 1.00 39.39 H new ATOM 0 HG3 LYS A 143 1.426 25.994 19.319 1.00 39.39 H new ATOM 0 HD2 LYS A 143 0.471 27.941 18.759 1.00 41.62 H new ATOM 0 HD3 LYS A 143 1.350 27.697 17.494 1.00 41.62 H new ATOM 0 HE2 LYS A 143 -0.503 26.837 16.331 1.00 42.62 H new ATOM 0 HE3 LYS A 143 -1.391 26.964 17.606 1.00 42.62 H new ATOM 0 HZ1 LYS A 143 -1.773 28.727 16.211 1.00 43.52 H new ATOM 0 HZ2 LYS A 143 -1.205 29.247 17.443 1.00 43.52 H new ATOM 0 HZ3 LYS A 143 -0.378 29.129 16.255 1.00 43.52 H new ATOM 204 N ARG A 144 3.450 22.702 16.312 1.00 35.77 N ATOM 205 CA ARG A 144 4.071 22.025 15.177 1.00 34.68 C ATOM 206 C ARG A 144 3.689 20.544 15.142 1.00 34.15 C ATOM 207 O ARG A 144 3.452 19.987 14.068 1.00 34.16 O ATOM 208 CB ARG A 144 5.596 22.205 15.207 1.00 34.36 C ATOM 209 CG ARG A 144 6.346 21.615 14.014 1.00 33.70 C ATOM 210 CD ARG A 144 6.021 22.318 12.701 1.00 31.76 C ATOM 211 NE ARG A 144 6.928 21.903 11.632 1.00 30.23 N ATOM 212 CZ ARG A 144 6.820 22.266 10.358 1.00 29.61 C ATOM 213 NH1 ARG A 144 5.831 23.061 9.963 1.00 29.60 N ATOM 214 NH2 ARG A 144 7.706 21.831 9.470 1.00 28.25 N ATOM 0 H ARG A 144 4.001 22.925 16.934 1.00 35.77 H new ATOM 0 HA ARG A 144 3.736 22.432 14.363 1.00 34.68 H new ATOM 0 HB2 ARG A 144 5.794 23.153 15.258 1.00 34.36 H new ATOM 0 HB3 ARG A 144 5.939 21.799 16.019 1.00 34.36 H new ATOM 0 HG2 ARG A 144 7.300 21.671 14.178 1.00 33.70 H new ATOM 0 HG3 ARG A 144 6.127 20.673 13.934 1.00 33.70 H new ATOM 0 HD2 ARG A 144 5.106 22.121 12.445 1.00 31.76 H new ATOM 0 HD3 ARG A 144 6.081 23.278 12.823 1.00 31.76 H new ATOM 0 HE ARG A 144 7.581 21.385 11.844 1.00 30.23 H new ATOM 0 HH11 ARG A 144 5.254 23.345 10.534 1.00 29.60 H new ATOM 0 HH12 ARG A 144 5.768 23.291 9.137 1.00 29.60 H new ATOM 0 HH21 ARG A 144 8.348 21.316 9.720 1.00 28.25 H new ATOM 0 HH22 ARG A 144 7.638 22.064 8.645 1.00 28.25 H new ATOM 215 N ARG A 145 3.625 19.915 16.312 1.00 33.27 N ATOM 216 CA ARG A 145 3.198 18.519 16.405 1.00 32.69 C ATOM 217 C ARG A 145 1.729 18.363 16.030 1.00 32.36 C ATOM 218 O ARG A 145 1.330 17.339 15.474 1.00 32.03 O ATOM 219 CB ARG A 145 3.449 17.954 17.804 1.00 32.76 C ATOM 220 CG ARG A 145 4.916 17.677 18.129 1.00 32.73 C ATOM 221 CD ARG A 145 5.475 16.479 17.361 1.00 32.48 C ATOM 222 NE ARG A 145 4.833 15.217 17.724 1.00 32.28 N ATOM 223 CZ ARG A 145 5.316 14.348 18.606 1.00 32.57 C ATOM 224 NH1 ARG A 145 6.458 14.597 19.239 1.00 32.94 N ATOM 225 NH2 ARG A 145 4.654 13.225 18.859 1.00 32.53 N ATOM 0 H ARG A 145 3.825 20.278 17.066 1.00 33.27 H new ATOM 0 HA ARG A 145 3.730 18.013 15.771 1.00 32.69 H new ATOM 0 HB2 ARG A 145 3.098 18.578 18.459 1.00 32.76 H new ATOM 0 HB3 ARG A 145 2.948 17.129 17.901 1.00 32.76 H new ATOM 0 HG2 ARG A 145 5.443 18.464 17.921 1.00 32.73 H new ATOM 0 HG3 ARG A 145 5.008 17.517 19.081 1.00 32.73 H new ATOM 0 HD2 ARG A 145 5.363 16.631 16.409 1.00 32.48 H new ATOM 0 HD3 ARG A 145 6.428 16.411 17.528 1.00 32.48 H new ATOM 0 HE ARG A 145 4.089 15.023 17.339 1.00 32.28 H new ATOM 0 HH11 ARG A 145 6.889 15.324 19.079 1.00 32.94 H new ATOM 0 HH12 ARG A 145 6.766 14.031 19.809 1.00 32.94 H new ATOM 0 HH21 ARG A 145 3.914 13.061 18.452 1.00 32.53 H new ATOM 0 HH22 ARG A 145 4.965 12.662 19.429 1.00 32.53 H new ATOM 226 N LYS A 146 0.935 19.385 16.343 1.00 31.85 N ATOM 227 CA LYS A 146 -0.490 19.406 16.024 1.00 31.74 C ATOM 228 C LYS A 146 -0.678 19.526 14.513 1.00 30.95 C ATOM 229 O LYS A 146 -1.596 18.925 13.938 1.00 30.87 O ATOM 230 CB LYS A 146 -1.174 20.577 16.741 1.00 32.14 C ATOM 231 CG LYS A 146 -2.480 20.218 17.432 1.00 34.48 C ATOM 232 CD LYS A 146 -3.636 20.082 16.454 1.00 37.84 C ATOM 233 CE LYS A 146 -4.529 21.322 16.459 1.00 39.55 C ATOM 234 NZ LYS A 146 -5.623 21.192 15.451 1.00 40.16 N ATOM 0 H LYS A 146 1.211 20.091 16.750 1.00 31.85 H new ATOM 0 HA LYS A 146 -0.896 18.579 16.327 1.00 31.74 H new ATOM 0 HB2 LYS A 146 -0.562 20.940 17.400 1.00 32.14 H new ATOM 0 HB3 LYS A 146 -1.346 21.281 16.096 1.00 32.14 H new ATOM 0 HG2 LYS A 146 -2.369 19.384 17.915 1.00 34.48 H new ATOM 0 HG3 LYS A 146 -2.694 20.900 18.088 1.00 34.48 H new ATOM 0 HD2 LYS A 146 -3.289 19.937 15.560 1.00 37.84 H new ATOM 0 HD3 LYS A 146 -4.164 19.301 16.683 1.00 37.84 H new ATOM 0 HE2 LYS A 146 -4.910 21.447 17.342 1.00 39.55 H new ATOM 0 HE3 LYS A 146 -3.997 22.110 16.265 1.00 39.55 H new ATOM 0 HZ1 LYS A 146 -5.965 21.995 15.279 1.00 40.16 H new ATOM 0 HZ2 LYS A 146 -5.296 20.842 14.701 1.00 40.16 H new ATOM 0 HZ3 LYS A 146 -6.261 20.661 15.772 1.00 40.16 H new ATOM 235 N TYR A 147 0.198 20.311 13.885 1.00 30.03 N ATOM 236 CA TYR A 147 0.249 20.444 12.434 1.00 29.33 C ATOM 237 C TYR A 147 0.444 19.076 11.770 1.00 28.84 C ATOM 238 O TYR A 147 -0.315 18.706 10.866 1.00 28.71 O ATOM 239 CB TYR A 147 1.361 21.420 12.023 1.00 29.48 C ATOM 240 CG TYR A 147 1.738 21.344 10.564 1.00 29.79 C ATOM 241 CD1 TYR A 147 0.978 21.990 9.593 1.00 29.38 C ATOM 242 CD2 TYR A 147 2.856 20.613 10.151 1.00 29.18 C ATOM 243 CE1 TYR A 147 1.317 21.908 8.245 1.00 30.11 C ATOM 244 CE2 TYR A 147 3.204 20.530 8.809 1.00 30.17 C ATOM 245 CZ TYR A 147 2.432 21.182 7.862 1.00 30.35 C ATOM 246 OH TYR A 147 2.778 21.094 6.532 1.00 30.58 O ATOM 0 H TYR A 147 0.785 20.786 14.297 1.00 30.03 H new ATOM 0 HA TYR A 147 -0.598 20.805 12.129 1.00 29.33 H new ATOM 0 HB2 TYR A 147 1.076 22.324 12.227 1.00 29.48 H new ATOM 0 HB3 TYR A 147 2.149 21.243 12.560 1.00 29.48 H new ATOM 0 HD1 TYR A 147 0.233 22.484 9.849 1.00 29.38 H new ATOM 0 HD2 TYR A 147 3.376 20.175 10.786 1.00 29.18 H new ATOM 0 HE1 TYR A 147 0.797 22.339 7.605 1.00 30.11 H new ATOM 0 HE2 TYR A 147 3.950 20.040 8.548 1.00 30.17 H new ATOM 0 HH TYR A 147 2.226 21.527 6.070 1.00 30.58 H new ATOM 247 N PHE A 148 1.448 18.330 12.231 1.00 27.97 N ATOM 248 CA PHE A 148 1.716 16.985 11.708 1.00 27.30 C ATOM 249 C PHE A 148 0.588 15.997 12.010 1.00 27.04 C ATOM 250 O PHE A 148 0.209 15.200 11.145 1.00 26.43 O ATOM 251 CB PHE A 148 3.045 16.440 12.237 1.00 27.11 C ATOM 252 CG PHE A 148 4.259 17.032 11.570 1.00 26.69 C ATOM 253 CD1 PHE A 148 5.110 17.880 12.275 1.00 26.52 C ATOM 254 CD2 PHE A 148 4.557 16.737 10.243 1.00 26.20 C ATOM 255 CE1 PHE A 148 6.242 18.422 11.667 1.00 26.17 C ATOM 256 CE2 PHE A 148 5.685 17.270 9.627 1.00 25.76 C ATOM 257 CZ PHE A 148 6.528 18.121 10.339 1.00 26.08 C ATOM 0 H PHE A 148 1.989 18.584 12.849 1.00 27.97 H new ATOM 0 HA PHE A 148 1.772 17.077 10.744 1.00 27.30 H new ATOM 0 HB2 PHE A 148 3.097 16.609 13.191 1.00 27.11 H new ATOM 0 HB3 PHE A 148 3.059 15.477 12.118 1.00 27.11 H new ATOM 0 HD1 PHE A 148 4.921 18.087 13.162 1.00 26.52 H new ATOM 0 HD2 PHE A 148 3.994 16.175 9.761 1.00 26.20 H new ATOM 0 HE1 PHE A 148 6.805 18.984 12.149 1.00 26.17 H new ATOM 0 HE2 PHE A 148 5.876 17.059 8.742 1.00 25.76 H new ATOM 0 HZ PHE A 148 7.278 18.486 9.928 1.00 26.08 H new ATOM 258 N ALA A 149 0.057 16.045 13.232 1.00 26.90 N ATOM 259 CA ALA A 149 -1.042 15.163 13.624 1.00 26.94 C ATOM 260 C ALA A 149 -2.271 15.352 12.739 1.00 27.33 C ATOM 261 O ALA A 149 -2.926 14.371 12.360 1.00 26.73 O ATOM 262 CB ALA A 149 -1.409 15.366 15.089 1.00 27.07 C ATOM 0 H ALA A 149 0.320 16.583 13.850 1.00 26.90 H new ATOM 0 HA ALA A 149 -0.730 14.252 13.504 1.00 26.94 H new ATOM 0 HB1 ALA A 149 -2.138 14.772 15.325 1.00 27.07 H new ATOM 0 HB2 ALA A 149 -0.639 15.170 15.646 1.00 27.07 H new ATOM 0 HB3 ALA A 149 -1.683 16.286 15.230 1.00 27.07 H new ATOM 263 N ASP A 150 -2.578 16.609 12.416 1.00 27.40 N ATOM 264 CA ASP A 150 -3.709 16.920 11.543 1.00 28.18 C ATOM 265 C ASP A 150 -3.496 16.398 10.116 1.00 27.98 C ATOM 266 O ASP A 150 -4.443 15.927 9.490 1.00 28.02 O ATOM 267 CB ASP A 150 -4.022 18.422 11.539 1.00 28.51 C ATOM 268 CG ASP A 150 -4.662 18.903 12.846 1.00 30.18 C ATOM 269 OD1 ASP A 150 -5.129 18.068 13.645 1.00 32.04 O ATOM 270 OD2 ASP A 150 -4.706 20.131 13.071 1.00 32.56 O ATOM 0 H ASP A 150 -2.142 17.297 12.693 1.00 27.40 H new ATOM 0 HA ASP A 150 -4.479 16.457 11.908 1.00 28.18 H new ATOM 0 HB2 ASP A 150 -3.203 18.918 11.384 1.00 28.51 H new ATOM 0 HB3 ASP A 150 -4.618 18.621 10.800 1.00 28.51 H new ATOM 271 N LEU A 151 -2.265 16.481 9.605 1.00 27.72 N ATOM 272 CA LEU A 151 -1.967 15.951 8.267 1.00 27.64 C ATOM 273 C LEU A 151 -2.271 14.463 8.198 1.00 27.27 C ATOM 274 O LEU A 151 -2.859 13.992 7.225 1.00 27.25 O ATOM 275 CB LEU A 151 -0.514 16.206 7.845 1.00 27.96 C ATOM 276 CG LEU A 151 -0.031 17.619 7.499 1.00 28.81 C ATOM 277 CD1 LEU A 151 1.419 17.543 7.048 1.00 29.82 C ATOM 278 CD2 LEU A 151 -0.882 18.309 6.432 1.00 29.49 C ATOM 0 H LEU A 151 -1.594 16.836 10.010 1.00 27.72 H new ATOM 0 HA LEU A 151 -2.540 16.427 7.646 1.00 27.64 H new ATOM 0 HB2 LEU A 151 0.052 15.879 8.562 1.00 27.96 H new ATOM 0 HB3 LEU A 151 -0.341 15.648 7.070 1.00 27.96 H new ATOM 0 HG LEU A 151 -0.116 18.161 8.299 1.00 28.81 H new ATOM 0 HD11 LEU A 151 1.736 18.432 6.826 1.00 29.82 H new ATOM 0 HD12 LEU A 151 1.962 17.176 7.763 1.00 29.82 H new ATOM 0 HD13 LEU A 151 1.486 16.972 6.267 1.00 29.82 H new ATOM 0 HD21 LEU A 151 -0.527 19.195 6.258 1.00 29.49 H new ATOM 0 HD22 LEU A 151 -0.862 17.787 5.615 1.00 29.49 H new ATOM 0 HD23 LEU A 151 -1.797 18.383 6.746 1.00 29.49 H new ATOM 279 N ALA A 152 -1.879 13.734 9.244 1.00 27.09 N ATOM 280 CA ALA A 152 -2.135 12.303 9.329 1.00 27.35 C ATOM 281 C ALA A 152 -3.632 12.001 9.416 1.00 27.74 C ATOM 282 O ALA A 152 -4.133 11.131 8.705 1.00 27.42 O ATOM 283 CB ALA A 152 -1.410 11.712 10.510 1.00 27.12 C ATOM 0 H ALA A 152 -1.458 14.058 9.921 1.00 27.09 H new ATOM 0 HA ALA A 152 -1.801 11.894 8.515 1.00 27.35 H new ATOM 0 HB1 ALA A 152 -1.588 10.760 10.556 1.00 27.12 H new ATOM 0 HB2 ALA A 152 -0.456 11.858 10.410 1.00 27.12 H new ATOM 0 HB3 ALA A 152 -1.718 12.138 11.325 1.00 27.12 H new ATOM 284 N MET A 153 -4.334 12.729 10.284 1.00 28.13 N ATOM 285 CA MET A 153 -5.764 12.499 10.538 1.00 28.80 C ATOM 286 C MET A 153 -6.626 12.749 9.305 1.00 28.16 C ATOM 287 O MET A 153 -7.594 12.027 9.052 1.00 28.40 O ATOM 288 CB MET A 153 -6.253 13.379 11.699 1.00 29.40 C ATOM 289 CG MET A 153 -5.716 12.976 13.066 1.00 31.97 C ATOM 290 SD MET A 153 -6.358 11.385 13.617 1.00 40.62 S ATOM 291 CE MET A 153 -7.646 11.701 14.586 0.00 53.19 C ATOM 0 H MET A 153 -3.997 13.372 10.745 1.00 28.13 H new ATOM 0 HA MET A 153 -5.857 11.563 10.775 1.00 28.80 H new ATOM 0 HB2 MET A 153 -5.999 14.298 11.522 1.00 29.40 H new ATOM 0 HB3 MET A 153 -7.222 13.352 11.724 1.00 29.40 H new ATOM 0 HG2 MET A 153 -4.747 12.936 13.031 1.00 31.97 H new ATOM 0 HG3 MET A 153 -5.948 13.658 13.716 1.00 31.97 H new ATOM 0 HE1 MET A 153 -8.023 10.866 14.906 0.00 53.19 H new ATOM 0 HE2 MET A 153 -7.359 12.236 15.342 0.00 53.19 H new ATOM 0 HE3 MET A 153 -8.318 12.187 14.083 0.00 53.19 H new ATOM 292 N ASN A 154 -6.266 13.778 8.546 1.00 27.68 N ATOM 293 CA ASN A 154 -6.994 14.142 7.339 1.00 27.41 C ATOM 294 C ASN A 154 -6.685 13.247 6.143 1.00 26.68 C ATOM 295 O ASN A 154 -7.446 13.229 5.172 1.00 26.87 O ATOM 296 CB ASN A 154 -6.743 15.609 6.993 1.00 27.89 C ATOM 297 CG ASN A 154 -7.398 16.560 7.985 1.00 29.70 C ATOM 298 OD1 ASN A 154 -8.518 16.325 8.451 1.00 31.80 O ATOM 299 ND2 ASN A 154 -6.700 17.646 8.307 1.00 31.69 N ATOM 0 H ASN A 154 -5.592 14.284 8.717 1.00 27.68 H new ATOM 0 HA ASN A 154 -7.934 14.008 7.536 1.00 27.41 H new ATOM 0 HB2 ASN A 154 -5.788 15.775 6.973 1.00 27.89 H new ATOM 0 HB3 ASN A 154 -7.082 15.791 6.102 1.00 27.89 H new ATOM 0 HD21 ASN A 154 -7.026 18.218 8.860 1.00 31.69 H new ATOM 0 HD22 ASN A 154 -5.923 17.776 7.962 1.00 31.69 H new ATOM 300 N TYR A 155 -5.585 12.497 6.226 1.00 25.41 N ATOM 301 CA TYR A 155 -5.170 11.593 5.146 1.00 24.34 C ATOM 302 C TYR A 155 -6.170 10.462 4.917 1.00 23.69 C ATOM 303 O TYR A 155 -6.660 9.851 5.870 1.00 23.42 O ATOM 304 CB TYR A 155 -3.777 11.000 5.421 1.00 24.39 C ATOM 305 CG TYR A 155 -3.328 10.001 4.367 1.00 24.09 C ATOM 306 CD1 TYR A 155 -2.645 10.422 3.226 1.00 24.52 C ATOM 307 CD2 TYR A 155 -3.600 8.636 4.509 1.00 23.79 C ATOM 308 CE1 TYR A 155 -2.241 9.509 2.246 1.00 23.56 C ATOM 309 CE2 TYR A 155 -3.200 7.718 3.540 1.00 24.03 C ATOM 310 CZ TYR A 155 -2.521 8.166 2.417 1.00 24.47 C ATOM 311 OH TYR A 155 -2.126 7.265 1.459 1.00 26.31 O ATOM 0 H TYR A 155 -5.059 12.496 6.906 1.00 25.41 H new ATOM 0 HA TYR A 155 -5.136 12.131 4.340 1.00 24.34 H new ATOM 0 HB2 TYR A 155 -3.130 11.721 5.470 1.00 24.39 H new ATOM 0 HB3 TYR A 155 -3.783 10.565 6.288 1.00 24.39 H new ATOM 0 HD1 TYR A 155 -2.455 11.326 3.115 1.00 24.52 H new ATOM 0 HD2 TYR A 155 -4.055 8.336 5.263 1.00 23.79 H new ATOM 0 HE1 TYR A 155 -1.789 9.802 1.488 1.00 23.56 H new ATOM 0 HE2 TYR A 155 -3.387 6.813 3.645 1.00 24.03 H new ATOM 0 HH TYR A 155 -1.429 7.544 1.082 1.00 26.31 H new ATOM 312 N LYS A 156 -6.457 10.193 3.646 1.00 23.36 N ATOM 313 CA LYS A 156 -7.257 9.032 3.241 1.00 23.16 C ATOM 314 C LYS A 156 -6.548 8.254 2.143 1.00 22.59 C ATOM 315 O LYS A 156 -5.960 8.844 1.239 1.00 21.92 O ATOM 316 CB LYS A 156 -8.631 9.480 2.735 1.00 23.56 C ATOM 317 CG LYS A 156 -9.473 10.222 3.757 1.00 24.72 C ATOM 318 CD LYS A 156 -9.921 9.321 4.906 1.00 28.96 C ATOM 319 CE LYS A 156 -10.758 10.098 5.918 1.00 31.18 C ATOM 320 NZ LYS A 156 -10.783 9.420 7.247 1.00 33.17 N ATOM 0 H LYS A 156 -6.193 10.680 2.988 1.00 23.36 H new ATOM 0 HA LYS A 156 -7.371 8.460 4.016 1.00 23.16 H new ATOM 0 HB2 LYS A 156 -8.506 10.051 1.961 1.00 23.56 H new ATOM 0 HB3 LYS A 156 -9.122 8.699 2.435 1.00 23.56 H new ATOM 0 HG2 LYS A 156 -8.963 10.967 4.113 1.00 24.72 H new ATOM 0 HG3 LYS A 156 -10.254 10.596 3.319 1.00 24.72 H new ATOM 0 HD2 LYS A 156 -10.438 8.579 4.556 1.00 28.96 H new ATOM 0 HD3 LYS A 156 -9.144 8.943 5.347 1.00 28.96 H new ATOM 0 HE2 LYS A 156 -10.398 10.993 6.017 1.00 31.18 H new ATOM 0 HE3 LYS A 156 -11.664 10.192 5.585 1.00 31.18 H new ATOM 0 HZ1 LYS A 156 -10.886 10.028 7.889 1.00 33.17 H new ATOM 0 HZ2 LYS A 156 -11.461 8.844 7.274 1.00 33.17 H new ATOM 0 HZ3 LYS A 156 -10.018 8.984 7.372 1.00 33.17 H new ATOM 321 N HIS A 157 -6.604 6.924 2.212 1.00 22.07 N ATOM 322 CA HIS A 157 -6.005 6.103 1.157 1.00 21.97 C ATOM 323 C HIS A 157 -6.378 6.614 -0.231 1.00 21.53 C ATOM 324 O HIS A 157 -7.549 6.909 -0.501 1.00 21.58 O ATOM 325 CB HIS A 157 -6.413 4.633 1.283 1.00 22.01 C ATOM 326 CG HIS A 157 -5.963 3.799 0.128 1.00 22.81 C ATOM 327 ND1 HIS A 157 -4.648 3.433 -0.051 1.00 23.54 N ATOM 328 CD2 HIS A 157 -6.644 3.288 -0.925 1.00 24.28 C ATOM 329 CE1 HIS A 157 -4.538 2.721 -1.158 1.00 24.20 C ATOM 330 NE2 HIS A 157 -5.736 2.614 -1.704 1.00 24.76 N ATOM 0 H HIS A 157 -6.977 6.483 2.849 1.00 22.07 H new ATOM 0 HA HIS A 157 -5.044 6.171 1.269 1.00 21.97 H new ATOM 0 HB2 HIS A 157 -6.042 4.269 2.102 1.00 22.01 H new ATOM 0 HB3 HIS A 157 -7.378 4.576 1.359 1.00 22.01 H new ATOM 0 HD2 HIS A 157 -7.555 3.377 -1.090 1.00 24.28 H new ATOM 0 HE1 HIS A 157 -3.751 2.357 -1.495 1.00 24.20 H new ATOM 0 HE2 HIS A 157 -5.918 2.191 -2.430 1.00 24.76 H new ATOM 331 N GLY A 158 -5.373 6.716 -1.098 1.00 21.09 N ATOM 332 CA GLY A 158 -5.544 7.258 -2.446 1.00 21.19 C ATOM 333 C GLY A 158 -4.919 8.640 -2.579 1.00 20.66 C ATOM 334 O GLY A 158 -4.495 9.035 -3.662 1.00 20.75 O ATOM 0 H GLY A 158 -4.568 6.471 -0.920 1.00 21.09 H new ATOM 0 HA2 GLY A 158 -5.140 6.656 -3.091 1.00 21.19 H new ATOM 0 HA3 GLY A 158 -6.489 7.308 -2.658 1.00 21.19 H new ATOM 335 N ASP A 159 -4.879 9.373 -1.470 1.00 20.75 N ATOM 336 CA ASP A 159 -4.250 10.693 -1.419 1.00 20.65 C ATOM 337 C ASP A 159 -2.748 10.561 -1.627 1.00 20.29 C ATOM 338 O ASP A 159 -2.134 9.648 -1.085 1.00 20.13 O ATOM 339 CB ASP A 159 -4.433 11.330 -0.033 1.00 20.63 C ATOM 340 CG ASP A 159 -5.863 11.736 0.270 1.00 20.66 C ATOM 341 OD1 ASP A 159 -6.757 11.623 -0.602 1.00 22.15 O ATOM 342 OD2 ASP A 159 -6.083 12.179 1.417 1.00 20.56 O ATOM 0 H ASP A 159 -5.217 9.119 -0.721 1.00 20.75 H new ATOM 0 HA ASP A 159 -4.663 11.235 -2.109 1.00 20.65 H new ATOM 0 HB2 ASP A 159 -4.133 10.703 0.644 1.00 20.63 H new ATOM 0 HB3 ASP A 159 -3.863 12.112 0.032 1.00 20.63 H new ATOM 343 N PRO A 160 -2.139 11.486 -2.385 1.00 20.43 N ATOM 344 CA PRO A 160 -0.686 11.598 -2.208 1.00 20.26 C ATOM 345 C PRO A 160 -0.406 12.064 -0.780 1.00 20.07 C ATOM 346 O PRO A 160 -1.214 12.799 -0.208 1.00 19.90 O ATOM 347 CB PRO A 160 -0.276 12.665 -3.230 1.00 20.50 C ATOM 348 CG PRO A 160 -1.518 13.383 -3.581 1.00 20.94 C ATOM 349 CD PRO A 160 -2.664 12.432 -3.385 1.00 20.65 C ATOM 0 HA PRO A 160 -0.202 10.768 -2.340 1.00 20.26 H new ATOM 0 HB2 PRO A 160 0.382 13.271 -2.856 1.00 20.50 H new ATOM 0 HB3 PRO A 160 0.125 12.260 -4.015 1.00 20.50 H new ATOM 0 HG2 PRO A 160 -1.627 14.168 -3.022 1.00 20.94 H new ATOM 0 HG3 PRO A 160 -1.485 13.692 -4.500 1.00 20.94 H new ATOM 0 HD2 PRO A 160 -3.459 12.888 -3.066 1.00 20.65 H new ATOM 0 HD3 PRO A 160 -2.905 11.985 -4.211 1.00 20.65 H new ATOM 350 N ILE A 161 0.693 11.605 -0.184 1.00 20.08 N ATOM 351 CA ILE A 161 0.998 11.977 1.193 1.00 20.01 C ATOM 352 C ILE A 161 1.489 13.428 1.166 1.00 20.47 C ATOM 353 O ILE A 161 2.450 13.722 0.460 1.00 20.01 O ATOM 354 CB ILE A 161 2.098 11.071 1.838 1.00 19.78 C ATOM 355 CG1 ILE A 161 1.708 9.584 1.793 1.00 20.18 C ATOM 356 CG2 ILE A 161 2.362 11.495 3.273 1.00 20.54 C ATOM 357 CD1 ILE A 161 2.855 8.648 2.138 1.00 20.32 C ATOM 0 H ILE A 161 1.268 11.084 -0.555 1.00 20.08 H new ATOM 0 HA ILE A 161 0.199 11.866 1.732 1.00 20.01 H new ATOM 0 HB ILE A 161 2.909 11.183 1.317 1.00 19.78 H new ATOM 0 HG12 ILE A 161 0.976 9.430 2.411 1.00 20.18 H new ATOM 0 HG13 ILE A 161 1.380 9.369 0.906 1.00 20.18 H new ATOM 0 HG21 ILE A 161 3.045 10.925 3.659 1.00 20.54 H new ATOM 0 HG22 ILE A 161 2.664 12.417 3.288 1.00 20.54 H new ATOM 0 HG23 ILE A 161 1.545 11.415 3.790 1.00 20.54 H new ATOM 0 HD11 ILE A 161 2.548 7.729 2.092 1.00 20.32 H new ATOM 0 HD12 ILE A 161 3.580 8.778 1.507 1.00 20.32 H new ATOM 0 HD13 ILE A 161 3.170 8.839 3.035 1.00 20.32 H new ATOM 358 N PRO A 162 0.830 14.330 1.928 1.00 21.20 N ATOM 359 CA PRO A 162 1.212 15.748 1.957 1.00 21.68 C ATOM 360 C PRO A 162 2.710 15.962 2.170 1.00 22.20 C ATOM 361 O PRO A 162 3.288 15.411 3.108 1.00 22.37 O ATOM 362 CB PRO A 162 0.429 16.283 3.157 1.00 21.61 C ATOM 363 CG PRO A 162 -0.830 15.471 3.144 1.00 21.81 C ATOM 364 CD PRO A 162 -0.335 14.070 2.795 1.00 21.30 C ATOM 0 HA PRO A 162 1.018 16.190 1.116 1.00 21.68 H new ATOM 0 HB2 PRO A 162 0.921 16.166 3.985 1.00 21.61 H new ATOM 0 HB3 PRO A 162 0.243 17.231 3.068 1.00 21.61 H new ATOM 0 HG2 PRO A 162 -1.278 15.489 4.004 1.00 21.81 H new ATOM 0 HG3 PRO A 162 -1.463 15.802 2.488 1.00 21.81 H new ATOM 0 HD2 PRO A 162 -0.087 13.570 3.588 1.00 21.30 H new ATOM 0 HD3 PRO A 162 -1.016 13.554 2.335 1.00 21.30 H new ATOM 365 N LYS A 163 3.327 16.740 1.290 1.00 23.06 N ATOM 366 CA LYS A 163 4.744 17.072 1.430 1.00 24.12 C ATOM 367 C LYS A 163 4.906 18.234 2.394 1.00 24.77 C ATOM 368 O LYS A 163 4.080 19.153 2.420 1.00 25.33 O ATOM 369 CB LYS A 163 5.387 17.348 0.068 1.00 24.02 C ATOM 370 CG LYS A 163 5.509 16.074 -0.773 1.00 25.06 C ATOM 371 CD LYS A 163 6.278 16.271 -2.061 1.00 26.59 C ATOM 372 CE LYS A 163 6.745 14.927 -2.613 1.00 26.77 C ATOM 373 NZ LYS A 163 7.445 15.080 -3.919 1.00 28.25 N ATOM 0 H LYS A 163 2.945 17.088 0.603 1.00 23.06 H new ATOM 0 HA LYS A 163 5.214 16.309 1.802 1.00 24.12 H new ATOM 0 HB2 LYS A 163 4.857 18.003 -0.413 1.00 24.02 H new ATOM 0 HB3 LYS A 163 6.267 17.735 0.198 1.00 24.02 H new ATOM 0 HG2 LYS A 163 5.947 15.388 -0.245 1.00 25.06 H new ATOM 0 HG3 LYS A 163 4.620 15.747 -0.982 1.00 25.06 H new ATOM 0 HD2 LYS A 163 5.717 16.718 -2.714 1.00 26.59 H new ATOM 0 HD3 LYS A 163 7.043 16.846 -1.903 1.00 26.59 H new ATOM 0 HE2 LYS A 163 7.340 14.504 -1.974 1.00 26.77 H new ATOM 0 HE3 LYS A 163 5.981 14.339 -2.722 1.00 26.77 H new ATOM 0 HZ1 LYS A 163 7.754 14.289 -4.185 1.00 28.25 H new ATOM 0 HZ2 LYS A 163 6.875 15.395 -4.526 1.00 28.25 H new ATOM 0 HZ3 LYS A 163 8.124 15.648 -3.827 1.00 28.25 H new ATOM 374 N VAL A 164 5.957 18.173 3.207 1.00 25.03 N ATOM 375 CA VAL A 164 6.132 19.123 4.300 1.00 25.54 C ATOM 376 C VAL A 164 7.381 19.959 4.087 1.00 25.81 C ATOM 377 O VAL A 164 8.454 19.427 3.778 1.00 25.19 O ATOM 378 CB VAL A 164 6.200 18.398 5.674 1.00 25.72 C ATOM 379 CG1 VAL A 164 6.473 19.384 6.811 1.00 26.21 C ATOM 380 CG2 VAL A 164 4.901 17.628 5.947 1.00 26.31 C ATOM 0 H VAL A 164 6.582 17.586 3.142 1.00 25.03 H new ATOM 0 HA VAL A 164 5.359 19.710 4.306 1.00 25.54 H new ATOM 0 HB VAL A 164 6.936 17.768 5.635 1.00 25.72 H new ATOM 0 HG11 VAL A 164 6.510 18.905 7.653 1.00 26.21 H new ATOM 0 HG12 VAL A 164 7.320 19.830 6.656 1.00 26.21 H new ATOM 0 HG13 VAL A 164 5.762 20.043 6.846 1.00 26.21 H new ATOM 0 HG21 VAL A 164 4.963 17.183 6.807 1.00 26.31 H new ATOM 0 HG22 VAL A 164 4.154 18.246 5.956 1.00 26.31 H new ATOM 0 HG23 VAL A 164 4.764 16.967 5.251 1.00 26.31 H new ATOM 381 N GLU A 165 7.223 21.272 4.238 1.00 26.18 N ATOM 382 CA GLU A 165 8.358 22.179 4.304 1.00 26.89 C ATOM 383 C GLU A 165 8.879 22.176 5.742 1.00 26.35 C ATOM 384 O GLU A 165 8.274 22.763 6.646 1.00 26.38 O ATOM 385 CB GLU A 165 7.962 23.581 3.829 1.00 26.82 C ATOM 386 CG GLU A 165 7.433 23.591 2.386 1.00 28.18 C ATOM 387 CD GLU A 165 7.114 24.984 1.849 1.00 28.46 C ATOM 388 OE1 GLU A 165 6.272 25.064 0.922 1.00 27.04 O ATOM 389 OE2 GLU A 165 7.709 25.983 2.345 1.00 30.52 O ATOM 0 H GLU A 165 6.457 21.658 4.305 1.00 26.18 H new ATOM 0 HA GLU A 165 9.067 21.885 3.710 1.00 26.89 H new ATOM 0 HB2 GLU A 165 7.282 23.939 4.421 1.00 26.82 H new ATOM 0 HB3 GLU A 165 8.731 24.169 3.892 1.00 26.82 H new ATOM 0 HG2 GLU A 165 8.091 23.175 1.808 1.00 28.18 H new ATOM 0 HG3 GLU A 165 6.632 23.046 2.342 1.00 28.18 H new ATOM 390 N PHE A 166 9.980 21.461 5.951 1.00 26.33 N ATOM 391 CA PHE A 166 10.572 21.326 7.275 1.00 25.99 C ATOM 392 C PHE A 166 11.341 22.592 7.642 1.00 26.48 C ATOM 393 O PHE A 166 11.914 23.251 6.772 1.00 26.54 O ATOM 394 CB PHE A 166 11.487 20.097 7.336 1.00 25.76 C ATOM 395 CG PHE A 166 10.746 18.781 7.267 1.00 24.90 C ATOM 396 CD1 PHE A 166 10.635 18.091 6.064 1.00 24.82 C ATOM 397 CD2 PHE A 166 10.156 18.234 8.415 1.00 23.92 C ATOM 398 CE1 PHE A 166 9.944 16.869 5.997 1.00 24.03 C ATOM 399 CE2 PHE A 166 9.463 17.018 8.361 1.00 24.13 C ATOM 400 CZ PHE A 166 9.361 16.332 7.146 1.00 23.43 C ATOM 0 H PHE A 166 10.403 21.042 5.330 1.00 26.33 H new ATOM 0 HA PHE A 166 9.859 21.202 7.921 1.00 25.99 H new ATOM 0 HB2 PHE A 166 12.122 20.140 6.604 1.00 25.76 H new ATOM 0 HB3 PHE A 166 12.000 20.127 8.158 1.00 25.76 H new ATOM 0 HD1 PHE A 166 11.023 18.443 5.295 1.00 24.82 H new ATOM 0 HD2 PHE A 166 10.226 18.686 9.225 1.00 23.92 H new ATOM 0 HE1 PHE A 166 9.875 16.418 5.187 1.00 24.03 H new ATOM 0 HE2 PHE A 166 9.073 16.668 9.129 1.00 24.13 H new ATOM 0 HZ PHE A 166 8.907 15.522 7.104 1.00 23.43 H new ATOM 401 N THR A 167 11.340 22.920 8.931 1.00 26.90 N ATOM 402 CA THR A 167 12.013 24.117 9.441 1.00 27.46 C ATOM 403 C THR A 167 13.527 23.941 9.451 1.00 28.13 C ATOM 404 O THR A 167 14.033 22.815 9.348 1.00 27.87 O ATOM 405 CB THR A 167 11.541 24.472 10.866 1.00 27.32 C ATOM 406 OG1 THR A 167 11.960 23.454 11.788 1.00 26.80 O ATOM 407 CG2 THR A 167 10.015 24.634 10.918 1.00 27.34 C ATOM 0 H THR A 167 10.948 22.454 9.538 1.00 26.90 H new ATOM 0 HA THR A 167 11.778 24.842 8.840 1.00 27.46 H new ATOM 0 HB THR A 167 11.943 25.318 11.118 1.00 27.32 H new ATOM 0 HG1 THR A 167 11.702 23.653 12.562 1.00 26.80 H new ATOM 0 HG21 THR A 167 9.744 24.856 11.822 1.00 27.34 H new ATOM 0 HG22 THR A 167 9.744 25.344 10.316 1.00 27.34 H new ATOM 0 HG23 THR A 167 9.592 23.804 10.649 1.00 27.34 H new ATOM 408 N GLU A 168 14.248 25.053 9.596 1.00 28.63 N ATOM 409 CA GLU A 168 15.706 25.021 9.633 1.00 29.53 C ATOM 410 C GLU A 168 16.210 24.186 10.807 1.00 28.97 C ATOM 411 O GLU A 168 17.173 23.436 10.666 1.00 29.06 O ATOM 412 CB GLU A 168 16.294 26.440 9.661 1.00 29.54 C ATOM 413 CG GLU A 168 16.217 27.160 8.313 1.00 31.15 C ATOM 414 CD GLU A 168 17.144 28.366 8.217 1.00 31.74 C ATOM 415 OE1 GLU A 168 17.927 28.435 7.236 1.00 35.22 O ATOM 416 OE2 GLU A 168 17.094 29.239 9.115 1.00 34.64 O ATOM 0 H GLU A 168 13.908 25.839 9.675 1.00 28.63 H new ATOM 0 HA GLU A 168 16.013 24.595 8.818 1.00 29.53 H new ATOM 0 HB2 GLU A 168 15.823 26.965 10.327 1.00 29.54 H new ATOM 0 HB3 GLU A 168 17.221 26.393 9.942 1.00 29.54 H new ATOM 0 HG2 GLU A 168 16.438 26.534 7.606 1.00 31.15 H new ATOM 0 HG3 GLU A 168 15.304 27.449 8.160 1.00 31.15 H new ATOM 417 N GLU A 169 15.539 24.307 11.951 1.00 29.11 N ATOM 418 CA GLU A 169 15.866 23.530 13.146 1.00 29.15 C ATOM 419 C GLU A 169 15.627 22.035 12.922 1.00 28.14 C ATOM 420 O GLU A 169 16.441 21.203 13.329 1.00 27.51 O ATOM 421 CB GLU A 169 15.053 24.029 14.344 1.00 29.38 C ATOM 422 CG GLU A 169 15.402 23.369 15.668 1.00 31.10 C ATOM 423 CD GLU A 169 14.586 23.903 16.829 1.00 31.50 C ATOM 424 OE1 GLU A 169 14.268 23.108 17.738 1.00 35.84 O ATOM 425 OE2 GLU A 169 14.260 25.111 16.842 1.00 35.69 O ATOM 0 H GLU A 169 14.877 24.846 12.056 1.00 29.11 H new ATOM 0 HA GLU A 169 16.810 23.654 13.334 1.00 29.15 H new ATOM 0 HB2 GLU A 169 15.182 24.987 14.430 1.00 29.38 H new ATOM 0 HB3 GLU A 169 14.111 23.884 14.163 1.00 29.38 H new ATOM 0 HG2 GLU A 169 15.262 22.412 15.594 1.00 31.10 H new ATOM 0 HG3 GLU A 169 16.345 23.504 15.852 1.00 31.10 H new ATOM 426 N GLU A 170 14.503 21.707 12.285 1.00 27.10 N ATOM 427 CA GLU A 170 14.168 20.317 11.976 1.00 26.52 C ATOM 428 C GLU A 170 15.224 19.698 11.069 1.00 26.01 C ATOM 429 O GLU A 170 15.726 18.614 11.357 1.00 25.90 O ATOM 430 CB GLU A 170 12.767 20.204 11.367 1.00 26.10 C ATOM 431 CG GLU A 170 11.651 20.367 12.396 1.00 26.78 C ATOM 432 CD GLU A 170 10.279 20.610 11.781 1.00 26.40 C ATOM 433 OE1 GLU A 170 10.185 20.809 10.556 1.00 27.04 O ATOM 434 OE2 GLU A 170 9.283 20.594 12.534 1.00 26.19 O ATOM 0 H GLU A 170 13.917 22.279 12.022 1.00 27.10 H new ATOM 0 HA GLU A 170 14.160 19.817 12.807 1.00 26.52 H new ATOM 0 HB2 GLU A 170 12.665 20.879 10.678 1.00 26.10 H new ATOM 0 HB3 GLU A 170 12.677 19.340 10.935 1.00 26.10 H new ATOM 0 HG2 GLU A 170 11.612 19.570 12.948 1.00 26.78 H new ATOM 0 HG3 GLU A 170 11.869 21.108 12.983 1.00 26.78 H new ATOM 435 N ILE A 171 15.595 20.412 10.006 1.00 25.90 N ATOM 436 CA ILE A 171 16.620 19.934 9.070 1.00 25.64 C ATOM 437 C ILE A 171 17.989 19.759 9.757 1.00 25.95 C ATOM 438 O ILE A 171 18.700 18.781 9.504 1.00 25.05 O ATOM 439 CB ILE A 171 16.709 20.835 7.811 1.00 25.57 C ATOM 440 CG1 ILE A 171 15.380 20.778 7.039 1.00 25.67 C ATOM 441 CG2 ILE A 171 17.886 20.411 6.919 1.00 25.40 C ATOM 442 CD1 ILE A 171 15.129 21.944 6.089 1.00 26.17 C ATOM 0 H ILE A 171 15.264 21.180 9.806 1.00 25.90 H new ATOM 0 HA ILE A 171 16.346 19.054 8.769 1.00 25.64 H new ATOM 0 HB ILE A 171 16.868 21.751 8.088 1.00 25.57 H new ATOM 0 HG12 ILE A 171 15.354 19.953 6.529 1.00 25.67 H new ATOM 0 HG13 ILE A 171 14.652 20.739 7.679 1.00 25.67 H new ATOM 0 HG21 ILE A 171 17.924 20.986 6.139 1.00 25.40 H new ATOM 0 HG22 ILE A 171 18.714 20.488 7.418 1.00 25.40 H new ATOM 0 HG23 ILE A 171 17.763 19.491 6.637 1.00 25.40 H new ATOM 0 HD11 ILE A 171 14.273 21.824 5.649 1.00 26.17 H new ATOM 0 HD12 ILE A 171 15.121 22.774 6.591 1.00 26.17 H new ATOM 0 HD13 ILE A 171 15.833 21.976 5.423 1.00 26.17 H new ATOM 443 N LYS A 172 18.337 20.701 10.634 1.00 26.17 N ATOM 444 CA LYS A 172 19.567 20.613 11.421 1.00 26.56 C ATOM 445 C LYS A 172 19.588 19.351 12.287 1.00 25.66 C ATOM 446 O LYS A 172 20.604 18.669 12.363 1.00 25.57 O ATOM 447 CB LYS A 172 19.748 21.868 12.286 1.00 26.54 C ATOM 448 CG LYS A 172 21.176 22.079 12.776 1.00 28.00 C ATOM 449 CD LYS A 172 21.401 23.487 13.350 1.00 28.97 C ATOM 450 CE LYS A 172 21.410 24.566 12.265 1.00 32.64 C ATOM 451 NZ LYS A 172 22.012 25.850 12.748 1.00 33.94 N ATOM 0 H LYS A 172 17.869 21.406 10.789 1.00 26.17 H new ATOM 0 HA LYS A 172 20.311 20.557 10.801 1.00 26.56 H new ATOM 0 HB2 LYS A 172 19.473 22.645 11.775 1.00 26.54 H new ATOM 0 HB3 LYS A 172 19.157 21.809 13.053 1.00 26.54 H new ATOM 0 HG2 LYS A 172 21.382 21.419 13.457 1.00 28.00 H new ATOM 0 HG3 LYS A 172 21.792 21.930 12.041 1.00 28.00 H new ATOM 0 HD2 LYS A 172 20.704 23.686 13.994 1.00 28.97 H new ATOM 0 HD3 LYS A 172 22.244 23.507 13.829 1.00 28.97 H new ATOM 0 HE2 LYS A 172 21.909 24.246 11.497 1.00 32.64 H new ATOM 0 HE3 LYS A 172 20.502 24.729 11.966 1.00 32.64 H new ATOM 0 HZ1 LYS A 172 21.999 26.450 12.091 1.00 33.94 H new ATOM 0 HZ2 LYS A 172 21.542 26.157 13.439 1.00 33.94 H new ATOM 0 HZ3 LYS A 172 22.853 25.707 13.002 1.00 33.94 H new ATOM 452 N THR A 173 18.461 19.034 12.922 1.00 25.37 N ATOM 453 CA THR A 173 18.363 17.834 13.758 1.00 24.92 C ATOM 454 C THR A 173 18.561 16.574 12.912 1.00 24.45 C ATOM 455 O THR A 173 19.360 15.695 13.262 1.00 23.95 O ATOM 456 CB THR A 173 17.027 17.786 14.535 1.00 25.30 C ATOM 457 OG1 THR A 173 16.982 18.875 15.468 1.00 25.77 O ATOM 458 CG2 THR A 173 16.878 16.476 15.302 1.00 25.49 C ATOM 0 H THR A 173 17.740 19.500 12.883 1.00 25.37 H new ATOM 0 HA THR A 173 19.073 17.872 14.418 1.00 24.92 H new ATOM 0 HB THR A 173 16.302 17.854 13.894 1.00 25.30 H new ATOM 0 HG1 THR A 173 16.830 19.591 15.056 1.00 25.77 H new ATOM 0 HG21 THR A 173 16.033 16.474 15.779 1.00 25.49 H new ATOM 0 HG22 THR A 173 16.899 15.732 14.680 1.00 25.49 H new ATOM 0 HG23 THR A 173 17.607 16.387 15.936 1.00 25.49 H new ATOM 459 N TRP A 174 17.851 16.513 11.788 1.00 24.17 N ATOM 460 CA TRP A 174 18.023 15.444 10.800 1.00 23.89 C ATOM 461 C TRP A 174 19.486 15.284 10.405 1.00 23.97 C ATOM 462 O TRP A 174 20.017 14.170 10.415 1.00 23.70 O ATOM 463 CB TRP A 174 17.168 15.724 9.561 1.00 23.25 C ATOM 464 CG TRP A 174 17.582 14.929 8.356 1.00 23.06 C ATOM 465 CD1 TRP A 174 18.437 15.323 7.364 1.00 22.24 C ATOM 466 CD2 TRP A 174 17.167 13.596 8.022 1.00 22.32 C ATOM 467 NE1 TRP A 174 18.580 14.318 6.437 1.00 22.47 N ATOM 468 CE2 TRP A 174 17.807 13.252 6.812 1.00 22.28 C ATOM 469 CE3 TRP A 174 16.312 12.664 8.627 1.00 22.20 C ATOM 470 CZ2 TRP A 174 17.620 12.008 6.188 1.00 22.24 C ATOM 471 CZ3 TRP A 174 16.130 11.426 8.010 1.00 22.37 C ATOM 472 CH2 TRP A 174 16.784 11.113 6.803 1.00 22.22 C ATOM 0 H TRP A 174 17.253 17.092 11.574 1.00 24.17 H new ATOM 0 HA TRP A 174 17.730 14.613 11.206 1.00 23.89 H new ATOM 0 HB2 TRP A 174 16.240 15.528 9.766 1.00 23.25 H new ATOM 0 HB3 TRP A 174 17.218 16.669 9.349 1.00 23.25 H new ATOM 0 HD1 TRP A 174 18.860 16.150 7.323 1.00 22.24 H new ATOM 0 HE1 TRP A 174 19.075 14.353 5.735 1.00 22.47 H new ATOM 0 HE3 TRP A 174 15.875 12.867 9.423 1.00 22.20 H new ATOM 0 HZ2 TRP A 174 18.047 11.800 5.388 1.00 22.24 H new ATOM 0 HZ3 TRP A 174 15.568 10.798 8.402 1.00 22.37 H new ATOM 0 HH2 TRP A 174 16.645 10.280 6.414 1.00 22.22 H new ATOM 473 N GLY A 175 20.124 16.404 10.067 1.00 24.28 N ATOM 474 CA GLY A 175 21.523 16.428 9.633 1.00 24.70 C ATOM 475 C GLY A 175 22.477 15.795 10.622 1.00 24.78 C ATOM 476 O GLY A 175 23.337 15.004 10.237 1.00 25.46 O ATOM 0 H GLY A 175 19.754 17.180 10.083 1.00 24.28 H new ATOM 0 HA2 GLY A 175 21.598 15.967 8.783 1.00 24.70 H new ATOM 0 HA3 GLY A 175 21.791 17.348 9.481 1.00 24.70 H new ATOM 477 N THR A 176 22.317 16.133 11.900 1.00 24.94 N ATOM 478 CA THR A 176 23.123 15.543 12.967 1.00 24.91 C ATOM 479 C THR A 176 22.916 14.031 13.024 1.00 24.69 C ATOM 480 O THR A 176 23.881 13.262 13.024 1.00 24.18 O ATOM 481 CB THR A 176 22.819 16.193 14.333 1.00 25.12 C ATOM 482 OG1 THR A 176 23.233 17.564 14.302 1.00 25.98 O ATOM 483 CG2 THR A 176 23.560 15.476 15.454 1.00 25.42 C ATOM 0 H THR A 176 21.740 16.709 12.172 1.00 24.94 H new ATOM 0 HA THR A 176 24.055 15.717 12.764 1.00 24.91 H new ATOM 0 HB THR A 176 21.866 16.129 14.501 1.00 25.12 H new ATOM 0 HG1 THR A 176 22.686 18.012 13.849 1.00 25.98 H new ATOM 0 HG21 THR A 176 23.354 15.901 16.301 1.00 25.42 H new ATOM 0 HG22 THR A 176 23.283 14.547 15.483 1.00 25.42 H new ATOM 0 HG23 THR A 176 24.515 15.523 15.293 1.00 25.42 H new ATOM 484 N VAL A 177 21.649 13.619 13.049 1.00 24.65 N ATOM 485 CA VAL A 177 21.275 12.208 13.065 1.00 24.42 C ATOM 486 C VAL A 177 21.860 11.498 11.834 1.00 24.62 C ATOM 487 O VAL A 177 22.551 10.483 11.966 1.00 24.25 O ATOM 488 CB VAL A 177 19.718 12.057 13.138 1.00 24.88 C ATOM 489 CG1 VAL A 177 19.291 10.603 13.005 1.00 24.12 C ATOM 490 CG2 VAL A 177 19.179 12.656 14.446 1.00 24.26 C ATOM 0 H VAL A 177 20.978 14.156 13.057 1.00 24.65 H new ATOM 0 HA VAL A 177 21.645 11.786 13.856 1.00 24.42 H new ATOM 0 HB VAL A 177 19.340 12.546 12.391 1.00 24.88 H new ATOM 0 HG11 VAL A 177 18.324 10.544 13.054 1.00 24.12 H new ATOM 0 HG12 VAL A 177 19.593 10.254 12.152 1.00 24.12 H new ATOM 0 HG13 VAL A 177 19.683 10.083 13.724 1.00 24.12 H new ATOM 0 HG21 VAL A 177 18.215 12.555 14.475 1.00 24.26 H new ATOM 0 HG22 VAL A 177 19.576 12.194 15.201 1.00 24.26 H new ATOM 0 HG23 VAL A 177 19.406 13.598 14.488 1.00 24.26 H new ATOM 491 N PHE A 178 21.608 12.059 10.651 1.00 24.45 N ATOM 492 CA PHE A 178 22.093 11.489 9.383 1.00 25.01 C ATOM 493 C PHE A 178 23.620 11.374 9.346 1.00 25.36 C ATOM 494 O PHE A 178 24.163 10.311 9.030 1.00 25.04 O ATOM 495 CB PHE A 178 21.584 12.317 8.196 1.00 24.61 C ATOM 496 CG PHE A 178 21.876 11.709 6.842 1.00 24.71 C ATOM 497 CD1 PHE A 178 21.010 10.770 6.281 1.00 24.58 C ATOM 498 CD2 PHE A 178 23.000 12.091 6.119 1.00 24.37 C ATOM 499 CE1 PHE A 178 21.269 10.210 5.030 1.00 25.11 C ATOM 500 CE2 PHE A 178 23.268 11.536 4.866 1.00 25.01 C ATOM 501 CZ PHE A 178 22.398 10.600 4.318 1.00 25.15 C ATOM 0 H PHE A 178 21.151 12.781 10.557 1.00 24.45 H new ATOM 0 HA PHE A 178 21.738 10.589 9.316 1.00 25.01 H new ATOM 0 HB2 PHE A 178 20.625 12.436 8.286 1.00 24.61 H new ATOM 0 HB3 PHE A 178 21.984 13.200 8.236 1.00 24.61 H new ATOM 0 HD1 PHE A 178 20.248 10.513 6.748 1.00 24.58 H new ATOM 0 HD2 PHE A 178 23.581 12.724 6.474 1.00 24.37 H new ATOM 0 HE1 PHE A 178 20.688 9.577 4.673 1.00 25.11 H new ATOM 0 HE2 PHE A 178 24.029 11.793 4.397 1.00 25.01 H new ATOM 0 HZ PHE A 178 22.570 10.237 3.479 1.00 25.15 H new ATOM 502 N ARG A 179 24.306 12.463 9.682 1.00 26.04 N ATOM 503 CA ARG A 179 25.769 12.493 9.635 1.00 27.16 C ATOM 504 C ARG A 179 26.406 11.457 10.578 1.00 26.85 C ATOM 505 O ARG A 179 27.262 10.680 10.156 1.00 27.41 O ATOM 506 CB ARG A 179 26.284 13.929 9.863 1.00 27.58 C ATOM 507 CG ARG A 179 27.764 14.073 10.201 1.00 30.71 C ATOM 508 CD ARG A 179 27.962 14.526 11.651 1.00 35.52 C ATOM 509 NE ARG A 179 27.524 15.910 11.862 1.00 38.28 N ATOM 510 CZ ARG A 179 27.254 16.454 13.048 1.00 39.48 C ATOM 511 NH1 ARG A 179 26.864 17.722 13.117 1.00 40.64 N ATOM 512 NH2 ARG A 179 27.359 15.741 14.164 1.00 39.50 N ATOM 0 H ARG A 179 23.943 13.198 9.941 1.00 26.04 H new ATOM 0 HA ARG A 179 26.051 12.227 8.746 1.00 27.16 H new ATOM 0 HB2 ARG A 179 26.103 14.447 9.063 1.00 27.58 H new ATOM 0 HB3 ARG A 179 25.768 14.327 10.582 1.00 27.58 H new ATOM 0 HG2 ARG A 179 28.214 13.225 10.060 1.00 30.71 H new ATOM 0 HG3 ARG A 179 28.174 14.715 9.600 1.00 30.71 H new ATOM 0 HD2 ARG A 179 27.467 13.938 12.243 1.00 35.52 H new ATOM 0 HD3 ARG A 179 28.899 14.445 11.889 1.00 35.52 H new ATOM 0 HE ARG A 179 27.435 16.409 11.167 1.00 38.28 H new ATOM 0 HH11 ARG A 179 26.787 18.188 12.398 1.00 40.64 H new ATOM 0 HH12 ARG A 179 26.689 18.077 13.880 1.00 40.64 H new ATOM 0 HH21 ARG A 179 27.604 14.917 14.127 1.00 39.50 H new ATOM 0 HH22 ARG A 179 27.182 16.103 14.924 1.00 39.50 H new ATOM 513 N GLU A 180 25.962 11.415 11.830 1.00 26.88 N ATOM 514 CA GLU A 180 26.543 10.503 12.818 1.00 26.81 C ATOM 515 C GLU A 180 26.210 9.027 12.579 1.00 26.12 C ATOM 516 O GLU A 180 27.068 8.154 12.741 1.00 25.60 O ATOM 517 CB GLU A 180 26.147 10.917 14.239 1.00 27.65 C ATOM 518 CG GLU A 180 26.712 12.264 14.688 1.00 29.53 C ATOM 519 CD GLU A 180 28.239 12.304 14.741 1.00 33.44 C ATOM 520 OE1 GLU A 180 28.890 11.242 14.883 1.00 34.76 O ATOM 521 OE2 GLU A 180 28.793 13.418 14.648 1.00 36.11 O ATOM 0 H GLU A 180 25.324 11.907 12.131 1.00 26.88 H new ATOM 0 HA GLU A 180 27.504 10.581 12.711 1.00 26.81 H new ATOM 0 HB2 GLU A 180 25.179 10.950 14.296 1.00 27.65 H new ATOM 0 HB3 GLU A 180 26.445 10.232 14.858 1.00 27.65 H new ATOM 0 HG2 GLU A 180 26.399 12.955 14.083 1.00 29.53 H new ATOM 0 HG3 GLU A 180 26.360 12.476 15.567 1.00 29.53 H new ATOM 522 N LEU A 181 24.969 8.744 12.191 1.00 25.27 N ATOM 523 CA LEU A 181 24.576 7.368 11.886 1.00 24.87 C ATOM 524 C LEU A 181 25.309 6.790 10.674 1.00 24.64 C ATOM 525 O LEU A 181 25.698 5.614 10.681 1.00 24.58 O ATOM 526 CB LEU A 181 23.057 7.251 11.707 1.00 24.61 C ATOM 527 CG LEU A 181 22.197 7.349 12.975 1.00 24.26 C ATOM 528 CD1 LEU A 181 20.728 7.527 12.596 1.00 22.32 C ATOM 529 CD2 LEU A 181 22.377 6.133 13.879 1.00 23.72 C ATOM 0 H LEU A 181 24.344 9.327 12.098 1.00 25.27 H new ATOM 0 HA LEU A 181 24.841 6.836 12.652 1.00 24.87 H new ATOM 0 HB2 LEU A 181 22.771 7.946 11.094 1.00 24.61 H new ATOM 0 HB3 LEU A 181 22.868 6.401 11.279 1.00 24.61 H new ATOM 0 HG LEU A 181 22.493 8.125 13.477 1.00 24.26 H new ATOM 0 HD11 LEU A 181 20.191 7.588 13.401 1.00 22.32 H new ATOM 0 HD12 LEU A 181 20.624 8.339 12.076 1.00 22.32 H new ATOM 0 HD13 LEU A 181 20.435 6.767 12.070 1.00 22.32 H new ATOM 0 HD21 LEU A 181 21.820 6.230 14.667 1.00 23.72 H new ATOM 0 HD22 LEU A 181 22.119 5.331 13.398 1.00 23.72 H new ATOM 0 HD23 LEU A 181 23.307 6.064 14.147 1.00 23.72 H new ATOM 530 N ASN A 182 25.514 7.608 9.645 1.00 24.37 N ATOM 531 CA ASN A 182 26.225 7.147 8.451 1.00 24.88 C ATOM 532 C ASN A 182 27.696 6.782 8.701 1.00 24.84 C ATOM 533 O ASN A 182 28.277 5.999 7.952 1.00 24.78 O ATOM 534 CB ASN A 182 26.068 8.132 7.288 1.00 24.99 C ATOM 535 CG ASN A 182 24.811 7.863 6.474 1.00 25.69 C ATOM 536 OD1 ASN A 182 24.734 6.877 5.739 1.00 26.75 O ATOM 537 ND2 ASN A 182 23.816 8.729 6.617 1.00 25.48 N ATOM 0 H ASN A 182 25.253 8.427 9.616 1.00 24.37 H new ATOM 0 HA ASN A 182 25.798 6.314 8.197 1.00 24.88 H new ATOM 0 HB2 ASN A 182 26.039 9.038 7.635 1.00 24.99 H new ATOM 0 HB3 ASN A 182 26.845 8.074 6.710 1.00 24.99 H new ATOM 0 HD21 ASN A 182 23.080 8.613 6.187 1.00 25.48 H new ATOM 0 HD22 ASN A 182 23.907 9.406 7.140 1.00 25.48 H new ATOM 538 N LYS A 183 28.274 7.334 9.765 1.00 24.91 N ATOM 539 CA LYS A 183 29.607 6.934 10.224 1.00 25.61 C ATOM 540 C LYS A 183 29.585 5.519 10.796 1.00 25.33 C ATOM 541 O LYS A 183 30.584 4.803 10.721 1.00 25.92 O ATOM 542 CB LYS A 183 30.129 7.895 11.296 1.00 25.81 C ATOM 543 CG LYS A 183 30.619 9.227 10.766 1.00 27.82 C ATOM 544 CD LYS A 183 30.971 10.175 11.903 1.00 30.23 C ATOM 545 CE LYS A 183 31.344 11.544 11.358 1.00 32.84 C ATOM 546 NZ LYS A 183 31.651 12.522 12.446 1.00 34.58 N ATOM 0 H LYS A 183 27.908 7.949 10.241 1.00 24.91 H new ATOM 0 HA LYS A 183 30.197 6.961 9.454 1.00 25.61 H new ATOM 0 HB2 LYS A 183 29.422 8.057 11.940 1.00 25.81 H new ATOM 0 HB3 LYS A 183 30.855 7.464 11.774 1.00 25.81 H new ATOM 0 HG2 LYS A 183 31.398 9.088 10.204 1.00 27.82 H new ATOM 0 HG3 LYS A 183 29.934 9.628 10.208 1.00 27.82 H new ATOM 0 HD2 LYS A 183 30.218 10.256 12.509 1.00 30.23 H new ATOM 0 HD3 LYS A 183 31.710 9.813 12.416 1.00 30.23 H new ATOM 0 HE2 LYS A 183 32.115 11.459 10.775 1.00 32.84 H new ATOM 0 HE3 LYS A 183 30.615 11.884 10.816 1.00 32.84 H new ATOM 0 HZ1 LYS A 183 31.864 13.308 12.087 1.00 34.58 H new ATOM 0 HZ2 LYS A 183 30.937 12.618 12.969 1.00 34.58 H new ATOM 0 HZ3 LYS A 183 32.335 12.222 12.930 1.00 34.58 H new ATOM 547 N LEU A 184 28.441 5.124 11.356 1.00 24.66 N ATOM 548 CA LEU A 184 28.308 3.852 12.071 1.00 24.26 C ATOM 549 C LEU A 184 27.855 2.708 11.173 1.00 23.55 C ATOM 550 O LEU A 184 28.344 1.582 11.303 1.00 23.04 O ATOM 551 CB LEU A 184 27.348 3.997 13.265 1.00 24.21 C ATOM 552 CG LEU A 184 27.668 5.046 14.345 1.00 25.21 C ATOM 553 CD1 LEU A 184 26.534 5.158 15.371 1.00 25.98 C ATOM 554 CD2 LEU A 184 28.988 4.759 15.043 1.00 26.43 C ATOM 0 H LEU A 184 27.717 5.588 11.332 1.00 24.66 H new ATOM 0 HA LEU A 184 29.195 3.626 12.393 1.00 24.26 H new ATOM 0 HB2 LEU A 184 26.467 4.197 12.912 1.00 24.21 H new ATOM 0 HB3 LEU A 184 27.289 3.133 13.702 1.00 24.21 H new ATOM 0 HG LEU A 184 27.753 5.898 13.889 1.00 25.21 H new ATOM 0 HD11 LEU A 184 26.764 5.825 16.037 1.00 25.98 H new ATOM 0 HD12 LEU A 184 25.715 5.420 14.921 1.00 25.98 H new ATOM 0 HD13 LEU A 184 26.404 4.300 15.805 1.00 25.98 H new ATOM 0 HD21 LEU A 184 29.154 5.439 15.714 1.00 26.43 H new ATOM 0 HD22 LEU A 184 28.946 3.889 15.469 1.00 26.43 H new ATOM 0 HD23 LEU A 184 29.707 4.766 14.392 1.00 26.43 H new ATOM 555 N TYR A 185 26.931 2.999 10.257 1.00 23.19 N ATOM 556 CA TYR A 185 26.347 1.975 9.378 1.00 23.02 C ATOM 557 C TYR A 185 27.333 0.978 8.728 1.00 23.52 C ATOM 558 O TYR A 185 27.087 -0.231 8.779 1.00 23.43 O ATOM 559 CB TYR A 185 25.471 2.611 8.295 1.00 22.59 C ATOM 560 CG TYR A 185 24.216 3.287 8.796 1.00 21.84 C ATOM 561 CD1 TYR A 185 23.538 2.815 9.924 1.00 21.82 C ATOM 562 CD2 TYR A 185 23.679 4.377 8.113 1.00 22.10 C ATOM 563 CE1 TYR A 185 22.362 3.434 10.375 1.00 21.58 C ATOM 564 CE2 TYR A 185 22.507 4.997 8.551 1.00 21.74 C ATOM 565 CZ TYR A 185 21.860 4.521 9.684 1.00 20.91 C ATOM 566 OH TYR A 185 20.702 5.137 10.112 1.00 20.78 O ATOM 0 H TYR A 185 26.624 3.791 10.125 1.00 23.19 H new ATOM 0 HA TYR A 185 25.815 1.439 9.987 1.00 23.02 H new ATOM 0 HB2 TYR A 185 26.002 3.264 7.812 1.00 22.59 H new ATOM 0 HB3 TYR A 185 25.219 1.924 7.659 1.00 22.59 H new ATOM 0 HD1 TYR A 185 23.872 2.078 10.383 1.00 21.82 H new ATOM 0 HD2 TYR A 185 24.109 4.697 7.353 1.00 22.10 H new ATOM 0 HE1 TYR A 185 21.925 3.116 11.132 1.00 21.58 H new ATOM 0 HE2 TYR A 185 22.161 5.725 8.086 1.00 21.74 H new ATOM 0 HH TYR A 185 20.472 4.817 10.854 1.00 20.78 H new ATOM 567 N PRO A 186 28.439 1.472 8.114 1.00 23.88 N ATOM 568 CA PRO A 186 29.353 0.547 7.434 1.00 24.19 C ATOM 569 C PRO A 186 29.859 -0.595 8.315 1.00 24.40 C ATOM 570 O PRO A 186 30.059 -1.701 7.812 1.00 25.05 O ATOM 571 CB PRO A 186 30.520 1.447 7.027 1.00 24.22 C ATOM 572 CG PRO A 186 29.918 2.791 6.894 1.00 24.48 C ATOM 573 CD PRO A 186 28.921 2.864 8.007 1.00 23.89 C ATOM 0 HA PRO A 186 28.905 0.099 6.699 1.00 24.19 H new ATOM 0 HB2 PRO A 186 31.223 1.439 7.695 1.00 24.22 H new ATOM 0 HB3 PRO A 186 30.919 1.154 6.193 1.00 24.22 H new ATOM 0 HG2 PRO A 186 30.588 3.488 6.973 1.00 24.48 H new ATOM 0 HG3 PRO A 186 29.492 2.904 6.030 1.00 24.48 H new ATOM 0 HD2 PRO A 186 29.327 3.168 8.834 1.00 23.89 H new ATOM 0 HD3 PRO A 186 28.199 3.479 7.803 1.00 23.89 H new ATOM 574 N THR A 187 30.058 -0.325 9.605 1.00 24.43 N ATOM 575 CA THR A 187 30.548 -1.332 10.558 1.00 24.33 C ATOM 576 C THR A 187 29.453 -1.984 11.406 1.00 24.21 C ATOM 577 O THR A 187 29.698 -3.006 12.058 1.00 24.05 O ATOM 578 CB THR A 187 31.607 -0.744 11.532 1.00 24.44 C ATOM 579 OG1 THR A 187 31.031 0.324 12.294 1.00 24.49 O ATOM 580 CG2 THR A 187 32.822 -0.240 10.781 1.00 23.96 C ATOM 0 H THR A 187 29.914 0.447 9.956 1.00 24.43 H new ATOM 0 HA THR A 187 30.940 -2.013 9.989 1.00 24.33 H new ATOM 0 HB THR A 187 31.892 -1.453 12.130 1.00 24.44 H new ATOM 0 HG1 THR A 187 30.421 0.021 12.786 1.00 24.49 H new ATOM 0 HG21 THR A 187 33.465 0.121 11.411 1.00 23.96 H new ATOM 0 HG22 THR A 187 33.226 -0.973 10.290 1.00 23.96 H new ATOM 0 HG23 THR A 187 32.553 0.455 10.160 1.00 23.96 H new ATOM 581 N HIS A 188 28.255 -1.398 11.396 1.00 23.76 N ATOM 582 CA HIS A 188 27.183 -1.800 12.313 1.00 23.87 C ATOM 583 C HIS A 188 25.962 -2.417 11.632 1.00 23.68 C ATOM 584 O HIS A 188 25.369 -3.354 12.163 1.00 23.57 O ATOM 585 CB HIS A 188 26.707 -0.604 13.146 1.00 23.88 C ATOM 586 CG HIS A 188 27.634 -0.227 14.258 1.00 25.04 C ATOM 587 ND1 HIS A 188 28.865 0.354 14.037 1.00 25.51 N ATOM 588 CD2 HIS A 188 27.502 -0.330 15.600 1.00 25.57 C ATOM 589 CE1 HIS A 188 29.455 0.581 15.196 1.00 26.13 C ATOM 590 NE2 HIS A 188 28.648 0.176 16.161 1.00 26.71 N ATOM 0 H HIS A 188 28.040 -0.760 10.861 1.00 23.76 H new ATOM 0 HA HIS A 188 27.583 -2.486 12.870 1.00 23.87 H new ATOM 0 HB2 HIS A 188 26.592 0.161 12.560 1.00 23.88 H new ATOM 0 HB3 HIS A 188 25.836 -0.809 13.520 1.00 23.88 H new ATOM 0 HD2 HIS A 188 26.771 -0.679 16.057 1.00 25.57 H new ATOM 0 HE1 HIS A 188 30.296 0.961 15.313 1.00 26.13 H new ATOM 0 HE2 HIS A 188 28.814 0.222 17.004 1.00 26.71 H new ATOM 591 N ALA A 189 25.573 -1.872 10.483 1.00 23.43 N ATOM 592 CA ALA A 189 24.336 -2.304 9.816 1.00 23.34 C ATOM 593 C ALA A 189 24.520 -3.597 9.016 1.00 23.42 C ATOM 594 O ALA A 189 25.613 -3.875 8.498 1.00 22.83 O ATOM 595 CB ALA A 189 23.799 -1.204 8.936 1.00 23.58 C ATOM 0 H ALA A 189 26.005 -1.253 10.071 1.00 23.43 H new ATOM 0 HA ALA A 189 23.689 -2.496 10.513 1.00 23.34 H new ATOM 0 HB1 ALA A 189 22.984 -1.504 8.504 1.00 23.58 H new ATOM 0 HB2 ALA A 189 23.609 -0.421 9.476 1.00 23.58 H new ATOM 0 HB3 ALA A 189 24.458 -0.978 8.261 1.00 23.58 H new ATOM 596 N CYS A 190 23.447 -4.384 8.918 1.00 23.12 N ATOM 597 CA CYS A 190 23.458 -5.600 8.107 1.00 23.11 C ATOM 598 C CYS A 190 23.662 -5.267 6.634 1.00 22.97 C ATOM 599 O CYS A 190 23.440 -4.128 6.212 1.00 22.24 O ATOM 600 CB CYS A 190 22.170 -6.401 8.306 1.00 23.31 C ATOM 601 SG CYS A 190 20.694 -5.571 7.718 1.00 24.99 S ATOM 0 H CYS A 190 22.700 -4.229 9.316 1.00 23.12 H new ATOM 0 HA CYS A 190 24.203 -6.148 8.400 1.00 23.11 H new ATOM 0 HB2 CYS A 190 22.255 -7.252 7.848 1.00 23.31 H new ATOM 0 HB3 CYS A 190 22.065 -6.597 9.250 1.00 23.31 H new ATOM 0 HG CYS A 190 20.301 -6.111 6.721 1.00 24.99 H new ATOM 602 N ARG A 191 24.096 -6.259 5.856 1.00 22.94 N ATOM 603 CA ARG A 191 24.425 -6.031 4.448 1.00 23.29 C ATOM 604 C ARG A 191 23.240 -5.536 3.623 1.00 22.86 C ATOM 605 O ARG A 191 23.417 -4.704 2.746 1.00 22.65 O ATOM 606 CB ARG A 191 25.060 -7.265 3.801 1.00 23.64 C ATOM 607 CG ARG A 191 24.184 -8.498 3.738 1.00 26.14 C ATOM 608 CD ARG A 191 24.834 -9.555 2.845 1.00 31.02 C ATOM 609 NE ARG A 191 25.008 -10.813 3.565 1.00 33.67 N ATOM 610 CZ ARG A 191 26.088 -11.117 4.281 1.00 35.21 C ATOM 611 NH1 ARG A 191 27.101 -10.260 4.374 1.00 35.77 N ATOM 612 NH2 ARG A 191 26.162 -12.283 4.900 1.00 35.42 N ATOM 0 H ARG A 191 24.207 -7.069 6.123 1.00 22.94 H new ATOM 0 HA ARG A 191 25.082 -5.317 4.449 1.00 23.29 H new ATOM 0 HB2 ARG A 191 25.330 -7.034 2.898 1.00 23.64 H new ATOM 0 HB3 ARG A 191 25.868 -7.487 4.290 1.00 23.64 H new ATOM 0 HG2 ARG A 191 24.050 -8.855 4.630 1.00 26.14 H new ATOM 0 HG3 ARG A 191 23.309 -8.265 3.392 1.00 26.14 H new ATOM 0 HD2 ARG A 191 24.285 -9.702 2.059 1.00 31.02 H new ATOM 0 HD3 ARG A 191 25.695 -9.235 2.533 1.00 31.02 H new ATOM 0 HE ARG A 191 24.374 -11.393 3.524 1.00 33.67 H new ATOM 0 HH11 ARG A 191 27.062 -9.502 3.970 1.00 35.77 H new ATOM 0 HH12 ARG A 191 27.795 -10.464 4.839 1.00 35.77 H new ATOM 0 HH21 ARG A 191 25.513 -12.844 4.840 1.00 35.42 H new ATOM 0 HH22 ARG A 191 26.859 -12.481 5.363 1.00 35.42 H new ATOM 613 N GLU A 192 22.044 -6.045 3.918 1.00 22.64 N ATOM 614 CA GLU A 192 20.835 -5.670 3.178 1.00 22.85 C ATOM 615 C GLU A 192 20.526 -4.191 3.344 1.00 22.45 C ATOM 616 O GLU A 192 20.145 -3.522 2.381 1.00 22.51 O ATOM 617 CB GLU A 192 19.630 -6.507 3.616 1.00 22.98 C ATOM 618 CG GLU A 192 19.751 -7.998 3.317 1.00 24.61 C ATOM 619 CD GLU A 192 20.397 -8.787 4.450 1.00 26.92 C ATOM 620 OE1 GLU A 192 21.134 -8.201 5.273 1.00 27.61 O ATOM 621 OE2 GLU A 192 20.158 -10.012 4.519 1.00 28.82 O ATOM 0 H GLU A 192 21.909 -6.614 4.549 1.00 22.64 H new ATOM 0 HA GLU A 192 21.008 -5.848 2.240 1.00 22.85 H new ATOM 0 HB2 GLU A 192 19.499 -6.390 4.570 1.00 22.98 H new ATOM 0 HB3 GLU A 192 18.836 -6.164 3.177 1.00 22.98 H new ATOM 0 HG2 GLU A 192 18.868 -8.359 3.141 1.00 24.61 H new ATOM 0 HG3 GLU A 192 20.273 -8.118 2.508 1.00 24.61 H new ATOM 622 N TYR A 193 20.694 -3.690 4.566 1.00 22.16 N ATOM 623 CA TYR A 193 20.512 -2.269 4.858 1.00 22.16 C ATOM 624 C TYR A 193 21.476 -1.433 4.022 1.00 22.37 C ATOM 625 O TYR A 193 21.082 -0.481 3.347 1.00 21.86 O ATOM 626 CB TYR A 193 20.748 -1.987 6.347 1.00 22.12 C ATOM 627 CG TYR A 193 20.508 -0.542 6.721 1.00 21.67 C ATOM 628 CD1 TYR A 193 19.275 -0.134 7.219 1.00 22.30 C ATOM 629 CD2 TYR A 193 21.507 0.424 6.553 1.00 22.28 C ATOM 630 CE1 TYR A 193 19.039 1.202 7.554 1.00 21.18 C ATOM 631 CE2 TYR A 193 21.283 1.760 6.882 1.00 20.91 C ATOM 632 CZ TYR A 193 20.045 2.139 7.380 1.00 21.87 C ATOM 633 OH TYR A 193 19.805 3.456 7.701 1.00 21.44 O ATOM 0 H TYR A 193 20.916 -4.163 5.249 1.00 22.16 H new ATOM 0 HA TYR A 193 19.599 -2.028 4.634 1.00 22.16 H new ATOM 0 HB2 TYR A 193 20.164 -2.554 6.875 1.00 22.12 H new ATOM 0 HB3 TYR A 193 21.659 -2.228 6.576 1.00 22.12 H new ATOM 0 HD1 TYR A 193 18.597 -0.760 7.331 1.00 22.30 H new ATOM 0 HD2 TYR A 193 22.336 0.170 6.216 1.00 22.28 H new ATOM 0 HE1 TYR A 193 18.212 1.461 7.892 1.00 21.18 H new ATOM 0 HE2 TYR A 193 21.957 2.391 6.769 1.00 20.91 H new ATOM 0 HH TYR A 193 18.981 3.570 7.819 1.00 21.44 H new ATOM 634 N LEU A 194 22.750 -1.803 4.084 1.00 23.08 N ATOM 635 CA LEU A 194 23.804 -1.103 3.361 1.00 23.78 C ATOM 636 C LEU A 194 23.609 -1.144 1.848 1.00 24.41 C ATOM 637 O LEU A 194 23.973 -0.204 1.154 1.00 24.72 O ATOM 638 CB LEU A 194 25.177 -1.671 3.751 1.00 23.68 C ATOM 639 CG LEU A 194 25.602 -1.384 5.196 1.00 23.49 C ATOM 640 CD1 LEU A 194 26.888 -2.129 5.552 1.00 22.92 C ATOM 641 CD2 LEU A 194 25.753 0.125 5.428 1.00 22.03 C ATOM 0 H LEU A 194 23.029 -2.471 4.549 1.00 23.08 H new ATOM 0 HA LEU A 194 23.758 -0.169 3.618 1.00 23.78 H new ATOM 0 HB2 LEU A 194 25.167 -2.631 3.614 1.00 23.68 H new ATOM 0 HB3 LEU A 194 25.847 -1.306 3.151 1.00 23.68 H new ATOM 0 HG LEU A 194 24.903 -1.710 5.785 1.00 23.49 H new ATOM 0 HD11 LEU A 194 27.134 -1.930 6.469 1.00 22.92 H new ATOM 0 HD12 LEU A 194 26.747 -3.084 5.455 1.00 22.92 H new ATOM 0 HD13 LEU A 194 27.601 -1.846 4.958 1.00 22.92 H new ATOM 0 HD21 LEU A 194 26.022 0.286 6.346 1.00 22.03 H new ATOM 0 HD22 LEU A 194 26.427 0.479 4.827 1.00 22.03 H new ATOM 0 HD23 LEU A 194 24.906 0.565 5.258 1.00 22.03 H new ATOM 642 N LYS A 195 23.031 -2.234 1.348 1.00 25.22 N ATOM 643 CA LYS A 195 22.757 -2.391 -0.083 1.00 26.22 C ATOM 644 C LYS A 195 21.719 -1.373 -0.578 1.00 26.81 C ATOM 645 O LYS A 195 21.860 -0.816 -1.663 1.00 26.70 O ATOM 646 CB LYS A 195 22.293 -3.823 -0.375 1.00 26.14 C ATOM 647 CG LYS A 195 22.141 -4.171 -1.852 1.00 26.75 C ATOM 648 CD LYS A 195 21.457 -5.526 -2.024 1.00 27.03 C ATOM 649 CE LYS A 195 21.149 -5.771 -3.237 0.00 51.73 C ATOM 650 NZ LYS A 195 20.357 -7.008 -3.613 0.00 51.18 N ATOM 0 H LYS A 195 22.786 -2.905 1.827 1.00 25.22 H new ATOM 0 HA LYS A 195 23.581 -2.220 -0.566 1.00 26.22 H new ATOM 0 HB2 LYS A 195 22.926 -4.440 0.024 1.00 26.14 H new ATOM 0 HB3 LYS A 195 21.441 -3.967 0.065 1.00 26.14 H new ATOM 0 HG2 LYS A 195 21.623 -3.484 -2.299 1.00 26.75 H new ATOM 0 HG3 LYS A 195 23.013 -4.189 -2.276 1.00 26.75 H new ATOM 0 HD2 LYS A 195 22.044 -6.225 -1.696 1.00 27.03 H new ATOM 0 HD3 LYS A 195 20.655 -5.551 -1.479 1.00 27.03 H new ATOM 0 HE2 LYS A 195 20.650 -5.006 -3.562 0.00 51.73 H new ATOM 0 HE3 LYS A 195 21.979 -5.803 -3.739 0.00 51.73 H new ATOM 0 HZ1 LYS A 195 20.231 -7.024 -4.494 0.00 51.18 H new ATOM 0 HZ2 LYS A 195 20.806 -7.735 -3.365 0.00 51.18 H new ATOM 0 HZ3 LYS A 195 19.568 -6.992 -3.201 0.00 51.18 H new ATOM 651 N ASN A 196 20.692 -1.119 0.230 1.00 27.49 N ATOM 652 CA ASN A 196 19.594 -0.239 -0.180 1.00 28.39 C ATOM 653 C ASN A 196 19.779 1.241 0.146 1.00 29.02 C ATOM 654 O ASN A 196 19.148 2.090 -0.478 1.00 29.02 O ATOM 655 CB ASN A 196 18.272 -0.723 0.408 1.00 28.47 C ATOM 656 CG ASN A 196 17.821 -2.033 -0.184 1.00 29.00 C ATOM 657 OD1 ASN A 196 17.729 -2.178 -1.403 1.00 31.13 O ATOM 658 ND2 ASN A 196 17.534 -2.999 0.673 1.00 29.72 N ATOM 0 H ASN A 196 20.610 -1.446 1.021 1.00 27.49 H new ATOM 0 HA ASN A 196 19.590 -0.296 -1.148 1.00 28.39 H new ATOM 0 HB2 ASN A 196 18.365 -0.821 1.369 1.00 28.47 H new ATOM 0 HB3 ASN A 196 17.589 -0.051 0.257 1.00 28.47 H new ATOM 0 HD21 ASN A 196 17.271 -3.765 0.385 1.00 29.72 H new ATOM 0 HD22 ASN A 196 17.610 -2.861 1.518 1.00 29.72 H new ATOM 659 N LEU A 197 20.631 1.544 1.122 1.00 29.87 N ATOM 660 CA LEU A 197 20.827 2.930 1.564 1.00 31.18 C ATOM 661 C LEU A 197 21.257 3.908 0.442 1.00 31.66 C ATOM 662 O LEU A 197 20.723 5.018 0.375 1.00 31.75 O ATOM 663 CB LEU A 197 21.760 3.003 2.784 1.00 30.89 C ATOM 664 CG LEU A 197 21.484 4.143 3.774 1.00 32.29 C ATOM 665 CD1 LEU A 197 20.384 4.647 4.292 0.00 51.74 C ATOM 666 CD2 LEU A 197 22.852 4.308 4.639 0.00 49.26 C ATOM 0 H LEU A 197 21.107 0.964 1.543 1.00 29.87 H new ATOM 0 HA LEU A 197 19.949 3.240 1.835 1.00 31.18 H new ATOM 0 HB2 LEU A 197 21.703 2.161 3.263 1.00 30.89 H new ATOM 0 HB3 LEU A 197 22.673 3.088 2.466 1.00 30.89 H new ATOM 0 HG LEU A 197 21.061 4.735 3.132 1.00 32.29 H new ATOM 0 HD11 LEU A 197 20.612 5.375 4.891 0.00 51.74 H new ATOM 0 HD12 LEU A 197 19.814 4.980 3.581 0.00 51.74 H new ATOM 0 HD13 LEU A 197 19.913 3.958 4.786 0.00 51.74 H new ATOM 0 HD21 LEU A 197 22.741 5.020 5.288 0.00 49.26 H new ATOM 0 HD22 LEU A 197 23.045 3.477 5.101 0.00 49.26 H new ATOM 0 HD23 LEU A 197 23.587 4.526 4.044 0.00 49.26 H new ATOM 667 N PRO A 198 22.205 3.508 -0.440 1.00 32.35 N ATOM 668 CA PRO A 198 22.609 4.404 -1.540 1.00 32.68 C ATOM 669 C PRO A 198 21.522 4.693 -2.582 1.00 32.93 C ATOM 670 O PRO A 198 21.500 5.786 -3.159 1.00 32.89 O ATOM 671 CB PRO A 198 23.780 3.655 -2.200 1.00 32.77 C ATOM 672 CG PRO A 198 24.211 2.649 -1.213 1.00 32.63 C ATOM 673 CD PRO A 198 22.983 2.257 -0.470 1.00 32.55 C ATOM 0 HA PRO A 198 22.824 5.282 -1.188 1.00 32.68 H new ATOM 0 HB2 PRO A 198 23.503 3.234 -3.029 1.00 32.77 H new ATOM 0 HB3 PRO A 198 24.504 4.262 -2.419 1.00 32.77 H new ATOM 0 HG2 PRO A 198 24.613 1.882 -1.651 1.00 32.63 H new ATOM 0 HG3 PRO A 198 24.879 3.015 -0.612 1.00 32.63 H new ATOM 0 HD2 PRO A 198 22.502 1.545 -0.920 1.00 32.55 H new ATOM 0 HD3 PRO A 198 23.189 1.940 0.423 1.00 32.55 H new ATOM 674 N LEU A 199 20.634 3.728 -2.823 1.00 33.10 N ATOM 675 CA LEU A 199 19.500 3.927 -3.730 1.00 33.29 C ATOM 676 C LEU A 199 18.576 5.046 -3.245 1.00 33.17 C ATOM 677 O LEU A 199 18.028 5.807 -4.051 1.00 33.00 O ATOM 678 CB LEU A 199 18.702 2.625 -3.903 1.00 33.45 C ATOM 679 CG LEU A 199 19.267 1.486 -4.766 1.00 33.90 C ATOM 680 CD1 LEU A 199 19.768 2.004 -6.108 1.00 34.27 C ATOM 681 CD2 LEU A 199 20.365 0.708 -4.051 1.00 33.75 C ATOM 0 H LEU A 199 20.670 2.945 -2.469 1.00 33.10 H new ATOM 0 HA LEU A 199 19.865 4.190 -4.590 1.00 33.29 H new ATOM 0 HB2 LEU A 199 18.544 2.264 -3.017 1.00 33.45 H new ATOM 0 HB3 LEU A 199 17.837 2.864 -4.271 1.00 33.45 H new ATOM 0 HG LEU A 199 18.534 0.872 -4.927 1.00 33.90 H new ATOM 0 HD11 LEU A 199 20.118 1.265 -6.630 1.00 34.27 H new ATOM 0 HD12 LEU A 199 19.035 2.420 -6.588 1.00 34.27 H new ATOM 0 HD13 LEU A 199 20.470 2.657 -5.961 1.00 34.27 H new ATOM 0 HD21 LEU A 199 20.691 0.002 -4.630 1.00 33.75 H new ATOM 0 HD22 LEU A 199 21.095 1.307 -3.830 1.00 33.75 H new ATOM 0 HD23 LEU A 199 20.009 0.319 -3.237 1.00 33.75 H new ATOM 682 N LEU A 200 18.416 5.131 -1.924 1.00 33.39 N ATOM 683 CA LEU A 200 17.595 6.159 -1.278 1.00 33.43 C ATOM 684 C LEU A 200 18.236 7.545 -1.335 1.00 33.91 C ATOM 685 O LEU A 200 17.532 8.554 -1.409 1.00 34.05 O ATOM 686 CB LEU A 200 17.287 5.777 0.175 1.00 33.11 C ATOM 687 CG LEU A 200 16.340 4.595 0.415 1.00 32.50 C ATOM 688 CD1 LEU A 200 16.497 4.076 1.837 1.00 32.74 C ATOM 689 CD2 LEU A 200 14.879 4.949 0.122 1.00 31.84 C ATOM 0 H LEU A 200 18.786 4.587 -1.370 1.00 33.39 H new ATOM 0 HA LEU A 200 16.765 6.205 -1.778 1.00 33.43 H new ATOM 0 HB2 LEU A 200 18.128 5.580 0.617 1.00 33.11 H new ATOM 0 HB3 LEU A 200 16.911 6.555 0.615 1.00 33.11 H new ATOM 0 HG LEU A 200 16.588 3.894 -0.208 1.00 32.50 H new ATOM 0 HD11 LEU A 200 15.894 3.329 1.978 1.00 32.74 H new ATOM 0 HD12 LEU A 200 17.411 3.783 1.976 1.00 32.74 H new ATOM 0 HD13 LEU A 200 16.286 4.784 2.465 1.00 32.74 H new ATOM 0 HD21 LEU A 200 14.319 4.174 0.287 1.00 31.84 H new ATOM 0 HD22 LEU A 200 14.600 5.678 0.699 1.00 31.84 H new ATOM 0 HD23 LEU A 200 14.791 5.219 -0.805 1.00 31.84 H new ATOM 690 N SER A 201 19.565 7.594 -1.285 1.00 34.27 N ATOM 691 CA SER A 201 20.286 8.842 -1.518 1.00 34.97 C ATOM 692 C SER A 201 20.069 9.309 -2.955 1.00 35.04 C ATOM 693 O SER A 201 19.791 10.483 -3.198 1.00 35.60 O ATOM 694 CB SER A 201 21.783 8.684 -1.217 1.00 35.00 C ATOM 695 OG SER A 201 22.068 8.983 0.140 1.00 36.11 O ATOM 0 H SER A 201 20.067 6.916 -1.118 1.00 34.27 H new ATOM 0 HA SER A 201 19.936 9.515 -0.913 1.00 34.97 H new ATOM 0 HB2 SER A 201 22.061 7.776 -1.416 1.00 35.00 H new ATOM 0 HB3 SER A 201 22.295 9.271 -1.795 1.00 35.00 H new ATOM 0 HG SER A 201 21.754 9.738 0.333 1.00 36.11 H new ATOM 696 N LYS A 202 20.173 8.375 -3.896 1.00 34.98 N ATOM 697 CA LYS A 202 20.021 8.669 -5.319 1.00 34.93 C ATOM 698 C LYS A 202 18.601 9.115 -5.716 1.00 34.46 C ATOM 699 O LYS A 202 18.440 10.090 -6.461 1.00 34.14 O ATOM 700 CB LYS A 202 20.482 7.461 -6.153 1.00 35.47 C ATOM 701 CG LYS A 202 19.908 7.379 -7.577 1.00 37.12 C ATOM 702 CD LYS A 202 20.691 8.214 -8.583 1.00 39.35 C ATOM 703 CE LYS A 202 21.699 7.367 -9.344 1.00 40.69 C ATOM 704 NZ LYS A 202 22.130 8.054 -10.599 1.00 42.18 N ATOM 0 H LYS A 202 20.335 7.548 -3.726 1.00 34.98 H new ATOM 0 HA LYS A 202 20.588 9.432 -5.510 1.00 34.93 H new ATOM 0 HB2 LYS A 202 21.450 7.480 -6.212 1.00 35.47 H new ATOM 0 HB3 LYS A 202 20.243 6.650 -5.678 1.00 35.47 H new ATOM 0 HG2 LYS A 202 19.904 6.453 -7.866 1.00 37.12 H new ATOM 0 HG3 LYS A 202 18.985 7.677 -7.566 1.00 37.12 H new ATOM 0 HD2 LYS A 202 20.077 8.629 -9.209 1.00 39.35 H new ATOM 0 HD3 LYS A 202 21.152 8.931 -8.121 1.00 39.35 H new ATOM 0 HE2 LYS A 202 22.471 7.194 -8.783 1.00 40.69 H new ATOM 0 HE3 LYS A 202 21.307 6.506 -9.560 1.00 40.69 H new ATOM 0 HZ1 LYS A 202 22.719 7.544 -11.030 1.00 42.18 H new ATOM 0 HZ2 LYS A 202 21.422 8.193 -11.120 1.00 42.18 H new ATOM 0 HZ3 LYS A 202 22.507 8.834 -10.396 1.00 42.18 H new ATOM 705 N TYR A 203 17.584 8.414 -5.214 1.00 33.62 N ATOM 706 CA TYR A 203 16.209 8.594 -5.699 1.00 33.04 C ATOM 707 C TYR A 203 15.242 9.339 -4.771 1.00 31.92 C ATOM 708 O TYR A 203 14.232 9.875 -5.237 1.00 31.41 O ATOM 709 CB TYR A 203 15.597 7.241 -6.094 1.00 34.16 C ATOM 710 CG TYR A 203 16.220 6.608 -7.324 1.00 35.98 C ATOM 711 CD1 TYR A 203 16.889 5.381 -7.240 1.00 37.49 C ATOM 712 CD2 TYR A 203 16.149 7.237 -8.572 1.00 36.86 C ATOM 713 CE1 TYR A 203 17.469 4.794 -8.371 1.00 37.79 C ATOM 714 CE2 TYR A 203 16.727 6.660 -9.708 1.00 37.75 C ATOM 715 CZ TYR A 203 17.382 5.443 -9.599 1.00 37.59 C ATOM 716 OH TYR A 203 17.949 4.874 -10.719 1.00 38.16 O ATOM 0 H TYR A 203 17.667 7.827 -4.591 1.00 33.62 H new ATOM 0 HA TYR A 203 16.314 9.179 -6.466 1.00 33.04 H new ATOM 0 HB2 TYR A 203 15.686 6.628 -5.348 1.00 34.16 H new ATOM 0 HB3 TYR A 203 14.647 7.361 -6.251 1.00 34.16 H new ATOM 0 HD1 TYR A 203 16.949 4.948 -6.419 1.00 37.49 H new ATOM 0 HD2 TYR A 203 15.710 8.053 -8.648 1.00 36.86 H new ATOM 0 HE1 TYR A 203 17.909 3.977 -8.302 1.00 37.79 H new ATOM 0 HE2 TYR A 203 16.672 7.090 -10.531 1.00 37.75 H new ATOM 0 HH TYR A 203 17.819 5.372 -11.383 1.00 38.16 H new ATOM 717 N CYS A 204 15.547 9.373 -3.474 1.00 30.28 N ATOM 718 CA CYS A 204 14.620 9.921 -2.477 1.00 28.92 C ATOM 719 C CYS A 204 15.134 11.152 -1.718 1.00 28.03 C ATOM 720 O CYS A 204 14.468 11.648 -0.800 1.00 27.96 O ATOM 721 CB CYS A 204 14.205 8.819 -1.497 1.00 28.80 C ATOM 722 SG CYS A 204 13.166 7.556 -2.263 1.00 28.55 S ATOM 0 H CYS A 204 16.288 9.083 -3.148 1.00 30.28 H new ATOM 0 HA CYS A 204 13.854 10.241 -2.978 1.00 28.92 H new ATOM 0 HB2 CYS A 204 15.000 8.400 -1.132 1.00 28.80 H new ATOM 0 HB3 CYS A 204 13.727 9.217 -0.753 1.00 28.80 H new ATOM 0 HG CYS A 204 12.879 6.725 -1.447 1.00 28.55 H new ATOM 723 N GLY A 205 16.315 11.637 -2.096 1.00 27.03 N ATOM 724 CA GLY A 205 16.866 12.868 -1.522 1.00 25.68 C ATOM 725 C GLY A 205 17.427 12.760 -0.116 1.00 24.62 C ATOM 726 O GLY A 205 17.418 13.740 0.632 1.00 24.51 O ATOM 0 H GLY A 205 16.817 11.267 -2.688 1.00 27.03 H new ATOM 0 HA2 GLY A 205 17.570 13.189 -2.107 1.00 25.68 H new ATOM 0 HA3 GLY A 205 16.169 13.542 -1.521 1.00 25.68 H new ATOM 727 N TYR A 206 17.916 11.574 0.246 1.00 23.94 N ATOM 728 CA TYR A 206 18.577 11.365 1.527 1.00 23.64 C ATOM 729 C TYR A 206 19.909 12.110 1.508 1.00 24.43 C ATOM 730 O TYR A 206 20.874 11.636 0.906 1.00 24.24 O ATOM 731 CB TYR A 206 18.821 9.871 1.800 1.00 22.63 C ATOM 732 CG TYR A 206 17.625 9.090 2.327 1.00 21.60 C ATOM 733 CD1 TYR A 206 16.438 8.993 1.588 1.00 21.13 C ATOM 734 CD2 TYR A 206 17.695 8.420 3.548 1.00 19.70 C ATOM 735 CE1 TYR A 206 15.352 8.265 2.065 1.00 20.30 C ATOM 736 CE2 TYR A 206 16.616 7.689 4.029 1.00 20.47 C ATOM 737 CZ TYR A 206 15.448 7.617 3.287 1.00 20.16 C ATOM 738 OH TYR A 206 14.383 6.890 3.766 1.00 19.00 O ATOM 0 H TYR A 206 17.872 10.870 -0.246 1.00 23.94 H new ATOM 0 HA TYR A 206 18.005 11.701 2.235 1.00 23.64 H new ATOM 0 HB2 TYR A 206 19.121 9.454 0.977 1.00 22.63 H new ATOM 0 HB3 TYR A 206 19.546 9.791 2.440 1.00 22.63 H new ATOM 0 HD1 TYR A 206 16.375 9.422 0.765 1.00 21.13 H new ATOM 0 HD2 TYR A 206 18.477 8.463 4.049 1.00 19.70 H new ATOM 0 HE1 TYR A 206 14.568 8.214 1.568 1.00 20.30 H new ATOM 0 HE2 TYR A 206 16.677 7.249 4.846 1.00 20.47 H new ATOM 0 HH TYR A 206 14.589 6.544 4.503 1.00 19.00 H new ATOM 739 N ARG A 207 19.930 13.279 2.147 1.00 25.27 N ATOM 740 CA ARG A 207 21.139 14.107 2.296 1.00 26.82 C ATOM 741 C ARG A 207 21.122 14.751 3.680 1.00 27.38 C ATOM 742 O ARG A 207 20.051 14.917 4.271 1.00 27.30 O ATOM 743 CB ARG A 207 21.173 15.233 1.251 1.00 26.67 C ATOM 744 CG ARG A 207 21.292 14.801 -0.191 1.00 27.79 C ATOM 745 CD ARG A 207 21.506 16.000 -1.129 1.00 27.30 C ATOM 746 NE ARG A 207 20.371 16.926 -1.168 1.00 27.89 N ATOM 747 CZ ARG A 207 19.273 16.740 -1.894 1.00 29.16 C ATOM 748 NH1 ARG A 207 19.142 15.652 -2.647 1.00 28.86 N ATOM 749 NH2 ARG A 207 18.304 17.644 -1.867 1.00 29.98 N ATOM 0 H ARG A 207 19.233 13.623 2.514 1.00 25.27 H new ATOM 0 HA ARG A 207 21.916 13.539 2.176 1.00 26.82 H new ATOM 0 HB2 ARG A 207 20.365 15.761 1.345 1.00 26.67 H new ATOM 0 HB3 ARG A 207 21.919 15.817 1.457 1.00 26.67 H new ATOM 0 HG2 ARG A 207 22.033 14.182 -0.283 1.00 27.79 H new ATOM 0 HG3 ARG A 207 20.489 14.324 -0.453 1.00 27.79 H new ATOM 0 HD2 ARG A 207 22.298 16.484 -0.847 1.00 27.30 H new ATOM 0 HD3 ARG A 207 21.677 15.673 -2.026 1.00 27.30 H new ATOM 0 HE ARG A 207 20.418 17.638 -0.689 1.00 27.89 H new ATOM 0 HH11 ARG A 207 19.769 15.064 -2.666 1.00 28.86 H new ATOM 0 HH12 ARG A 207 18.430 15.536 -3.115 1.00 28.86 H new ATOM 0 HH21 ARG A 207 18.387 18.349 -1.381 1.00 29.98 H new ATOM 0 HH22 ARG A 207 17.593 17.526 -2.336 1.00 29.98 H new ATOM 750 N GLU A 208 22.298 15.146 4.178 1.00 28.02 N ATOM 751 CA GLU A 208 22.406 15.837 5.466 1.00 29.21 C ATOM 752 C GLU A 208 21.540 17.096 5.525 1.00 28.77 C ATOM 753 O GLU A 208 21.004 17.426 6.582 1.00 29.17 O ATOM 754 CB GLU A 208 23.862 16.218 5.770 1.00 29.22 C ATOM 755 CG GLU A 208 24.788 15.038 6.017 1.00 31.53 C ATOM 756 CD GLU A 208 26.254 15.423 5.968 1.00 31.63 C ATOM 757 OE1 GLU A 208 26.988 14.857 5.119 1.00 36.04 O ATOM 758 OE2 GLU A 208 26.666 16.291 6.769 1.00 34.49 O ATOM 0 H GLU A 208 23.051 15.021 3.781 1.00 28.02 H new ATOM 0 HA GLU A 208 22.085 15.212 6.135 1.00 29.21 H new ATOM 0 HB2 GLU A 208 24.210 16.737 5.028 1.00 29.22 H new ATOM 0 HB3 GLU A 208 23.877 16.794 6.550 1.00 29.22 H new ATOM 0 HG2 GLU A 208 24.588 14.651 6.884 1.00 31.53 H new ATOM 0 HG3 GLU A 208 24.615 14.352 5.353 1.00 31.53 H new ATOM 759 N ASP A 209 21.410 17.789 4.395 1.00 28.75 N ATOM 760 CA ASP A 209 20.680 19.066 4.335 1.00 28.88 C ATOM 761 C ASP A 209 19.230 18.963 3.852 1.00 28.14 C ATOM 762 O ASP A 209 18.581 19.987 3.592 1.00 28.13 O ATOM 763 CB ASP A 209 21.444 20.088 3.475 1.00 29.78 C ATOM 764 CG ASP A 209 21.495 19.715 1.986 1.00 31.65 C ATOM 765 OD1 ASP A 209 20.931 18.681 1.570 1.00 34.85 O ATOM 766 OD2 ASP A 209 22.112 20.477 1.210 1.00 35.92 O ATOM 0 H ASP A 209 21.740 17.537 3.642 1.00 28.75 H new ATOM 0 HA ASP A 209 20.629 19.365 5.256 1.00 28.88 H new ATOM 0 HB2 ASP A 209 21.025 20.958 3.570 1.00 29.78 H new ATOM 0 HB3 ASP A 209 22.350 20.171 3.812 1.00 29.78 H new ATOM 767 N ASN A 210 18.722 17.740 3.731 1.00 27.01 N ATOM 768 CA ASN A 210 17.367 17.527 3.217 1.00 26.30 C ATOM 769 C ASN A 210 16.673 16.350 3.898 1.00 25.42 C ATOM 770 O ASN A 210 17.228 15.251 3.960 1.00 25.67 O ATOM 771 CB ASN A 210 17.403 17.322 1.694 1.00 26.31 C ATOM 772 CG ASN A 210 16.016 17.299 1.072 1.00 26.76 C ATOM 773 OD1 ASN A 210 15.313 18.317 1.044 1.00 26.45 O ATOM 774 ND2 ASN A 210 15.612 16.134 0.570 1.00 24.75 N ATOM 0 H ASN A 210 19.143 17.020 3.940 1.00 27.01 H new ATOM 0 HA ASN A 210 16.850 18.322 3.420 1.00 26.30 H new ATOM 0 HB2 ASN A 210 17.924 18.033 1.288 1.00 26.31 H new ATOM 0 HB3 ASN A 210 17.857 16.488 1.494 1.00 26.31 H new ATOM 0 HD21 ASN A 210 14.835 16.068 0.208 1.00 24.75 H new ATOM 0 HD22 ASN A 210 16.128 15.447 0.608 1.00 24.75 H new ATOM 775 N ILE A 211 15.466 16.588 4.409 1.00 24.11 N ATOM 776 CA ILE A 211 14.652 15.516 4.984 1.00 22.88 C ATOM 777 C ILE A 211 13.775 14.927 3.880 1.00 22.22 C ATOM 778 O ILE A 211 12.954 15.637 3.301 1.00 21.52 O ATOM 779 CB ILE A 211 13.759 16.014 6.151 1.00 22.91 C ATOM 780 CG1 ILE A 211 14.620 16.630 7.264 1.00 23.02 C ATOM 781 CG2 ILE A 211 12.872 14.871 6.677 1.00 22.47 C ATOM 782 CD1 ILE A 211 13.843 17.266 8.395 1.00 22.94 C ATOM 0 H ILE A 211 15.099 17.365 4.433 1.00 24.11 H new ATOM 0 HA ILE A 211 15.249 14.844 5.349 1.00 22.88 H new ATOM 0 HB ILE A 211 13.170 16.711 5.821 1.00 22.91 H new ATOM 0 HG12 ILE A 211 15.193 15.939 7.632 1.00 23.02 H new ATOM 0 HG13 ILE A 211 15.201 17.300 6.871 1.00 23.02 H new ATOM 0 HG21 ILE A 211 12.321 15.198 7.405 1.00 22.47 H new ATOM 0 HG22 ILE A 211 12.303 14.547 5.961 1.00 22.47 H new ATOM 0 HG23 ILE A 211 13.433 14.147 6.997 1.00 22.47 H new ATOM 0 HD11 ILE A 211 14.461 17.627 9.049 1.00 22.94 H new ATOM 0 HD12 ILE A 211 13.289 17.981 8.045 1.00 22.94 H new ATOM 0 HD13 ILE A 211 13.280 16.598 8.817 1.00 22.94 H new ATOM 783 N PRO A 212 13.955 13.627 3.577 1.00 21.38 N ATOM 784 CA PRO A 212 13.141 12.955 2.565 1.00 21.19 C ATOM 785 C PRO A 212 11.640 13.052 2.856 1.00 20.99 C ATOM 786 O PRO A 212 11.227 13.118 4.025 1.00 21.04 O ATOM 787 CB PRO A 212 13.607 11.496 2.648 1.00 21.01 C ATOM 788 CG PRO A 212 14.967 11.566 3.235 1.00 21.36 C ATOM 789 CD PRO A 212 14.961 12.726 4.168 1.00 21.36 C ATOM 0 HA PRO A 212 13.253 13.356 1.689 1.00 21.19 H new ATOM 0 HB2 PRO A 212 13.011 10.967 3.202 1.00 21.01 H new ATOM 0 HB3 PRO A 212 13.623 11.081 1.771 1.00 21.01 H new ATOM 0 HG2 PRO A 212 15.184 10.745 3.705 1.00 21.36 H new ATOM 0 HG3 PRO A 212 15.637 11.682 2.543 1.00 21.36 H new ATOM 0 HD2 PRO A 212 14.719 12.460 5.069 1.00 21.36 H new ATOM 0 HD3 PRO A 212 15.833 13.148 4.221 1.00 21.36 H new ATOM 790 N GLN A 213 10.843 13.060 1.791 1.00 21.17 N ATOM 791 CA GLN A 213 9.390 13.117 1.908 1.00 20.91 C ATOM 792 C GLN A 213 8.774 11.721 1.895 1.00 20.42 C ATOM 793 O GLN A 213 9.210 10.833 1.144 1.00 20.41 O ATOM 794 CB GLN A 213 8.783 13.983 0.800 1.00 20.99 C ATOM 795 CG GLN A 213 9.257 15.445 0.805 1.00 22.10 C ATOM 796 CD GLN A 213 8.733 16.263 1.990 1.00 23.44 C ATOM 797 OE1 GLN A 213 7.699 15.949 2.588 1.00 22.85 O ATOM 798 NE2 GLN A 213 9.458 17.324 2.331 1.00 24.46 N ATOM 0 H GLN A 213 11.130 13.033 0.981 1.00 21.17 H new ATOM 0 HA GLN A 213 9.184 13.526 2.763 1.00 20.91 H new ATOM 0 HB2 GLN A 213 8.999 13.588 -0.059 1.00 20.99 H new ATOM 0 HB3 GLN A 213 7.817 13.967 0.885 1.00 20.99 H new ATOM 0 HG2 GLN A 213 10.227 15.461 0.816 1.00 22.10 H new ATOM 0 HG3 GLN A 213 8.975 15.870 -0.020 1.00 22.10 H new ATOM 0 HE21 GLN A 213 10.173 17.515 1.893 1.00 24.46 H new ATOM 0 HE22 GLN A 213 9.212 17.820 2.989 1.00 24.46 H new ATOM 799 N LEU A 214 7.768 11.539 2.743 1.00 20.29 N ATOM 800 CA LEU A 214 7.054 10.267 2.841 1.00 20.13 C ATOM 801 C LEU A 214 6.471 9.820 1.498 1.00 19.87 C ATOM 802 O LEU A 214 6.561 8.644 1.165 1.00 19.32 O ATOM 803 CB LEU A 214 5.982 10.300 3.936 1.00 19.99 C ATOM 804 CG LEU A 214 6.389 10.381 5.412 1.00 20.55 C ATOM 805 CD1 LEU A 214 5.173 10.187 6.302 1.00 20.72 C ATOM 806 CD2 LEU A 214 7.484 9.385 5.807 1.00 19.14 C ATOM 0 H LEU A 214 7.479 12.147 3.278 1.00 20.29 H new ATOM 0 HA LEU A 214 7.711 9.601 3.096 1.00 20.13 H new ATOM 0 HB2 LEU A 214 5.408 11.061 3.754 1.00 19.99 H new ATOM 0 HB3 LEU A 214 5.439 9.503 3.831 1.00 19.99 H new ATOM 0 HG LEU A 214 6.763 11.267 5.539 1.00 20.55 H new ATOM 0 HD11 LEU A 214 5.441 10.240 7.233 1.00 20.72 H new ATOM 0 HD12 LEU A 214 4.520 10.880 6.114 1.00 20.72 H new ATOM 0 HD13 LEU A 214 4.780 9.317 6.128 1.00 20.72 H new ATOM 0 HD21 LEU A 214 7.692 9.490 6.749 1.00 19.14 H new ATOM 0 HD22 LEU A 214 7.173 8.481 5.643 1.00 19.14 H new ATOM 0 HD23 LEU A 214 8.280 9.553 5.279 1.00 19.14 H new ATOM 807 N GLU A 215 5.900 10.751 0.720 1.00 20.16 N ATOM 808 CA GLU A 215 5.401 10.432 -0.629 1.00 20.58 C ATOM 809 C GLU A 215 6.467 9.832 -1.562 1.00 20.67 C ATOM 810 O GLU A 215 6.202 8.841 -2.248 1.00 20.42 O ATOM 811 CB GLU A 215 4.721 11.647 -1.290 1.00 20.68 C ATOM 812 CG GLU A 215 4.196 11.404 -2.715 1.00 21.74 C ATOM 813 CD GLU A 215 2.994 10.448 -2.802 1.00 23.28 C ATOM 814 OE1 GLU A 215 2.439 10.036 -1.757 1.00 22.62 O ATOM 815 OE2 GLU A 215 2.603 10.103 -3.939 1.00 24.88 O ATOM 0 H GLU A 215 5.792 11.572 0.954 1.00 20.16 H new ATOM 0 HA GLU A 215 4.736 9.739 -0.494 1.00 20.58 H new ATOM 0 HB2 GLU A 215 3.980 11.930 -0.731 1.00 20.68 H new ATOM 0 HB3 GLU A 215 5.354 12.381 -1.314 1.00 20.68 H new ATOM 0 HG2 GLU A 215 3.945 12.256 -3.104 1.00 21.74 H new ATOM 0 HG3 GLU A 215 4.918 11.047 -3.256 1.00 21.74 H new ATOM 816 N ASP A 216 7.653 10.449 -1.592 1.00 20.94 N ATOM 817 CA ASP A 216 8.777 9.965 -2.404 1.00 21.32 C ATOM 818 C ASP A 216 9.215 8.558 -1.981 1.00 20.93 C ATOM 819 O ASP A 216 9.366 7.665 -2.826 1.00 20.40 O ATOM 820 CB ASP A 216 9.978 10.929 -2.332 1.00 21.64 C ATOM 821 CG ASP A 216 9.679 12.299 -2.930 1.00 23.59 C ATOM 822 OD1 ASP A 216 10.375 13.265 -2.554 1.00 25.80 O ATOM 823 OD2 ASP A 216 8.758 12.424 -3.767 1.00 25.43 O ATOM 0 H ASP A 216 7.829 11.160 -1.142 1.00 20.94 H new ATOM 0 HA ASP A 216 8.463 9.926 -3.321 1.00 21.32 H new ATOM 0 HB2 ASP A 216 10.244 11.037 -1.406 1.00 21.64 H new ATOM 0 HB3 ASP A 216 10.731 10.535 -2.799 1.00 21.64 H new ATOM 824 N VAL A 217 9.386 8.351 -0.681 1.00 20.57 N ATOM 825 CA VAL A 217 9.838 7.045 -0.187 1.00 20.45 C ATOM 826 C VAL A 217 8.752 5.980 -0.373 1.00 20.00 C ATOM 827 O VAL A 217 9.058 4.830 -0.694 1.00 19.48 O ATOM 828 CB VAL A 217 10.416 7.080 1.271 1.00 20.74 C ATOM 829 CG1 VAL A 217 11.665 7.951 1.329 1.00 21.39 C ATOM 830 CG2 VAL A 217 9.400 7.582 2.275 1.00 21.75 C ATOM 0 H VAL A 217 9.249 8.942 -0.071 1.00 20.57 H new ATOM 0 HA VAL A 217 10.595 6.791 -0.738 1.00 20.45 H new ATOM 0 HB VAL A 217 10.644 6.167 1.507 1.00 20.74 H new ATOM 0 HG11 VAL A 217 12.010 7.963 2.236 1.00 21.39 H new ATOM 0 HG12 VAL A 217 12.339 7.591 0.732 1.00 21.39 H new ATOM 0 HG13 VAL A 217 11.442 8.855 1.057 1.00 21.39 H new ATOM 0 HG21 VAL A 217 9.796 7.588 3.161 1.00 21.75 H new ATOM 0 HG22 VAL A 217 9.127 8.482 2.037 1.00 21.75 H new ATOM 0 HG23 VAL A 217 8.625 6.998 2.271 1.00 21.75 H new ATOM 831 N SER A 218 7.492 6.373 -0.206 1.00 19.23 N ATOM 832 CA SER A 218 6.386 5.454 -0.473 1.00 19.66 C ATOM 833 C SER A 218 6.402 4.966 -1.922 1.00 19.89 C ATOM 834 O SER A 218 6.309 3.761 -2.174 1.00 19.78 O ATOM 835 CB SER A 218 5.031 6.076 -0.135 1.00 19.36 C ATOM 836 OG SER A 218 4.033 5.062 -0.148 1.00 18.90 O ATOM 0 H SER A 218 7.257 7.157 0.058 1.00 19.23 H new ATOM 0 HA SER A 218 6.514 4.688 0.109 1.00 19.66 H new ATOM 0 HB2 SER A 218 5.066 6.499 0.737 1.00 19.36 H new ATOM 0 HB3 SER A 218 4.812 6.769 -0.778 1.00 19.36 H new ATOM 0 HG SER A 218 3.279 5.409 -0.015 1.00 18.90 H new ATOM 837 N ASN A 219 6.527 5.897 -2.869 1.00 20.57 N ATOM 838 CA ASN A 219 6.602 5.541 -4.286 1.00 21.56 C ATOM 839 C ASN A 219 7.823 4.686 -4.622 1.00 21.30 C ATOM 840 O ASN A 219 7.739 3.781 -5.454 1.00 21.36 O ATOM 841 CB ASN A 219 6.531 6.789 -5.178 1.00 21.78 C ATOM 842 CG ASN A 219 5.156 7.447 -5.145 1.00 24.05 C ATOM 843 OD1 ASN A 219 4.127 6.769 -5.035 1.00 27.06 O ATOM 844 ND2 ASN A 219 5.131 8.771 -5.243 1.00 24.93 N ATOM 0 H ASN A 219 6.570 6.741 -2.711 1.00 20.57 H new ATOM 0 HA ASN A 219 5.825 4.991 -4.472 1.00 21.56 H new ATOM 0 HB2 ASN A 219 7.200 7.429 -4.889 1.00 21.78 H new ATOM 0 HB3 ASN A 219 6.748 6.544 -6.091 1.00 21.78 H new ATOM 0 HD21 ASN A 219 4.379 9.189 -5.231 1.00 24.93 H new ATOM 0 HD22 ASN A 219 5.866 9.211 -5.318 1.00 24.93 H new ATOM 845 N PHE A 220 8.946 4.974 -3.964 1.00 20.91 N ATOM 846 CA PHE A 220 10.159 4.177 -4.117 1.00 20.73 C ATOM 847 C PHE A 220 9.916 2.731 -3.645 1.00 20.43 C ATOM 848 O PHE A 220 10.316 1.773 -4.309 1.00 19.76 O ATOM 849 CB PHE A 220 11.314 4.822 -3.339 1.00 21.40 C ATOM 850 CG PHE A 220 12.594 4.026 -3.374 1.00 22.00 C ATOM 851 CD1 PHE A 220 13.503 4.196 -4.410 1.00 23.92 C ATOM 852 CD2 PHE A 220 12.880 3.097 -2.372 1.00 22.56 C ATOM 853 CE1 PHE A 220 14.695 3.451 -4.454 1.00 24.50 C ATOM 854 CE2 PHE A 220 14.059 2.346 -2.404 1.00 24.35 C ATOM 855 CZ PHE A 220 14.968 2.528 -3.448 1.00 23.23 C ATOM 0 H PHE A 220 9.024 5.635 -3.419 1.00 20.91 H new ATOM 0 HA PHE A 220 10.401 4.149 -5.056 1.00 20.73 H new ATOM 0 HB2 PHE A 220 11.483 5.706 -3.702 1.00 21.40 H new ATOM 0 HB3 PHE A 220 11.043 4.942 -2.415 1.00 21.40 H new ATOM 0 HD1 PHE A 220 13.321 4.811 -5.084 1.00 23.92 H new ATOM 0 HD2 PHE A 220 12.278 2.976 -1.674 1.00 22.56 H new ATOM 0 HE1 PHE A 220 15.298 3.574 -5.151 1.00 24.50 H new ATOM 0 HE2 PHE A 220 14.237 1.728 -1.733 1.00 24.35 H new ATOM 0 HZ PHE A 220 15.755 2.033 -3.471 1.00 23.23 H new ATOM 856 N LEU A 221 9.251 2.583 -2.500 1.00 19.76 N ATOM 857 CA LEU A 221 8.991 1.260 -1.930 1.00 19.60 C ATOM 858 C LEU A 221 7.983 0.474 -2.764 1.00 20.07 C ATOM 859 O LEU A 221 8.114 -0.746 -2.927 1.00 19.58 O ATOM 860 CB LEU A 221 8.517 1.381 -0.473 1.00 19.03 C ATOM 861 CG LEU A 221 9.596 1.763 0.550 1.00 19.29 C ATOM 862 CD1 LEU A 221 8.972 1.936 1.932 1.00 17.14 C ATOM 863 CD2 LEU A 221 10.721 0.728 0.604 1.00 18.91 C ATOM 0 H LEU A 221 8.941 3.237 -2.036 1.00 19.76 H new ATOM 0 HA LEU A 221 9.826 0.767 -1.943 1.00 19.60 H new ATOM 0 HB2 LEU A 221 7.810 2.044 -0.435 1.00 19.03 H new ATOM 0 HB3 LEU A 221 8.127 0.534 -0.206 1.00 19.03 H new ATOM 0 HG LEU A 221 9.986 2.604 0.266 1.00 19.29 H new ATOM 0 HD11 LEU A 221 9.661 2.177 2.571 1.00 17.14 H new ATOM 0 HD12 LEU A 221 8.302 2.637 1.899 1.00 17.14 H new ATOM 0 HD13 LEU A 221 8.555 1.104 2.206 1.00 17.14 H new ATOM 0 HD21 LEU A 221 11.382 1.002 1.259 1.00 18.91 H new ATOM 0 HD22 LEU A 221 10.356 -0.135 0.855 1.00 18.91 H new ATOM 0 HD23 LEU A 221 11.140 0.659 -0.268 1.00 18.91 H new ATOM 864 N LYS A 222 6.977 1.175 -3.286 1.00 20.79 N ATOM 865 CA LYS A 222 5.945 0.542 -4.100 1.00 22.26 C ATOM 866 C LYS A 222 6.555 -0.198 -5.287 1.00 23.32 C ATOM 867 O LYS A 222 6.123 -1.301 -5.615 1.00 23.23 O ATOM 868 CB LYS A 222 4.912 1.563 -4.579 1.00 22.47 C ATOM 869 CG LYS A 222 3.886 1.950 -3.544 1.00 23.54 C ATOM 870 CD LYS A 222 2.817 2.814 -4.179 1.00 26.19 C ATOM 871 CE LYS A 222 1.962 3.511 -3.135 1.00 28.56 C ATOM 872 NZ LYS A 222 1.009 4.488 -3.759 1.00 29.37 N ATOM 0 H LYS A 222 6.875 2.022 -3.179 1.00 20.79 H new ATOM 0 HA LYS A 222 5.491 -0.106 -3.539 1.00 22.26 H new ATOM 0 HB2 LYS A 222 5.377 2.363 -4.872 1.00 22.47 H new ATOM 0 HB3 LYS A 222 4.453 1.202 -5.353 1.00 22.47 H new ATOM 0 HG2 LYS A 222 3.485 1.154 -3.161 1.00 23.54 H new ATOM 0 HG3 LYS A 222 4.313 2.431 -2.817 1.00 23.54 H new ATOM 0 HD2 LYS A 222 3.234 3.477 -4.751 1.00 26.19 H new ATOM 0 HD3 LYS A 222 2.252 2.266 -4.746 1.00 26.19 H new ATOM 0 HE2 LYS A 222 1.463 2.849 -2.631 1.00 28.56 H new ATOM 0 HE3 LYS A 222 2.535 3.975 -2.505 1.00 28.56 H new ATOM 0 HZ1 LYS A 222 0.394 4.726 -3.162 1.00 29.37 H new ATOM 0 HZ2 LYS A 222 1.456 5.209 -4.027 1.00 29.37 H new ATOM 0 HZ3 LYS A 222 0.611 4.109 -4.459 1.00 29.37 H new ATOM 873 N GLU A 223 7.563 0.397 -5.921 1.00 24.63 N ATOM 874 CA GLU A 223 8.200 -0.257 -7.066 1.00 26.42 C ATOM 875 C GLU A 223 9.149 -1.394 -6.665 1.00 26.12 C ATOM 876 O GLU A 223 9.300 -2.366 -7.405 1.00 26.44 O ATOM 877 CB GLU A 223 8.853 0.755 -8.032 1.00 26.77 C ATOM 878 CG GLU A 223 9.938 1.654 -7.466 1.00 28.77 C ATOM 879 CD GLU A 223 10.466 2.640 -8.507 1.00 28.99 C ATOM 880 OE1 GLU A 223 10.769 3.804 -8.139 1.00 34.80 O ATOM 881 OE2 GLU A 223 11.072 1.840 -9.673 0.00 54.24 O ATOM 0 H GLU A 223 7.889 1.164 -5.711 1.00 24.63 H new ATOM 0 HA GLU A 223 7.483 -0.684 -7.560 1.00 26.42 H new ATOM 0 HB2 GLU A 223 9.231 0.260 -8.776 1.00 26.77 H new ATOM 0 HB3 GLU A 223 8.153 1.320 -8.394 1.00 26.77 H new ATOM 0 HG2 GLU A 223 9.587 2.144 -6.706 1.00 28.77 H new ATOM 0 HG3 GLU A 223 10.670 1.109 -7.138 1.00 28.77 H new ATOM 882 N ARG A 224 9.746 -1.288 -5.480 1.00 25.64 N ATOM 883 CA ARG A 224 10.765 -2.243 -5.042 1.00 25.45 C ATOM 884 C ARG A 224 10.167 -3.515 -4.431 1.00 24.56 C ATOM 885 O ARG A 224 10.531 -4.629 -4.833 1.00 24.51 O ATOM 886 CB ARG A 224 11.742 -1.577 -4.063 1.00 26.04 C ATOM 887 CG ARG A 224 12.680 -0.532 -4.697 1.00 28.83 C ATOM 888 CD ARG A 224 14.106 -1.052 -4.794 1.00 32.81 C ATOM 889 NE ARG A 224 14.258 -2.064 -5.839 1.00 37.01 N ATOM 890 CZ ARG A 224 15.033 -1.938 -6.917 1.00 38.93 C ATOM 891 NH1 ARG A 224 15.091 -2.924 -7.804 1.00 39.85 N ATOM 892 NH2 ARG A 224 15.759 -0.841 -7.110 1.00 39.79 N ATOM 0 H ARG A 224 9.575 -0.667 -4.911 1.00 25.64 H new ATOM 0 HA ARG A 224 11.249 -2.519 -5.836 1.00 25.45 H new ATOM 0 HB2 ARG A 224 11.232 -1.149 -3.357 1.00 26.04 H new ATOM 0 HB3 ARG A 224 12.282 -2.266 -3.645 1.00 26.04 H new ATOM 0 HG2 ARG A 224 12.358 -0.300 -5.582 1.00 28.83 H new ATOM 0 HG3 ARG A 224 12.666 0.281 -4.168 1.00 28.83 H new ATOM 0 HD2 ARG A 224 14.706 -0.312 -4.974 1.00 32.81 H new ATOM 0 HD3 ARG A 224 14.369 -1.430 -3.940 1.00 32.81 H new ATOM 0 HE ARG A 224 13.814 -2.795 -5.752 1.00 37.01 H new ATOM 0 HH11 ARG A 224 14.630 -3.640 -7.682 1.00 39.85 H new ATOM 0 HH12 ARG A 224 15.589 -2.847 -8.501 1.00 39.85 H new ATOM 0 HH21 ARG A 224 15.733 -0.201 -6.536 1.00 39.79 H new ATOM 0 HH22 ARG A 224 16.255 -0.771 -7.809 1.00 39.79 H new ATOM 893 N THR A 225 9.241 -3.349 -3.483 1.00 22.79 N ATOM 894 CA THR A 225 8.670 -4.484 -2.742 1.00 22.08 C ATOM 895 C THR A 225 7.140 -4.466 -2.635 1.00 21.04 C ATOM 896 O THR A 225 6.543 -5.352 -2.018 1.00 21.35 O ATOM 897 CB THR A 225 9.217 -4.543 -1.303 1.00 21.90 C ATOM 898 OG1 THR A 225 8.959 -3.290 -0.647 1.00 21.51 O ATOM 899 CG2 THR A 225 10.725 -4.855 -1.296 1.00 22.16 C ATOM 0 H THR A 225 8.927 -2.583 -3.251 1.00 22.79 H new ATOM 0 HA THR A 225 8.934 -5.259 -3.262 1.00 22.08 H new ATOM 0 HB THR A 225 8.768 -5.257 -0.825 1.00 21.90 H new ATOM 0 HG1 THR A 225 9.487 -3.198 0.000 1.00 21.51 H new ATOM 0 HG21 THR A 225 11.045 -4.887 -0.381 1.00 22.16 H new ATOM 0 HG22 THR A 225 10.880 -5.712 -1.722 1.00 22.16 H new ATOM 0 HG23 THR A 225 11.201 -4.163 -1.781 1.00 22.16 H new ATOM 900 N GLY A 226 6.510 -3.454 -3.210 1.00 20.35 N ATOM 901 CA GLY A 226 5.068 -3.268 -3.041 1.00 19.60 C ATOM 902 C GLY A 226 4.694 -2.653 -1.702 1.00 18.87 C ATOM 903 O GLY A 226 3.516 -2.516 -1.390 1.00 18.95 O ATOM 0 H GLY A 226 6.893 -2.862 -3.702 1.00 20.35 H new ATOM 0 HA2 GLY A 226 4.736 -2.701 -3.754 1.00 19.60 H new ATOM 0 HA3 GLY A 226 4.625 -4.126 -3.131 1.00 19.60 H new ATOM 904 N PHE A 227 5.687 -2.300 -0.893 1.00 18.23 N ATOM 905 CA PHE A 227 5.394 -1.589 0.347 1.00 17.75 C ATOM 906 C PHE A 227 4.984 -0.160 0.043 1.00 17.84 C ATOM 907 O PHE A 227 5.388 0.415 -0.971 1.00 17.54 O ATOM 908 CB PHE A 227 6.543 -1.659 1.364 1.00 17.74 C ATOM 909 CG PHE A 227 6.248 -2.567 2.533 1.00 18.13 C ATOM 910 CD1 PHE A 227 6.512 -3.934 2.458 1.00 18.16 C ATOM 911 CD2 PHE A 227 5.655 -2.061 3.692 1.00 17.23 C ATOM 912 CE1 PHE A 227 6.200 -4.785 3.538 1.00 16.86 C ATOM 913 CE2 PHE A 227 5.344 -2.893 4.771 1.00 17.49 C ATOM 914 CZ PHE A 227 5.623 -4.261 4.695 1.00 17.55 C ATOM 0 H PHE A 227 6.520 -2.458 -1.038 1.00 18.23 H new ATOM 0 HA PHE A 227 4.648 -2.039 0.774 1.00 17.75 H new ATOM 0 HB2 PHE A 227 7.345 -1.969 0.916 1.00 17.74 H new ATOM 0 HB3 PHE A 227 6.729 -0.766 1.694 1.00 17.74 H new ATOM 0 HD1 PHE A 227 6.897 -4.288 1.689 1.00 18.16 H new ATOM 0 HD2 PHE A 227 5.463 -1.153 3.747 1.00 17.23 H new ATOM 0 HE1 PHE A 227 6.379 -5.696 3.479 1.00 16.86 H new ATOM 0 HE2 PHE A 227 4.953 -2.538 5.537 1.00 17.49 H new ATOM 0 HZ PHE A 227 5.425 -4.819 5.412 1.00 17.55 H new ATOM 915 N SER A 228 4.120 0.379 0.888 1.00 18.25 N ATOM 916 CA SER A 228 3.740 1.774 0.789 1.00 18.56 C ATOM 917 C SER A 228 3.669 2.370 2.179 1.00 18.44 C ATOM 918 O SER A 228 3.734 1.662 3.188 1.00 18.31 O ATOM 919 CB SER A 228 2.413 1.940 0.049 1.00 18.52 C ATOM 920 OG SER A 228 1.357 1.288 0.722 1.00 19.33 O ATOM 0 H SER A 228 3.741 -0.050 1.530 1.00 18.25 H new ATOM 0 HA SER A 228 4.411 2.247 0.273 1.00 18.56 H new ATOM 0 HB2 SER A 228 2.207 2.884 -0.040 1.00 18.52 H new ATOM 0 HB3 SER A 228 2.495 1.582 -0.849 1.00 18.52 H new ATOM 0 HG SER A 228 1.303 0.493 0.456 1.00 19.33 H new ATOM 921 N ILE A 229 3.545 3.685 2.224 1.00 18.80 N ATOM 922 CA ILE A 229 3.517 4.390 3.487 1.00 18.83 C ATOM 923 C ILE A 229 2.186 5.101 3.666 1.00 19.11 C ATOM 924 O ILE A 229 1.551 5.529 2.703 1.00 19.16 O ATOM 925 CB ILE A 229 4.721 5.359 3.615 1.00 18.77 C ATOM 926 CG1 ILE A 229 6.007 4.535 3.763 1.00 19.68 C ATOM 927 CG2 ILE A 229 4.547 6.299 4.812 1.00 17.88 C ATOM 928 CD1 ILE A 229 7.279 5.329 3.724 1.00 22.27 C ATOM 0 H ILE A 229 3.475 4.188 1.530 1.00 18.80 H new ATOM 0 HA ILE A 229 3.603 3.744 4.205 1.00 18.83 H new ATOM 0 HB ILE A 229 4.773 5.909 2.818 1.00 18.77 H new ATOM 0 HG12 ILE A 229 5.970 4.051 4.603 1.00 19.68 H new ATOM 0 HG13 ILE A 229 6.034 3.873 3.055 1.00 19.68 H new ATOM 0 HG21 ILE A 229 5.311 6.894 4.870 1.00 17.88 H new ATOM 0 HG22 ILE A 229 3.738 6.822 4.698 1.00 17.88 H new ATOM 0 HG23 ILE A 229 4.481 5.777 5.627 1.00 17.88 H new ATOM 0 HD11 ILE A 229 8.037 4.732 3.824 1.00 22.27 H new ATOM 0 HD12 ILE A 229 7.344 5.794 2.875 1.00 22.27 H new ATOM 0 HD13 ILE A 229 7.280 5.975 4.447 1.00 22.27 H new ATOM 929 N ARG A 230 1.772 5.182 4.920 1.00 19.76 N ATOM 930 CA ARG A 230 0.619 5.944 5.327 1.00 20.71 C ATOM 931 C ARG A 230 1.043 6.799 6.528 1.00 20.58 C ATOM 932 O ARG A 230 1.621 6.276 7.479 1.00 20.61 O ATOM 933 CB ARG A 230 -0.498 4.956 5.672 1.00 21.02 C ATOM 934 CG ARG A 230 -1.501 5.425 6.645 1.00 23.23 C ATOM 935 CD ARG A 230 -2.828 4.740 6.379 1.00 23.68 C ATOM 936 NE ARG A 230 -3.881 5.693 6.668 1.00 24.56 N ATOM 937 CZ ARG A 230 -5.102 5.666 6.157 1.00 23.41 C ATOM 938 NH1 ARG A 230 -5.467 4.716 5.299 1.00 23.12 N ATOM 939 NH2 ARG A 230 -5.949 6.614 6.505 1.00 24.34 N ATOM 0 H ARG A 230 2.168 4.783 5.571 1.00 19.76 H new ATOM 0 HA ARG A 230 0.287 6.534 4.633 1.00 20.71 H new ATOM 0 HB2 ARG A 230 -0.957 4.716 4.852 1.00 21.02 H new ATOM 0 HB3 ARG A 230 -0.093 4.146 6.018 1.00 21.02 H new ATOM 0 HG2 ARG A 230 -1.203 5.233 7.548 1.00 23.23 H new ATOM 0 HG3 ARG A 230 -1.604 6.387 6.578 1.00 23.23 H new ATOM 0 HD2 ARG A 230 -2.880 4.445 5.456 1.00 23.68 H new ATOM 0 HD3 ARG A 230 -2.921 3.951 6.935 1.00 23.68 H new ATOM 0 HE ARG A 230 -3.697 6.329 7.217 1.00 24.56 H new ATOM 0 HH11 ARG A 230 -4.906 4.106 5.068 1.00 23.12 H new ATOM 0 HH12 ARG A 230 -6.264 4.712 4.976 1.00 23.12 H new ATOM 0 HH21 ARG A 230 -5.703 7.231 7.052 1.00 24.34 H new ATOM 0 HH22 ARG A 230 -6.747 6.616 6.185 1.00 24.34 H new ATOM 940 N PRO A 231 0.805 8.125 6.464 1.00 21.11 N ATOM 941 CA PRO A 231 1.145 8.989 7.593 1.00 21.31 C ATOM 942 C PRO A 231 0.294 8.657 8.813 1.00 21.50 C ATOM 943 O PRO A 231 -0.898 8.376 8.670 1.00 21.28 O ATOM 944 CB PRO A 231 0.816 10.396 7.071 1.00 21.21 C ATOM 945 CG PRO A 231 -0.183 10.185 6.001 1.00 21.47 C ATOM 946 CD PRO A 231 0.227 8.893 5.346 1.00 21.00 C ATOM 0 HA PRO A 231 2.067 8.891 7.879 1.00 21.31 H new ATOM 0 HB2 PRO A 231 0.461 10.958 7.777 1.00 21.21 H new ATOM 0 HB3 PRO A 231 1.609 10.838 6.729 1.00 21.21 H new ATOM 0 HG2 PRO A 231 -1.081 10.127 6.363 1.00 21.47 H new ATOM 0 HG3 PRO A 231 -0.180 10.919 5.366 1.00 21.47 H new ATOM 0 HD2 PRO A 231 -0.530 8.435 4.949 1.00 21.00 H new ATOM 0 HD3 PRO A 231 0.874 9.038 4.638 1.00 21.00 H new ATOM 947 N VAL A 232 0.904 8.689 9.992 1.00 21.75 N ATOM 948 CA VAL A 232 0.206 8.359 11.240 1.00 22.76 C ATOM 949 C VAL A 232 0.442 9.438 12.307 1.00 23.58 C ATOM 950 O VAL A 232 1.558 9.958 12.454 1.00 23.25 O ATOM 951 CB VAL A 232 0.566 6.920 11.748 1.00 22.43 C ATOM 952 CG1 VAL A 232 1.970 6.849 12.334 1.00 22.19 C ATOM 953 CG2 VAL A 232 -0.470 6.407 12.744 1.00 22.78 C ATOM 0 H VAL A 232 1.731 8.901 10.096 1.00 21.75 H new ATOM 0 HA VAL A 232 -0.746 8.348 11.053 1.00 22.76 H new ATOM 0 HB VAL A 232 0.552 6.338 10.972 1.00 22.43 H new ATOM 0 HG11 VAL A 232 2.150 5.945 12.635 1.00 22.19 H new ATOM 0 HG12 VAL A 232 2.617 7.099 11.656 1.00 22.19 H new ATOM 0 HG13 VAL A 232 2.038 7.459 13.085 1.00 22.19 H new ATOM 0 HG21 VAL A 232 -0.222 5.517 13.040 1.00 22.78 H new ATOM 0 HG22 VAL A 232 -0.507 7.003 13.508 1.00 22.78 H new ATOM 0 HG23 VAL A 232 -1.341 6.374 12.318 1.00 22.78 H new ATOM 954 N ALA A 233 -0.625 9.782 13.029 1.00 25.17 N ATOM 955 CA ALA A 233 -0.601 10.913 13.961 1.00 26.59 C ATOM 956 C ALA A 233 0.216 10.634 15.216 1.00 27.70 C ATOM 957 O ALA A 233 0.824 11.546 15.782 1.00 28.49 O ATOM 958 CB ALA A 233 -2.031 11.345 14.322 1.00 26.64 C ATOM 0 H ALA A 233 -1.379 9.370 12.994 1.00 25.17 H new ATOM 0 HA ALA A 233 -0.156 11.643 13.503 1.00 26.59 H new ATOM 0 HB1 ALA A 233 -1.997 12.093 14.938 1.00 26.64 H new ATOM 0 HB2 ALA A 233 -2.502 11.611 13.517 1.00 26.64 H new ATOM 0 HB3 ALA A 233 -2.498 10.604 14.739 1.00 26.64 H new ATOM 959 N GLY A 234 0.236 9.369 15.636 1.00 28.51 N ATOM 960 CA GLY A 234 0.995 8.933 16.803 1.00 29.20 C ATOM 961 C GLY A 234 1.026 7.419 16.878 1.00 29.65 C ATOM 962 O GLY A 234 1.022 6.746 15.847 1.00 29.81 O ATOM 0 H GLY A 234 -0.196 8.735 15.246 1.00 28.51 H new ATOM 0 HA2 GLY A 234 1.900 9.279 16.755 1.00 29.20 H new ATOM 0 HA3 GLY A 234 0.595 9.295 17.610 1.00 29.20 H new ATOM 963 N TYR A 235 1.050 6.888 18.099 1.00 29.87 N ATOM 964 CA TYR A 235 1.070 5.444 18.330 1.00 29.80 C ATOM 965 C TYR A 235 -0.273 4.813 17.978 1.00 29.25 C ATOM 966 O TYR A 235 -1.322 5.291 18.418 1.00 29.25 O ATOM 967 CB TYR A 235 1.362 5.144 19.803 1.00 30.82 C ATOM 968 CG TYR A 235 2.814 5.113 20.233 1.00 31.90 C ATOM 969 CD1 TYR A 235 3.663 4.079 19.835 1.00 33.73 C ATOM 970 CD2 TYR A 235 3.325 6.088 21.095 1.00 34.03 C ATOM 971 CE1 TYR A 235 4.999 4.038 20.253 1.00 34.00 C ATOM 972 CE2 TYR A 235 4.660 6.054 21.524 1.00 33.82 C ATOM 973 CZ TYR A 235 5.486 5.023 21.102 1.00 33.47 C ATOM 974 OH TYR A 235 6.808 4.983 21.523 1.00 33.20 O ATOM 0 H TYR A 235 1.055 7.357 18.820 1.00 29.87 H new ATOM 0 HA TYR A 235 1.764 5.071 17.764 1.00 29.80 H new ATOM 0 HB2 TYR A 235 0.904 5.809 20.341 1.00 30.82 H new ATOM 0 HB3 TYR A 235 0.967 4.284 20.018 1.00 30.82 H new ATOM 0 HD1 TYR A 235 3.336 3.406 19.283 1.00 33.73 H new ATOM 0 HD2 TYR A 235 2.769 6.773 21.390 1.00 34.03 H new ATOM 0 HE1 TYR A 235 5.558 3.354 19.963 1.00 34.00 H new ATOM 0 HE2 TYR A 235 4.989 6.717 22.087 1.00 33.82 H new ATOM 0 HH TYR A 235 6.961 5.637 22.028 1.00 33.20 H new ATOM 975 N LEU A 236 -0.238 3.742 17.187 1.00 28.27 N ATOM 976 CA LEU A 236 -1.412 2.889 16.969 1.00 27.37 C ATOM 977 C LEU A 236 -1.320 1.675 17.873 1.00 27.05 C ATOM 978 O LEU A 236 -0.228 1.307 18.304 1.00 27.03 O ATOM 979 CB LEU A 236 -1.469 2.402 15.518 1.00 27.03 C ATOM 980 CG LEU A 236 -1.889 3.360 14.414 1.00 26.27 C ATOM 981 CD1 LEU A 236 -1.580 2.716 13.077 1.00 25.00 C ATOM 982 CD2 LEU A 236 -3.364 3.693 14.524 1.00 26.38 C ATOM 0 H LEU A 236 0.465 3.488 16.761 1.00 28.27 H new ATOM 0 HA LEU A 236 -2.208 3.408 17.165 1.00 27.37 H new ATOM 0 HB2 LEU A 236 -0.587 2.067 15.291 1.00 27.03 H new ATOM 0 HB3 LEU A 236 -2.075 1.645 15.491 1.00 27.03 H new ATOM 0 HG LEU A 236 -1.398 4.192 14.497 1.00 26.27 H new ATOM 0 HD11 LEU A 236 -1.842 3.315 12.361 1.00 25.00 H new ATOM 0 HD12 LEU A 236 -0.629 2.537 13.016 1.00 25.00 H new ATOM 0 HD13 LEU A 236 -2.071 1.883 12.998 1.00 25.00 H new ATOM 0 HD21 LEU A 236 -3.612 4.304 13.813 1.00 26.38 H new ATOM 0 HD22 LEU A 236 -3.886 2.879 14.447 1.00 26.38 H new ATOM 0 HD23 LEU A 236 -3.539 4.109 15.383 1.00 26.38 H new ATOM 983 N SER A 237 -2.459 1.044 18.148 1.00 26.84 N ATOM 984 CA SER A 237 -2.463 -0.229 18.856 1.00 26.35 C ATOM 985 C SER A 237 -1.679 -1.240 18.024 1.00 25.84 C ATOM 986 O SER A 237 -1.685 -1.161 16.794 1.00 25.68 O ATOM 987 CB SER A 237 -3.891 -0.740 19.063 1.00 26.62 C ATOM 988 OG SER A 237 -4.492 -1.031 17.814 1.00 26.53 O ATOM 0 H SER A 237 -3.238 1.337 17.933 1.00 26.84 H new ATOM 0 HA SER A 237 -2.057 -0.110 19.729 1.00 26.35 H new ATOM 0 HB2 SER A 237 -3.880 -1.536 19.617 1.00 26.62 H new ATOM 0 HB3 SER A 237 -4.415 -0.074 19.534 1.00 26.62 H new ATOM 0 HG SER A 237 -5.238 -1.396 17.940 1.00 26.53 H new ATOM 989 N PRO A 238 -0.987 -2.180 18.690 1.00 25.17 N ATOM 990 CA PRO A 238 -0.260 -3.221 17.979 1.00 24.46 C ATOM 991 C PRO A 238 -1.129 -3.920 16.942 1.00 23.55 C ATOM 992 O PRO A 238 -0.652 -4.208 15.842 1.00 23.63 O ATOM 993 CB PRO A 238 0.126 -4.189 19.097 1.00 24.54 C ATOM 994 CG PRO A 238 0.279 -3.309 20.282 1.00 25.23 C ATOM 995 CD PRO A 238 -0.830 -2.311 20.150 1.00 25.36 C ATOM 0 HA PRO A 238 0.496 -2.873 17.481 1.00 24.46 H new ATOM 0 HB2 PRO A 238 -0.558 -4.862 19.238 1.00 24.54 H new ATOM 0 HB3 PRO A 238 0.949 -4.660 18.893 1.00 24.54 H new ATOM 0 HG2 PRO A 238 0.206 -3.812 21.108 1.00 25.23 H new ATOM 0 HG3 PRO A 238 1.146 -2.875 20.291 1.00 25.23 H new ATOM 0 HD2 PRO A 238 -1.646 -2.623 20.572 1.00 25.36 H new ATOM 0 HD3 PRO A 238 -0.602 -1.464 20.564 1.00 25.36 H new ATOM 996 N ARG A 239 -2.394 -4.171 17.285 1.00 22.43 N ATOM 997 CA ARG A 239 -3.315 -4.816 16.355 1.00 21.60 C ATOM 998 C ARG A 239 -3.460 -3.996 15.085 1.00 21.10 C ATOM 999 O ARG A 239 -3.333 -4.535 13.990 1.00 20.31 O ATOM 1000 CB ARG A 239 -4.688 -5.080 16.988 1.00 21.64 C ATOM 1001 CG ARG A 239 -5.649 -5.781 16.028 1.00 21.81 C ATOM 1002 CD ARG A 239 -7.018 -6.048 16.652 1.00 21.83 C ATOM 1003 NE ARG A 239 -6.975 -6.996 17.769 1.00 22.85 N ATOM 1004 CZ ARG A 239 -6.962 -8.324 17.651 1.00 22.25 C ATOM 1005 NH1 ARG A 239 -6.954 -8.904 16.454 1.00 22.82 N ATOM 1006 NH2 ARG A 239 -6.933 -9.080 18.745 1.00 23.07 N ATOM 0 H ARG A 239 -2.735 -3.975 18.050 1.00 22.43 H new ATOM 0 HA ARG A 239 -2.933 -5.678 16.128 1.00 21.60 H new ATOM 0 HB2 ARG A 239 -4.575 -5.624 17.783 1.00 21.64 H new ATOM 0 HB3 ARG A 239 -5.077 -4.238 17.273 1.00 21.64 H new ATOM 0 HG2 ARG A 239 -5.761 -5.236 15.233 1.00 21.81 H new ATOM 0 HG3 ARG A 239 -5.259 -6.622 15.743 1.00 21.81 H new ATOM 0 HD2 ARG A 239 -7.393 -5.209 16.963 1.00 21.83 H new ATOM 0 HD3 ARG A 239 -7.616 -6.390 15.969 1.00 21.83 H new ATOM 0 HE ARG A 239 -6.957 -6.669 18.564 1.00 22.85 H new ATOM 0 HH11 ARG A 239 -6.957 -8.421 15.742 1.00 22.82 H new ATOM 0 HH12 ARG A 239 -6.946 -9.762 16.392 1.00 22.82 H new ATOM 0 HH21 ARG A 239 -6.923 -8.712 19.522 1.00 23.07 H new ATOM 0 HH22 ARG A 239 -6.925 -9.937 18.675 1.00 23.07 H new ATOM 1007 N ASP A 240 -3.710 -2.694 15.236 1.00 20.95 N ATOM 1008 CA ASP A 240 -3.909 -1.824 14.078 1.00 21.04 C ATOM 1009 C ASP A 240 -2.607 -1.655 13.283 1.00 20.44 C ATOM 1010 O ASP A 240 -2.609 -1.762 12.058 1.00 20.44 O ATOM 1011 CB ASP A 240 -4.509 -0.476 14.494 1.00 21.67 C ATOM 1012 CG ASP A 240 -5.969 -0.589 14.949 1.00 23.63 C ATOM 1013 OD1 ASP A 240 -6.705 -1.487 14.475 1.00 24.90 O ATOM 1014 OD2 ASP A 240 -6.387 0.241 15.783 1.00 26.46 O ATOM 0 H ASP A 240 -3.768 -2.298 15.997 1.00 20.95 H new ATOM 0 HA ASP A 240 -4.550 -2.250 13.488 1.00 21.04 H new ATOM 0 HB2 ASP A 240 -3.979 -0.099 15.214 1.00 21.67 H new ATOM 0 HB3 ASP A 240 -4.454 0.141 13.748 1.00 21.67 H new ATOM 1015 N PHE A 241 -1.494 -1.429 13.981 1.00 20.12 N ATOM 1016 CA PHE A 241 -0.204 -1.314 13.307 1.00 19.58 C ATOM 1017 C PHE A 241 0.135 -2.556 12.474 1.00 19.06 C ATOM 1018 O PHE A 241 0.491 -2.453 11.295 1.00 18.09 O ATOM 1019 CB PHE A 241 0.936 -1.014 14.287 1.00 20.03 C ATOM 1020 CG PHE A 241 2.218 -0.650 13.591 1.00 21.52 C ATOM 1021 CD1 PHE A 241 2.432 0.648 13.143 1.00 22.37 C ATOM 1022 CD2 PHE A 241 3.188 -1.612 13.340 1.00 22.97 C ATOM 1023 CE1 PHE A 241 3.606 0.988 12.473 1.00 23.15 C ATOM 1024 CE2 PHE A 241 4.366 -1.283 12.667 1.00 22.94 C ATOM 1025 CZ PHE A 241 4.573 0.020 12.234 1.00 22.86 C ATOM 0 H PHE A 241 -1.465 -1.340 14.836 1.00 20.12 H new ATOM 0 HA PHE A 241 -0.292 -0.561 12.701 1.00 19.58 H new ATOM 0 HB2 PHE A 241 0.672 -0.287 14.872 1.00 20.03 H new ATOM 0 HB3 PHE A 241 1.087 -1.790 14.850 1.00 20.03 H new ATOM 0 HD1 PHE A 241 1.784 1.298 13.292 1.00 22.37 H new ATOM 0 HD2 PHE A 241 3.051 -2.487 13.624 1.00 22.97 H new ATOM 0 HE1 PHE A 241 3.742 1.862 12.186 1.00 23.15 H new ATOM 0 HE2 PHE A 241 5.010 -1.935 12.509 1.00 22.94 H new ATOM 0 HZ PHE A 241 5.356 0.244 11.786 1.00 22.86 H new ATOM 1026 N LEU A 242 0.021 -3.729 13.094 1.00 18.49 N ATOM 1027 CA LEU A 242 0.302 -4.989 12.408 1.00 18.45 C ATOM 1028 C LEU A 242 -0.669 -5.270 11.265 1.00 18.04 C ATOM 1029 O LEU A 242 -0.265 -5.809 10.239 1.00 17.84 O ATOM 1030 CB LEU A 242 0.347 -6.170 13.389 1.00 18.23 C ATOM 1031 CG LEU A 242 1.456 -6.168 14.451 1.00 19.51 C ATOM 1032 CD1 LEU A 242 1.361 -7.426 15.312 1.00 20.00 C ATOM 1033 CD2 LEU A 242 2.853 -6.037 13.859 1.00 19.42 C ATOM 0 H LEU A 242 -0.219 -3.817 13.915 1.00 18.49 H new ATOM 0 HA LEU A 242 1.182 -4.889 12.013 1.00 18.45 H new ATOM 0 HB2 LEU A 242 -0.507 -6.211 13.848 1.00 18.23 H new ATOM 0 HB3 LEU A 242 0.430 -6.986 12.871 1.00 18.23 H new ATOM 0 HG LEU A 242 1.315 -5.382 15.001 1.00 19.51 H new ATOM 0 HD11 LEU A 242 2.065 -7.416 15.979 1.00 20.00 H new ATOM 0 HD12 LEU A 242 0.498 -7.452 15.754 1.00 20.00 H new ATOM 0 HD13 LEU A 242 1.460 -8.211 14.751 1.00 20.00 H new ATOM 0 HD21 LEU A 242 3.509 -6.042 14.573 1.00 19.42 H new ATOM 0 HD22 LEU A 242 3.022 -6.781 13.260 1.00 19.42 H new ATOM 0 HD23 LEU A 242 2.919 -5.205 13.365 1.00 19.42 H new ATOM 1034 N SER A 243 -1.938 -4.887 11.426 1.00 17.99 N ATOM 1035 CA SER A 243 -2.920 -5.046 10.343 1.00 17.80 C ATOM 1036 C SER A 243 -2.465 -4.364 9.043 1.00 17.43 C ATOM 1037 O SER A 243 -2.687 -4.884 7.943 1.00 17.28 O ATOM 1038 CB SER A 243 -4.307 -4.540 10.768 1.00 18.12 C ATOM 1039 OG SER A 243 -4.376 -3.127 10.727 1.00 20.02 O ATOM 0 H SER A 243 -2.250 -4.536 12.146 1.00 17.99 H new ATOM 0 HA SER A 243 -2.986 -5.997 10.163 1.00 17.80 H new ATOM 0 HB2 SER A 243 -4.983 -4.916 10.183 1.00 18.12 H new ATOM 0 HB3 SER A 243 -4.505 -4.849 11.666 1.00 18.12 H new ATOM 0 HG SER A 243 -3.646 -2.803 10.987 1.00 20.02 H new ATOM 1040 N GLY A 244 -1.807 -3.212 9.173 1.00 16.86 N ATOM 1041 CA GLY A 244 -1.291 -2.481 8.012 1.00 16.64 C ATOM 1042 C GLY A 244 -0.243 -3.274 7.250 1.00 16.64 C ATOM 1043 O GLY A 244 -0.237 -3.304 6.013 1.00 16.23 O ATOM 0 H GLY A 244 -1.648 -2.834 9.929 1.00 16.86 H new ATOM 0 HA2 GLY A 244 -2.025 -2.264 7.417 1.00 16.64 H new ATOM 0 HA3 GLY A 244 -0.907 -1.640 8.306 1.00 16.64 H new ATOM 1044 N LEU A 245 0.645 -3.923 8.001 1.00 16.96 N ATOM 1045 CA LEU A 245 1.712 -4.733 7.428 1.00 17.21 C ATOM 1046 C LEU A 245 1.175 -5.855 6.549 1.00 17.07 C ATOM 1047 O LEU A 245 1.815 -6.234 5.574 1.00 17.40 O ATOM 1048 CB LEU A 245 2.588 -5.321 8.538 1.00 17.15 C ATOM 1049 CG LEU A 245 3.332 -4.352 9.461 1.00 18.23 C ATOM 1050 CD1 LEU A 245 4.244 -5.144 10.389 1.00 18.64 C ATOM 1051 CD2 LEU A 245 4.136 -3.323 8.668 1.00 19.10 C ATOM 0 H LEU A 245 0.643 -3.904 8.861 1.00 16.96 H new ATOM 0 HA LEU A 245 2.244 -4.147 6.867 1.00 17.21 H new ATOM 0 HB2 LEU A 245 2.026 -5.885 9.092 1.00 17.15 H new ATOM 0 HB3 LEU A 245 3.247 -5.898 8.121 1.00 17.15 H new ATOM 0 HG LEU A 245 2.679 -3.862 9.985 1.00 18.23 H new ATOM 0 HD11 LEU A 245 4.718 -4.534 10.976 1.00 18.64 H new ATOM 0 HD12 LEU A 245 3.712 -5.756 10.921 1.00 18.64 H new ATOM 0 HD13 LEU A 245 4.884 -5.647 9.862 1.00 18.64 H new ATOM 0 HD21 LEU A 245 4.593 -2.727 9.281 1.00 19.10 H new ATOM 0 HD22 LEU A 245 4.789 -3.779 8.114 1.00 19.10 H new ATOM 0 HD23 LEU A 245 3.537 -2.809 8.104 1.00 19.10 H new ATOM 1052 N ALA A 246 0.006 -6.387 6.909 1.00 17.54 N ATOM 1053 CA ALA A 246 -0.664 -7.408 6.101 1.00 17.70 C ATOM 1054 C ALA A 246 -0.893 -6.970 4.656 1.00 18.00 C ATOM 1055 O ALA A 246 -0.910 -7.807 3.751 1.00 18.29 O ATOM 1056 CB ALA A 246 -1.980 -7.848 6.754 1.00 17.64 C ATOM 0 H ALA A 246 -0.419 -6.168 7.624 1.00 17.54 H new ATOM 0 HA ALA A 246 -0.063 -8.169 6.067 1.00 17.70 H new ATOM 0 HB1 ALA A 246 -2.405 -8.523 6.202 1.00 17.64 H new ATOM 0 HB2 ALA A 246 -1.798 -8.216 7.633 1.00 17.64 H new ATOM 0 HB3 ALA A 246 -2.570 -7.083 6.841 1.00 17.64 H new ATOM 1057 N PHE A 247 -1.063 -5.662 4.445 1.00 18.27 N ATOM 1058 CA PHE A 247 -1.260 -5.101 3.106 1.00 18.50 C ATOM 1059 C PHE A 247 -0.034 -4.360 2.609 1.00 18.45 C ATOM 1060 O PHE A 247 -0.117 -3.579 1.656 1.00 18.66 O ATOM 1061 CB PHE A 247 -2.487 -4.186 3.091 1.00 19.10 C ATOM 1062 CG PHE A 247 -3.734 -4.892 3.480 1.00 19.93 C ATOM 1063 CD1 PHE A 247 -4.146 -4.925 4.808 1.00 20.35 C ATOM 1064 CD2 PHE A 247 -4.472 -5.580 2.524 1.00 20.79 C ATOM 1065 CE1 PHE A 247 -5.294 -5.622 5.177 1.00 20.70 C ATOM 1066 CE2 PHE A 247 -5.622 -6.272 2.885 1.00 21.85 C ATOM 1067 CZ PHE A 247 -6.028 -6.293 4.212 1.00 20.90 C ATOM 0 H PHE A 247 -1.067 -5.076 5.074 1.00 18.27 H new ATOM 0 HA PHE A 247 -1.409 -5.842 2.499 1.00 18.50 H new ATOM 0 HB2 PHE A 247 -2.339 -3.443 3.696 1.00 19.10 H new ATOM 0 HB3 PHE A 247 -2.596 -3.812 2.203 1.00 19.10 H new ATOM 0 HD1 PHE A 247 -3.650 -4.478 5.455 1.00 20.35 H new ATOM 0 HD2 PHE A 247 -4.194 -5.577 1.636 1.00 20.79 H new ATOM 0 HE1 PHE A 247 -5.566 -5.637 6.066 1.00 20.70 H new ATOM 0 HE2 PHE A 247 -6.118 -6.720 2.239 1.00 21.85 H new ATOM 0 HZ PHE A 247 -6.795 -6.759 4.454 1.00 20.90 H new ATOM 1068 N ARG A 248 1.101 -4.634 3.257 1.00 18.10 N ATOM 1069 CA ARG A 248 2.380 -3.985 2.962 1.00 17.99 C ATOM 1070 C ARG A 248 2.268 -2.472 3.098 1.00 17.97 C ATOM 1071 O ARG A 248 2.800 -1.712 2.287 1.00 18.08 O ATOM 1072 CB ARG A 248 2.952 -4.415 1.596 1.00 18.47 C ATOM 1073 CG ARG A 248 3.285 -5.909 1.559 1.00 18.47 C ATOM 1074 CD ARG A 248 4.206 -6.310 0.418 1.00 20.61 C ATOM 1075 NE ARG A 248 4.513 -7.742 0.526 1.00 20.66 N ATOM 1076 CZ ARG A 248 5.638 -8.325 0.117 1.00 20.65 C ATOM 1077 NH1 ARG A 248 6.601 -7.623 -0.460 1.00 20.75 N ATOM 1078 NH2 ARG A 248 5.797 -9.631 0.291 1.00 20.57 N ATOM 0 H ARG A 248 1.149 -5.213 3.891 1.00 18.10 H new ATOM 0 HA ARG A 248 3.021 -4.287 3.624 1.00 17.99 H new ATOM 0 HB2 ARG A 248 2.310 -4.210 0.898 1.00 18.47 H new ATOM 0 HB3 ARG A 248 3.752 -3.901 1.405 1.00 18.47 H new ATOM 0 HG2 ARG A 248 3.699 -6.159 2.400 1.00 18.47 H new ATOM 0 HG3 ARG A 248 2.459 -6.413 1.488 1.00 18.47 H new ATOM 0 HD2 ARG A 248 3.783 -6.122 -0.435 1.00 20.61 H new ATOM 0 HD3 ARG A 248 5.024 -5.789 0.450 1.00 20.61 H new ATOM 0 HE ARG A 248 3.916 -8.247 0.884 1.00 20.66 H new ATOM 0 HH11 ARG A 248 6.505 -6.776 -0.576 1.00 20.75 H new ATOM 0 HH12 ARG A 248 7.322 -8.014 -0.719 1.00 20.75 H new ATOM 0 HH21 ARG A 248 5.176 -10.094 0.665 1.00 20.57 H new ATOM 0 HH22 ARG A 248 6.521 -10.015 0.029 1.00 20.57 H new ATOM 1079 N VAL A 249 1.562 -2.059 4.144 1.00 18.05 N ATOM 1080 CA VAL A 249 1.427 -0.657 4.489 1.00 18.21 C ATOM 1081 C VAL A 249 2.112 -0.427 5.824 1.00 17.99 C ATOM 1082 O VAL A 249 1.796 -1.069 6.828 1.00 18.34 O ATOM 1083 CB VAL A 249 -0.051 -0.215 4.564 1.00 18.43 C ATOM 1084 CG1 VAL A 249 -0.149 1.240 5.006 1.00 18.63 C ATOM 1085 CG2 VAL A 249 -0.723 -0.400 3.220 1.00 18.80 C ATOM 0 H VAL A 249 1.146 -2.592 4.676 1.00 18.05 H new ATOM 0 HA VAL A 249 1.843 -0.124 3.794 1.00 18.21 H new ATOM 0 HB VAL A 249 -0.505 -0.768 5.218 1.00 18.43 H new ATOM 0 HG11 VAL A 249 -1.082 1.503 5.049 1.00 18.63 H new ATOM 0 HG12 VAL A 249 0.255 1.340 5.882 1.00 18.63 H new ATOM 0 HG13 VAL A 249 0.317 1.804 4.369 1.00 18.63 H new ATOM 0 HG21 VAL A 249 -1.650 -0.119 3.280 1.00 18.80 H new ATOM 0 HG22 VAL A 249 -0.266 0.136 2.553 1.00 18.80 H new ATOM 0 HG23 VAL A 249 -0.685 -1.335 2.965 1.00 18.80 H new ATOM 1086 N PHE A 250 3.068 0.487 5.814 1.00 18.27 N ATOM 1087 CA PHE A 250 3.775 0.863 7.009 1.00 18.38 C ATOM 1088 C PHE A 250 3.308 2.245 7.468 1.00 18.53 C ATOM 1089 O PHE A 250 3.410 3.219 6.726 1.00 18.87 O ATOM 1090 CB PHE A 250 5.286 0.843 6.754 1.00 18.81 C ATOM 1091 CG PHE A 250 6.094 0.675 8.004 1.00 19.31 C ATOM 1092 CD1 PHE A 250 6.539 -0.581 8.396 1.00 19.74 C ATOM 1093 CD2 PHE A 250 6.380 1.763 8.807 1.00 20.48 C ATOM 1094 CE1 PHE A 250 7.267 -0.741 9.561 1.00 20.56 C ATOM 1095 CE2 PHE A 250 7.105 1.613 9.969 1.00 20.41 C ATOM 1096 CZ PHE A 250 7.550 0.362 10.349 1.00 20.49 C ATOM 0 H PHE A 250 3.322 0.906 5.107 1.00 18.27 H new ATOM 0 HA PHE A 250 3.583 0.226 7.715 1.00 18.38 H new ATOM 0 HB2 PHE A 250 5.495 0.121 6.141 1.00 18.81 H new ATOM 0 HB3 PHE A 250 5.545 1.669 6.317 1.00 18.81 H new ATOM 0 HD1 PHE A 250 6.345 -1.323 7.869 1.00 19.74 H new ATOM 0 HD2 PHE A 250 6.079 2.608 8.560 1.00 20.48 H new ATOM 0 HE1 PHE A 250 7.565 -1.585 9.814 1.00 20.56 H new ATOM 0 HE2 PHE A 250 7.295 2.354 10.498 1.00 20.41 H new ATOM 0 HZ PHE A 250 8.039 0.260 11.133 1.00 20.49 H new ATOM 1097 N HIS A 251 2.776 2.318 8.684 1.00 19.01 N ATOM 1098 CA HIS A 251 2.339 3.595 9.251 1.00 19.45 C ATOM 1099 C HIS A 251 3.554 4.362 9.761 1.00 19.60 C ATOM 1100 O HIS A 251 4.244 3.893 10.666 1.00 19.19 O ATOM 1101 CB HIS A 251 1.332 3.373 10.382 1.00 20.01 C ATOM 1102 CG HIS A 251 0.002 2.859 9.918 1.00 20.31 C ATOM 1103 ND1 HIS A 251 -0.229 1.526 9.656 1.00 21.61 N ATOM 1104 CD2 HIS A 251 -1.170 3.498 9.684 1.00 21.70 C ATOM 1105 CE1 HIS A 251 -1.484 1.364 9.274 1.00 22.17 C ATOM 1106 NE2 HIS A 251 -2.079 2.545 9.286 1.00 22.67 N ATOM 0 H HIS A 251 2.658 1.640 9.200 1.00 19.01 H new ATOM 0 HA HIS A 251 1.898 4.113 8.560 1.00 19.45 H new ATOM 0 HB2 HIS A 251 1.707 2.745 11.019 1.00 20.01 H new ATOM 0 HB3 HIS A 251 1.199 4.210 10.854 1.00 20.01 H new ATOM 0 HD2 HIS A 251 -1.330 4.410 9.775 1.00 21.70 H new ATOM 0 HE1 HIS A 251 -1.881 0.557 9.037 1.00 22.17 H new ATOM 0 HE2 HIS A 251 -2.900 2.693 9.079 1.00 22.67 H new ATOM 1107 N CYS A 252 3.800 5.539 9.184 1.00 20.22 N ATOM 1108 CA CYS A 252 4.998 6.339 9.490 1.00 20.77 C ATOM 1109 C CYS A 252 4.670 7.696 10.085 1.00 20.65 C ATOM 1110 O CYS A 252 3.791 8.399 9.584 1.00 20.22 O ATOM 1111 CB CYS A 252 5.814 6.598 8.219 1.00 21.08 C ATOM 1112 SG CYS A 252 6.701 5.186 7.564 1.00 23.89 S ATOM 0 H CYS A 252 3.279 5.900 8.603 1.00 20.22 H new ATOM 0 HA CYS A 252 5.497 5.817 10.138 1.00 20.77 H new ATOM 0 HB2 CYS A 252 5.215 6.930 7.532 1.00 21.08 H new ATOM 0 HB3 CYS A 252 6.453 7.304 8.403 1.00 21.08 H new ATOM 0 HG CYS A 252 7.447 5.549 6.697 1.00 23.89 H new ATOM 1113 N THR A 253 5.403 8.070 11.129 1.00 20.51 N ATOM 1114 CA THR A 253 5.305 9.417 11.682 1.00 20.71 C ATOM 1115 C THR A 253 6.008 10.387 10.740 1.00 20.90 C ATOM 1116 O THR A 253 6.886 9.994 9.954 1.00 20.89 O ATOM 1117 CB THR A 253 5.874 9.516 13.116 1.00 20.62 C ATOM 1118 OG1 THR A 253 7.226 9.048 13.129 1.00 21.29 O ATOM 1119 CG2 THR A 253 5.028 8.676 14.092 1.00 20.55 C ATOM 0 H THR A 253 5.964 7.558 11.532 1.00 20.51 H new ATOM 0 HA THR A 253 4.366 9.650 11.755 1.00 20.71 H new ATOM 0 HB THR A 253 5.846 10.444 13.398 1.00 20.62 H new ATOM 0 HG1 THR A 253 7.235 8.215 13.023 1.00 21.29 H new ATOM 0 HG21 THR A 253 5.398 8.749 14.986 1.00 20.55 H new ATOM 0 HG22 THR A 253 4.115 9.003 14.093 1.00 20.55 H new ATOM 0 HG23 THR A 253 5.038 7.747 13.813 1.00 20.55 H new ATOM 1120 N GLN A 254 5.590 11.645 10.793 1.00 20.91 N ATOM 1121 CA GLN A 254 6.074 12.649 9.867 1.00 21.22 C ATOM 1122 C GLN A 254 6.877 13.762 10.557 1.00 21.37 C ATOM 1123 O GLN A 254 7.654 14.464 9.907 1.00 20.81 O ATOM 1124 CB GLN A 254 4.893 13.226 9.093 1.00 21.44 C ATOM 1125 CG GLN A 254 5.246 13.788 7.734 1.00 22.04 C ATOM 1126 CD GLN A 254 4.018 14.018 6.866 1.00 23.11 C ATOM 1127 OE1 GLN A 254 2.884 14.080 7.362 1.00 22.09 O ATOM 1128 NE2 GLN A 254 4.238 14.137 5.563 1.00 22.65 N ATOM 0 H GLN A 254 5.019 11.937 11.366 1.00 20.91 H new ATOM 0 HA GLN A 254 6.691 12.217 9.255 1.00 21.22 H new ATOM 0 HB2 GLN A 254 4.225 12.532 8.979 1.00 21.44 H new ATOM 0 HB3 GLN A 254 4.485 13.928 9.624 1.00 21.44 H new ATOM 0 HG2 GLN A 254 5.721 14.626 7.847 1.00 22.04 H new ATOM 0 HG3 GLN A 254 5.850 13.178 7.281 1.00 22.04 H new ATOM 0 HE21 GLN A 254 5.040 14.088 5.256 1.00 22.65 H new ATOM 0 HE22 GLN A 254 3.579 14.263 5.025 1.00 22.65 H new ATOM 1129 N TYR A 255 6.691 13.899 11.871 1.00 21.84 N ATOM 1130 CA TYR A 255 7.370 14.925 12.670 1.00 22.81 C ATOM 1131 C TYR A 255 8.824 14.558 12.970 1.00 23.19 C ATOM 1132 O TYR A 255 9.233 13.411 12.807 1.00 22.94 O ATOM 1133 CB TYR A 255 6.615 15.170 13.984 1.00 23.14 C ATOM 1134 CG TYR A 255 6.425 13.924 14.821 1.00 23.99 C ATOM 1135 CD1 TYR A 255 7.433 13.462 15.668 1.00 25.08 C ATOM 1136 CD2 TYR A 255 5.235 13.202 14.757 1.00 24.65 C ATOM 1137 CE1 TYR A 255 7.253 12.304 16.431 1.00 24.85 C ATOM 1138 CE2 TYR A 255 5.045 12.056 15.519 1.00 25.54 C ATOM 1139 CZ TYR A 255 6.053 11.612 16.344 1.00 24.85 C ATOM 1140 OH TYR A 255 5.852 10.470 17.093 1.00 26.09 O ATOM 0 H TYR A 255 6.164 13.396 12.328 1.00 21.84 H new ATOM 0 HA TYR A 255 7.374 15.738 12.141 1.00 22.81 H new ATOM 0 HB2 TYR A 255 7.098 15.830 14.506 1.00 23.14 H new ATOM 0 HB3 TYR A 255 5.745 15.549 13.782 1.00 23.14 H new ATOM 0 HD1 TYR A 255 8.235 13.930 15.726 1.00 25.08 H new ATOM 0 HD2 TYR A 255 4.555 13.493 14.193 1.00 24.65 H new ATOM 0 HE1 TYR A 255 7.931 12.001 16.991 1.00 24.85 H new ATOM 0 HE2 TYR A 255 4.241 11.591 15.472 1.00 25.54 H new ATOM 0 HH TYR A 255 6.552 10.006 17.090 1.00 26.09 H new ATOM 1141 N VAL A 256 9.589 15.533 13.449 1.00 23.85 N ATOM 1142 CA VAL A 256 10.997 15.320 13.771 1.00 24.46 C ATOM 1143 C VAL A 256 11.242 15.349 15.287 1.00 25.33 C ATOM 1144 O VAL A 256 10.617 16.136 16.016 1.00 24.98 O ATOM 1145 CB VAL A 256 11.904 16.371 13.061 1.00 24.49 C ATOM 1146 CG1 VAL A 256 13.395 16.150 13.388 1.00 24.52 C ATOM 1147 CG2 VAL A 256 11.688 16.339 11.541 1.00 24.58 C ATOM 0 H VAL A 256 9.309 16.333 13.596 1.00 23.85 H new ATOM 0 HA VAL A 256 11.232 14.438 13.444 1.00 24.46 H new ATOM 0 HB VAL A 256 11.649 17.245 13.397 1.00 24.49 H new ATOM 0 HG11 VAL A 256 13.929 16.819 12.932 1.00 24.52 H new ATOM 0 HG12 VAL A 256 13.531 16.226 14.345 1.00 24.52 H new ATOM 0 HG13 VAL A 256 13.664 15.266 13.093 1.00 24.52 H new ATOM 0 HG21 VAL A 256 12.260 16.999 11.119 1.00 24.58 H new ATOM 0 HG22 VAL A 256 11.907 15.457 11.201 1.00 24.58 H new ATOM 0 HG23 VAL A 256 10.760 16.541 11.341 1.00 24.58 H new ATOM 1148 N ARG A 257 12.129 14.461 15.741 1.00 26.16 N ATOM 1149 CA ARG A 257 12.769 14.514 17.065 1.00 27.61 C ATOM 1150 C ARG A 257 12.878 15.923 17.616 1.00 27.70 C ATOM 1151 O ARG A 257 13.296 16.835 16.896 1.00 27.57 O ATOM 1152 CB ARG A 257 14.220 14.051 16.933 1.00 27.71 C ATOM 1153 CG ARG A 257 14.500 12.650 17.312 1.00 29.90 C ATOM 1154 CD ARG A 257 15.593 12.144 16.397 1.00 30.58 C ATOM 1155 NE ARG A 257 16.418 11.138 17.041 1.00 32.75 N ATOM 1156 CZ ARG A 257 16.264 9.834 16.892 1.00 31.05 C ATOM 1157 NH1 ARG A 257 15.312 9.342 16.095 1.00 29.73 N ATOM 1158 NH2 ARG A 257 17.080 9.023 17.539 1.00 32.60 N ATOM 0 H ARG A 257 12.385 13.787 15.272 1.00 26.16 H new ATOM 0 HA ARG A 257 12.222 13.963 17.646 1.00 27.61 H new ATOM 0 HB2 ARG A 257 14.497 14.178 16.012 1.00 27.71 H new ATOM 0 HB3 ARG A 257 14.775 14.630 17.479 1.00 27.71 H new ATOM 0 HG2 ARG A 257 14.779 12.596 18.240 1.00 29.90 H new ATOM 0 HG3 ARG A 257 13.702 12.106 17.224 1.00 29.90 H new ATOM 0 HD2 ARG A 257 15.195 11.770 15.595 1.00 30.58 H new ATOM 0 HD3 ARG A 257 16.150 12.887 16.117 1.00 30.58 H new ATOM 0 HE ARG A 257 17.051 11.410 17.556 1.00 32.75 H new ATOM 0 HH11 ARG A 257 14.789 9.876 15.670 1.00 29.73 H new ATOM 0 HH12 ARG A 257 15.222 8.491 16.007 1.00 29.73 H new ATOM 0 HH21 ARG A 257 17.696 9.346 18.045 1.00 32.60 H new ATOM 0 HH22 ARG A 257 16.996 8.171 17.455 1.00 32.60 H new ATOM 1159 N HIS A 258 12.556 16.091 18.896 1.00 28.27 N ATOM 1160 CA HIS A 258 12.931 17.319 19.591 1.00 28.61 C ATOM 1161 C HIS A 258 14.442 17.513 19.497 1.00 28.88 C ATOM 1162 O HIS A 258 15.213 16.576 19.722 1.00 28.55 O ATOM 1163 CB HIS A 258 12.499 17.307 21.054 1.00 28.70 C ATOM 1164 CG HIS A 258 12.514 18.665 21.676 1.00 29.63 C ATOM 1165 ND1 HIS A 258 13.593 19.144 22.387 1.00 30.79 N ATOM 1166 CD2 HIS A 258 11.602 19.666 21.654 1.00 30.01 C ATOM 1167 CE1 HIS A 258 13.335 20.372 22.798 1.00 30.77 C ATOM 1168 NE2 HIS A 258 12.137 20.715 22.362 1.00 30.29 N ATOM 0 H HIS A 258 12.128 15.517 19.373 1.00 28.27 H new ATOM 0 HA HIS A 258 12.471 18.057 19.160 1.00 28.61 H new ATOM 0 HB2 HIS A 258 11.605 16.936 21.119 1.00 28.70 H new ATOM 0 HB3 HIS A 258 13.087 16.720 21.555 1.00 28.70 H new ATOM 0 HD2 HIS A 258 10.770 19.647 21.238 1.00 30.01 H new ATOM 0 HE1 HIS A 258 13.901 20.905 23.308 1.00 30.77 H new ATOM 0 HE2 HIS A 258 11.754 21.472 22.499 1.00 30.29 H new ATOM 1169 N SER A 259 14.847 18.735 19.167 1.00 29.60 N ATOM 1170 CA SER A 259 16.246 19.058 18.864 1.00 30.85 C ATOM 1171 C SER A 259 17.225 18.839 20.025 1.00 31.55 C ATOM 1172 O SER A 259 18.447 18.781 19.819 1.00 31.68 O ATOM 1173 CB SER A 259 16.343 20.498 18.357 1.00 31.04 C ATOM 1174 OG SER A 259 15.907 21.411 19.350 1.00 31.84 O ATOM 0 H SER A 259 14.316 19.409 19.111 1.00 29.60 H new ATOM 0 HA SER A 259 16.520 18.430 18.178 1.00 30.85 H new ATOM 0 HB2 SER A 259 17.259 20.697 18.109 1.00 31.04 H new ATOM 0 HB3 SER A 259 15.804 20.601 17.557 1.00 31.04 H new ATOM 0 HG SER A 259 15.413 21.992 18.999 1.00 31.84 H new ATOM 1175 N SER A 260 16.691 18.704 21.235 1.00 32.19 N ATOM 1176 CA SER A 260 17.516 18.595 22.437 1.00 33.28 C ATOM 1177 C SER A 260 18.233 17.252 22.593 1.00 33.88 C ATOM 1178 O SER A 260 19.266 17.176 23.263 1.00 33.94 O ATOM 1179 CB SER A 260 16.686 18.911 23.684 1.00 33.12 C ATOM 1180 OG SER A 260 15.786 17.860 23.972 1.00 33.71 O ATOM 0 H SER A 260 15.844 18.673 21.383 1.00 32.19 H new ATOM 0 HA SER A 260 18.220 19.254 22.333 1.00 33.28 H new ATOM 0 HB2 SER A 260 17.275 19.054 24.441 1.00 33.12 H new ATOM 0 HB3 SER A 260 16.193 19.735 23.549 1.00 33.12 H new ATOM 0 HG SER A 260 15.047 18.015 23.604 1.00 33.71 H new ATOM 1181 N ASP A 261 17.690 16.196 21.988 1.00 34.53 N ATOM 1182 CA ASP A 261 18.352 14.887 22.005 1.00 35.15 C ATOM 1183 C ASP A 261 18.249 14.178 20.648 1.00 35.07 C ATOM 1184 O ASP A 261 17.303 13.424 20.399 1.00 35.21 O ATOM 1185 CB ASP A 261 17.827 13.997 23.146 1.00 35.54 C ATOM 1186 CG ASP A 261 18.747 12.800 23.444 1.00 36.75 C ATOM 1187 OD1 ASP A 261 19.777 12.628 22.757 1.00 38.40 O ATOM 1188 OD2 ASP A 261 18.436 12.023 24.376 1.00 38.08 O ATOM 0 H ASP A 261 16.942 16.214 21.563 1.00 34.53 H new ATOM 0 HA ASP A 261 19.293 15.049 22.174 1.00 35.15 H new ATOM 0 HB2 ASP A 261 17.730 14.532 23.949 1.00 35.54 H new ATOM 0 HB3 ASP A 261 16.943 13.670 22.915 1.00 35.54 H new ATOM 1189 N PRO A 262 19.232 14.418 19.764 1.00 34.90 N ATOM 1190 CA PRO A 262 19.242 13.738 18.464 1.00 34.63 C ATOM 1191 C PRO A 262 19.671 12.274 18.571 1.00 34.41 C ATOM 1192 O PRO A 262 19.353 11.473 17.688 1.00 34.13 O ATOM 1193 CB PRO A 262 20.277 14.530 17.650 1.00 34.69 C ATOM 1194 CG PRO A 262 20.686 15.708 18.513 1.00 34.84 C ATOM 1195 CD PRO A 262 20.383 15.324 19.919 1.00 34.91 C ATOM 0 HA PRO A 262 18.358 13.718 18.066 1.00 34.63 H new ATOM 0 HB2 PRO A 262 21.044 13.977 17.434 1.00 34.69 H new ATOM 0 HB3 PRO A 262 19.899 14.832 16.809 1.00 34.69 H new ATOM 0 HG2 PRO A 262 21.630 15.905 18.404 1.00 34.84 H new ATOM 0 HG3 PRO A 262 20.198 16.507 18.260 1.00 34.84 H new ATOM 0 HD2 PRO A 262 21.136 14.882 20.342 1.00 34.91 H new ATOM 0 HD3 PRO A 262 20.164 16.096 20.464 1.00 34.91 H new ATOM 1196 N PHE A 263 20.374 11.931 19.649 1.00 33.73 N ATOM 1197 CA PHE A 263 21.004 10.618 19.781 1.00 33.57 C ATOM 1198 C PHE A 263 20.031 9.514 20.168 1.00 32.89 C ATOM 1199 O PHE A 263 20.239 8.351 19.821 1.00 32.62 O ATOM 1200 CB PHE A 263 22.152 10.674 20.791 1.00 33.88 C ATOM 1201 CG PHE A 263 23.142 11.770 20.521 1.00 34.73 C ATOM 1202 CD1 PHE A 263 24.172 11.584 19.603 1.00 35.85 C ATOM 1203 CD2 PHE A 263 23.043 12.988 21.182 1.00 35.98 C ATOM 1204 CE1 PHE A 263 25.094 12.597 19.348 1.00 36.35 C ATOM 1205 CE2 PHE A 263 23.959 14.009 20.936 1.00 36.56 C ATOM 1206 CZ PHE A 263 24.986 13.811 20.013 1.00 36.10 C ATOM 0 H PHE A 263 20.499 12.451 20.322 1.00 33.73 H new ATOM 0 HA PHE A 263 21.346 10.395 18.901 1.00 33.57 H new ATOM 0 HB2 PHE A 263 21.784 10.794 21.680 1.00 33.88 H new ATOM 0 HB3 PHE A 263 22.616 9.822 20.788 1.00 33.88 H new ATOM 0 HD1 PHE A 263 24.246 10.773 19.154 1.00 35.85 H new ATOM 0 HD2 PHE A 263 22.358 13.124 21.796 1.00 35.98 H new ATOM 0 HE1 PHE A 263 25.779 12.460 18.734 1.00 36.35 H new ATOM 0 HE2 PHE A 263 23.886 14.820 21.386 1.00 36.56 H new ATOM 0 HZ PHE A 263 25.597 14.491 19.843 1.00 36.10 H new ATOM 1207 N TYR A 264 18.990 9.884 20.912 1.00 32.29 N ATOM 1208 CA TYR A 264 17.947 8.949 21.324 1.00 31.99 C ATOM 1209 C TYR A 264 16.629 9.680 21.578 1.00 31.76 C ATOM 1210 O TYR A 264 16.611 10.806 22.083 1.00 31.86 O ATOM 1211 CB TYR A 264 18.367 8.152 22.573 1.00 32.03 C ATOM 1212 CG TYR A 264 17.259 7.281 23.142 1.00 32.26 C ATOM 1213 CD1 TYR A 264 16.408 7.762 24.139 1.00 32.21 C ATOM 1214 CD2 TYR A 264 17.050 5.985 22.669 1.00 31.79 C ATOM 1215 CE1 TYR A 264 15.379 6.970 24.652 1.00 32.26 C ATOM 1216 CE2 TYR A 264 16.024 5.183 23.176 1.00 32.26 C ATOM 1217 CZ TYR A 264 15.195 5.682 24.167 1.00 32.24 C ATOM 1218 OH TYR A 264 14.182 4.896 24.671 1.00 32.32 O ATOM 0 H TYR A 264 18.869 10.688 21.193 1.00 32.29 H new ATOM 0 HA TYR A 264 17.817 8.320 20.597 1.00 31.99 H new ATOM 0 HB2 TYR A 264 19.126 7.591 22.349 1.00 32.03 H new ATOM 0 HB3 TYR A 264 18.664 8.772 23.258 1.00 32.03 H new ATOM 0 HD1 TYR A 264 16.529 8.624 24.467 1.00 32.21 H new ATOM 0 HD2 TYR A 264 17.605 5.648 22.003 1.00 31.79 H new ATOM 0 HE1 TYR A 264 14.819 7.304 25.316 1.00 32.26 H new ATOM 0 HE2 TYR A 264 15.899 4.321 22.850 1.00 32.26 H new ATOM 0 HH TYR A 264 13.545 5.384 24.918 1.00 32.32 H new ATOM 1219 N THR A 265 15.526 9.030 21.224 1.00 31.28 N ATOM 1220 CA THR A 265 14.196 9.546 21.524 1.00 30.79 C ATOM 1221 C THR A 265 13.270 8.379 21.892 1.00 30.56 C ATOM 1222 O THR A 265 13.275 7.345 21.213 1.00 30.08 O ATOM 1223 CB THR A 265 13.629 10.407 20.358 1.00 30.94 C ATOM 1224 OG1 THR A 265 12.354 10.945 20.724 1.00 31.39 O ATOM 1225 CG2 THR A 265 13.487 9.583 19.064 1.00 30.60 C ATOM 0 H THR A 265 15.527 8.279 20.804 1.00 31.28 H new ATOM 0 HA THR A 265 14.255 10.144 22.286 1.00 30.79 H new ATOM 0 HB THR A 265 14.256 11.128 20.191 1.00 30.94 H new ATOM 0 HG1 THR A 265 11.925 11.146 20.030 1.00 31.39 H new ATOM 0 HG21 THR A 265 13.132 10.146 18.359 1.00 30.60 H new ATOM 0 HG22 THR A 265 14.356 9.243 18.800 1.00 30.60 H new ATOM 0 HG23 THR A 265 12.883 8.840 19.218 1.00 30.60 H new ATOM 1226 N PRO A 266 12.492 8.526 22.986 1.00 30.18 N ATOM 1227 CA PRO A 266 11.624 7.429 23.425 1.00 30.03 C ATOM 1228 C PRO A 266 10.435 7.174 22.500 1.00 29.64 C ATOM 1229 O PRO A 266 9.821 6.110 22.572 1.00 29.96 O ATOM 1230 CB PRO A 266 11.140 7.892 24.805 1.00 30.17 C ATOM 1231 CG PRO A 266 11.208 9.389 24.738 1.00 30.56 C ATOM 1232 CD PRO A 266 12.395 9.701 23.877 1.00 30.13 C ATOM 0 HA PRO A 266 12.103 6.586 23.430 1.00 30.03 H new ATOM 0 HB2 PRO A 266 10.237 7.586 24.984 1.00 30.17 H new ATOM 0 HB3 PRO A 266 11.704 7.543 25.513 1.00 30.17 H new ATOM 0 HG2 PRO A 266 10.395 9.758 24.359 1.00 30.56 H new ATOM 0 HG3 PRO A 266 11.308 9.774 25.623 1.00 30.56 H new ATOM 0 HD2 PRO A 266 12.266 10.521 23.375 1.00 30.13 H new ATOM 0 HD3 PRO A 266 13.200 9.816 24.406 1.00 30.13 H new ATOM 1233 N GLU A 267 10.115 8.135 21.639 1.00 29.17 N ATOM 1234 CA GLU A 267 9.025 7.957 20.684 1.00 28.78 C ATOM 1235 C GLU A 267 9.539 7.951 19.242 1.00 27.91 C ATOM 1236 O GLU A 267 10.539 8.609 18.938 1.00 27.68 O ATOM 1237 CB GLU A 267 7.935 9.022 20.870 1.00 29.27 C ATOM 1238 CG GLU A 267 8.415 10.455 20.804 1.00 30.59 C ATOM 1239 CD GLU A 267 7.294 11.439 20.522 1.00 32.64 C ATOM 1240 OE1 GLU A 267 7.607 12.568 20.092 1.00 33.88 O ATOM 1241 OE2 GLU A 267 6.105 11.093 20.723 1.00 33.71 O ATOM 0 H GLU A 267 10.515 8.895 21.591 1.00 29.17 H new ATOM 0 HA GLU A 267 8.627 7.090 20.862 1.00 28.78 H new ATOM 0 HB2 GLU A 267 7.257 8.892 20.189 1.00 29.27 H new ATOM 0 HB3 GLU A 267 7.507 8.879 21.728 1.00 29.27 H new ATOM 0 HG2 GLU A 267 8.841 10.688 21.644 1.00 30.59 H new ATOM 0 HG3 GLU A 267 9.090 10.534 20.112 1.00 30.59 H new ATOM 1242 N PRO A 268 8.859 7.205 18.351 1.00 27.04 N ATOM 1243 CA PRO A 268 9.292 7.185 16.952 1.00 26.29 C ATOM 1244 C PRO A 268 9.011 8.515 16.262 1.00 25.23 C ATOM 1245 O PRO A 268 7.935 9.096 16.439 1.00 26.05 O ATOM 1246 CB PRO A 268 8.451 6.060 16.326 1.00 26.32 C ATOM 1247 CG PRO A 268 7.775 5.364 17.466 1.00 26.94 C ATOM 1248 CD PRO A 268 7.684 6.348 18.575 1.00 27.02 C ATOM 0 HA PRO A 268 10.247 7.041 16.863 1.00 26.29 H new ATOM 0 HB2 PRO A 268 7.800 6.419 15.704 1.00 26.32 H new ATOM 0 HB3 PRO A 268 9.011 5.445 15.827 1.00 26.32 H new ATOM 0 HG2 PRO A 268 6.893 5.055 17.206 1.00 26.94 H new ATOM 0 HG3 PRO A 268 8.280 4.582 17.740 1.00 26.94 H new ATOM 0 HD2 PRO A 268 6.858 6.855 18.539 1.00 27.02 H new ATOM 0 HD3 PRO A 268 7.715 5.916 19.443 1.00 27.02 H new ATOM 1249 N ASP A 269 9.985 8.998 15.500 1.00 23.80 N ATOM 1250 CA ASP A 269 9.816 10.202 14.696 1.00 22.33 C ATOM 1251 C ASP A 269 10.085 9.849 13.237 1.00 21.22 C ATOM 1252 O ASP A 269 10.306 8.683 12.918 1.00 21.24 O ATOM 1253 CB ASP A 269 10.746 11.323 15.178 1.00 22.10 C ATOM 1254 CG ASP A 269 12.208 11.082 14.816 1.00 21.75 C ATOM 1255 OD1 ASP A 269 12.625 9.915 14.696 1.00 20.84 O ATOM 1256 OD2 ASP A 269 12.945 12.078 14.656 1.00 22.22 O ATOM 0 H ASP A 269 10.763 8.637 15.434 1.00 23.80 H new ATOM 0 HA ASP A 269 8.909 10.532 14.788 1.00 22.33 H new ATOM 0 HB2 ASP A 269 10.457 12.165 14.792 1.00 22.10 H new ATOM 0 HB3 ASP A 269 10.667 11.411 16.141 1.00 22.10 H new ATOM 1257 N THR A 270 10.071 10.842 12.357 1.00 20.40 N ATOM 1258 CA THR A 270 10.275 10.571 10.940 1.00 20.00 C ATOM 1259 C THR A 270 11.712 10.111 10.637 1.00 20.00 C ATOM 1260 O THR A 270 11.923 9.322 9.720 1.00 19.39 O ATOM 1261 CB THR A 270 9.791 11.732 10.024 1.00 20.03 C ATOM 1262 OG1 THR A 270 9.444 11.217 8.730 1.00 19.65 O ATOM 1263 CG2 THR A 270 10.835 12.835 9.880 1.00 20.04 C ATOM 0 H THR A 270 9.947 11.670 12.555 1.00 20.40 H new ATOM 0 HA THR A 270 9.703 9.820 10.718 1.00 20.00 H new ATOM 0 HB THR A 270 9.012 12.127 10.445 1.00 20.03 H new ATOM 0 HG1 THR A 270 8.711 10.809 8.778 1.00 19.65 H new ATOM 0 HG21 THR A 270 10.490 13.534 9.303 1.00 20.04 H new ATOM 0 HG22 THR A 270 11.036 13.207 10.753 1.00 20.04 H new ATOM 0 HG23 THR A 270 11.644 12.466 9.493 1.00 20.04 H new ATOM 1264 N CYS A 271 12.684 10.594 11.421 1.00 19.98 N ATOM 1265 CA CYS A 271 14.070 10.137 11.290 1.00 20.32 C ATOM 1266 C CYS A 271 14.144 8.620 11.450 1.00 19.87 C ATOM 1267 O CYS A 271 14.775 7.932 10.646 1.00 20.28 O ATOM 1268 CB CYS A 271 14.974 10.816 12.321 1.00 20.37 C ATOM 1269 SG CYS A 271 15.075 12.607 12.140 1.00 23.21 S ATOM 0 H CYS A 271 12.560 11.185 12.033 1.00 19.98 H new ATOM 0 HA CYS A 271 14.383 10.379 10.404 1.00 20.32 H new ATOM 0 HB2 CYS A 271 14.648 10.608 13.211 1.00 20.37 H new ATOM 0 HB3 CYS A 271 15.866 10.442 12.251 1.00 20.37 H new ATOM 0 HG CYS A 271 15.799 13.055 12.986 1.00 23.21 H new ATOM 1270 N HIS A 272 13.489 8.114 12.492 1.00 19.41 N ATOM 1271 CA HIS A 272 13.373 6.678 12.733 1.00 18.64 C ATOM 1272 C HIS A 272 12.734 5.909 11.577 1.00 18.31 C ATOM 1273 O HIS A 272 13.237 4.851 11.186 1.00 18.12 O ATOM 1274 CB HIS A 272 12.607 6.404 14.030 1.00 18.53 C ATOM 1275 CG HIS A 272 12.204 4.973 14.192 1.00 18.47 C ATOM 1276 ND1 HIS A 272 13.115 3.962 14.422 1.00 17.34 N ATOM 1277 CD2 HIS A 272 10.990 4.380 14.120 1.00 17.29 C ATOM 1278 CE1 HIS A 272 12.474 2.809 14.497 1.00 17.30 C ATOM 1279 NE2 HIS A 272 11.185 3.037 14.325 1.00 17.28 N ATOM 0 H HIS A 272 13.096 8.599 13.084 1.00 19.41 H new ATOM 0 HA HIS A 272 14.283 6.352 12.813 1.00 18.64 H new ATOM 0 HB2 HIS A 272 13.158 6.665 14.784 1.00 18.53 H new ATOM 0 HB3 HIS A 272 11.813 6.961 14.053 1.00 18.53 H new ATOM 0 HD1 HIS A 272 13.965 4.066 14.504 1.00 17.34 H new ATOM 0 HD2 HIS A 272 10.177 4.803 13.962 1.00 17.29 H new ATOM 0 HE1 HIS A 272 12.864 1.978 14.646 1.00 17.30 H new ATOM 1280 N GLU A 273 11.630 6.424 11.039 1.00 17.75 N ATOM 1281 CA GLU A 273 10.961 5.742 9.930 1.00 17.95 C ATOM 1282 C GLU A 273 11.875 5.693 8.709 1.00 17.72 C ATOM 1283 O GLU A 273 12.033 4.644 8.076 1.00 17.79 O ATOM 1284 CB GLU A 273 9.634 6.426 9.560 1.00 17.98 C ATOM 1285 CG GLU A 273 8.781 6.919 10.748 1.00 18.57 C ATOM 1286 CD GLU A 273 8.198 5.811 11.631 1.00 20.07 C ATOM 1287 OE1 GLU A 273 7.316 6.125 12.460 1.00 21.17 O ATOM 1288 OE2 GLU A 273 8.601 4.633 11.516 1.00 20.40 O ATOM 0 H GLU A 273 11.256 7.155 11.295 1.00 17.75 H new ATOM 0 HA GLU A 273 10.762 4.838 10.221 1.00 17.95 H new ATOM 0 HB2 GLU A 273 9.829 7.184 8.987 1.00 17.98 H new ATOM 0 HB3 GLU A 273 9.103 5.804 9.038 1.00 17.98 H new ATOM 0 HG2 GLU A 273 9.326 7.501 11.300 1.00 18.57 H new ATOM 0 HG3 GLU A 273 8.051 7.457 10.403 1.00 18.57 H new ATOM 1289 N LEU A 274 12.497 6.829 8.407 1.00 17.17 N ATOM 1290 CA LEU A 274 13.254 6.996 7.171 1.00 17.25 C ATOM 1291 C LEU A 274 14.621 6.331 7.197 1.00 17.27 C ATOM 1292 O LEU A 274 15.048 5.740 6.201 1.00 17.64 O ATOM 1293 CB LEU A 274 13.416 8.481 6.841 1.00 17.06 C ATOM 1294 CG LEU A 274 12.164 9.319 6.536 1.00 17.19 C ATOM 1295 CD1 LEU A 274 12.566 10.794 6.535 1.00 16.91 C ATOM 1296 CD2 LEU A 274 11.542 8.931 5.203 1.00 17.61 C ATOM 0 H LEU A 274 12.492 7.524 8.913 1.00 17.17 H new ATOM 0 HA LEU A 274 12.737 6.551 6.481 1.00 17.25 H new ATOM 0 HB2 LEU A 274 13.873 8.899 7.588 1.00 17.06 H new ATOM 0 HB3 LEU A 274 14.007 8.548 6.074 1.00 17.06 H new ATOM 0 HG LEU A 274 11.493 9.154 7.217 1.00 17.19 H new ATOM 0 HD11 LEU A 274 11.788 11.341 6.344 1.00 16.91 H new ATOM 0 HD12 LEU A 274 12.923 11.033 7.405 1.00 16.91 H new ATOM 0 HD13 LEU A 274 13.242 10.945 5.856 1.00 16.91 H new ATOM 0 HD21 LEU A 274 10.757 9.477 5.041 1.00 17.61 H new ATOM 0 HD22 LEU A 274 12.186 9.073 4.492 1.00 17.61 H new ATOM 0 HD23 LEU A 274 11.286 7.996 5.225 1.00 17.61 H new ATOM 1297 N LEU A 275 15.322 6.447 8.317 1.00 17.70 N ATOM 1298 CA LEU A 275 16.659 5.850 8.424 1.00 18.41 C ATOM 1299 C LEU A 275 16.636 4.445 9.005 1.00 18.54 C ATOM 1300 O LEU A 275 17.492 3.631 8.682 1.00 19.26 O ATOM 1301 CB LEU A 275 17.601 6.758 9.223 1.00 18.55 C ATOM 1302 CG LEU A 275 17.996 8.060 8.516 1.00 19.85 C ATOM 1303 CD1 LEU A 275 18.598 9.071 9.486 1.00 20.19 C ATOM 1304 CD2 LEU A 275 18.933 7.792 7.322 1.00 20.39 C ATOM 0 H LEU A 275 15.052 6.860 9.021 1.00 17.70 H new ATOM 0 HA LEU A 275 16.998 5.768 7.519 1.00 18.41 H new ATOM 0 HB2 LEU A 275 17.177 6.979 10.067 1.00 18.55 H new ATOM 0 HB3 LEU A 275 18.407 6.261 9.432 1.00 18.55 H new ATOM 0 HG LEU A 275 17.182 8.453 8.164 1.00 19.85 H new ATOM 0 HD11 LEU A 275 18.835 9.879 9.005 1.00 20.19 H new ATOM 0 HD12 LEU A 275 17.950 9.284 10.176 1.00 20.19 H new ATOM 0 HD13 LEU A 275 19.393 8.694 9.895 1.00 20.19 H new ATOM 0 HD21 LEU A 275 19.164 8.633 6.897 1.00 20.39 H new ATOM 0 HD22 LEU A 275 19.741 7.356 7.636 1.00 20.39 H new ATOM 0 HD23 LEU A 275 18.485 7.219 6.681 1.00 20.39 H new ATOM 1305 N GLY A 276 15.669 4.169 9.870 1.00 18.57 N ATOM 1306 CA GLY A 276 15.547 2.852 10.490 1.00 18.66 C ATOM 1307 C GLY A 276 14.802 1.831 9.651 1.00 18.67 C ATOM 1308 O GLY A 276 15.314 0.735 9.396 1.00 19.11 O ATOM 0 H GLY A 276 15.068 4.734 10.114 1.00 18.57 H new ATOM 0 HA2 GLY A 276 16.436 2.512 10.680 1.00 18.66 H new ATOM 0 HA3 GLY A 276 15.093 2.948 11.342 1.00 18.66 H new ATOM 1309 N HIS A 277 13.586 2.178 9.233 1.00 18.43 N ATOM 1310 CA HIS A 277 12.706 1.221 8.553 1.00 17.79 C ATOM 1311 C HIS A 277 12.858 1.116 7.039 1.00 17.72 C ATOM 1312 O HIS A 277 12.956 0.011 6.495 1.00 17.54 O ATOM 1313 CB HIS A 277 11.240 1.505 8.897 1.00 17.48 C ATOM 1314 CG HIS A 277 10.863 1.098 10.286 1.00 17.44 C ATOM 1315 ND1 HIS A 277 10.737 -0.221 10.662 1.00 16.71 N ATOM 1316 CD2 HIS A 277 10.583 1.833 11.388 1.00 16.10 C ATOM 1317 CE1 HIS A 277 10.398 -0.282 11.938 1.00 16.86 C ATOM 1318 NE2 HIS A 277 10.297 0.950 12.403 1.00 15.82 N ATOM 0 H HIS A 277 13.249 2.963 9.332 1.00 18.43 H new ATOM 0 HA HIS A 277 12.994 0.360 8.894 1.00 17.79 H new ATOM 0 HB2 HIS A 277 11.067 2.453 8.788 1.00 17.48 H new ATOM 0 HB3 HIS A 277 10.671 1.038 8.265 1.00 17.48 H new ATOM 0 HD1 HIS A 277 10.860 -0.899 10.147 1.00 16.71 H new ATOM 0 HD2 HIS A 277 10.584 2.761 11.448 1.00 16.10 H new ATOM 0 HE1 HIS A 277 10.255 -1.061 12.426 1.00 16.86 H new ATOM 1319 N VAL A 278 12.869 2.260 6.362 1.00 17.29 N ATOM 1320 CA VAL A 278 12.741 2.295 4.903 1.00 17.40 C ATOM 1321 C VAL A 278 13.770 1.431 4.135 1.00 17.85 C ATOM 1322 O VAL A 278 13.371 0.670 3.258 1.00 17.83 O ATOM 1323 CB VAL A 278 12.601 3.744 4.356 1.00 17.53 C ATOM 1324 CG1 VAL A 278 12.739 3.794 2.827 1.00 16.77 C ATOM 1325 CG2 VAL A 278 11.239 4.339 4.780 1.00 16.20 C ATOM 0 H VAL A 278 12.950 3.033 6.729 1.00 17.29 H new ATOM 0 HA VAL A 278 11.899 1.851 4.715 1.00 17.40 H new ATOM 0 HB VAL A 278 13.321 4.272 4.735 1.00 17.53 H new ATOM 0 HG11 VAL A 278 12.646 4.711 2.523 1.00 16.77 H new ATOM 0 HG12 VAL A 278 13.610 3.455 2.569 1.00 16.77 H new ATOM 0 HG13 VAL A 278 12.047 3.248 2.421 1.00 16.77 H new ATOM 0 HG21 VAL A 278 11.159 5.242 4.435 1.00 16.20 H new ATOM 0 HG22 VAL A 278 10.522 3.792 4.423 1.00 16.20 H new ATOM 0 HG23 VAL A 278 11.181 4.356 5.748 1.00 16.20 H new ATOM 1326 N PRO A 279 15.081 1.528 4.471 1.00 18.75 N ATOM 1327 CA PRO A 279 16.059 0.729 3.708 1.00 19.28 C ATOM 1328 C PRO A 279 15.816 -0.784 3.754 1.00 19.79 C ATOM 1329 O PRO A 279 16.148 -1.484 2.801 1.00 20.39 O ATOM 1330 CB PRO A 279 17.400 1.073 4.367 1.00 19.23 C ATOM 1331 CG PRO A 279 17.168 2.401 5.042 1.00 19.09 C ATOM 1332 CD PRO A 279 15.741 2.347 5.506 1.00 18.76 C ATOM 0 HA PRO A 279 16.007 0.943 2.763 1.00 19.28 H new ATOM 0 HB2 PRO A 279 17.662 0.393 5.008 1.00 19.23 H new ATOM 0 HB3 PRO A 279 18.111 1.132 3.709 1.00 19.23 H new ATOM 0 HG2 PRO A 279 17.776 2.529 5.787 1.00 19.09 H new ATOM 0 HG3 PRO A 279 17.312 3.138 4.428 1.00 19.09 H new ATOM 0 HD2 PRO A 279 15.665 1.943 6.385 1.00 18.76 H new ATOM 0 HD3 PRO A 279 15.350 3.233 5.566 1.00 18.76 H new ATOM 1333 N LEU A 280 15.235 -1.281 4.839 1.00 19.87 N ATOM 1334 CA LEU A 280 14.943 -2.710 4.923 1.00 19.75 C ATOM 1335 C LEU A 280 13.598 -3.105 4.314 1.00 19.50 C ATOM 1336 O LEU A 280 13.453 -4.211 3.794 1.00 19.41 O ATOM 1337 CB LEU A 280 15.121 -3.222 6.348 1.00 20.02 C ATOM 1338 CG LEU A 280 16.624 -3.322 6.648 1.00 20.53 C ATOM 1339 CD1 LEU A 280 16.879 -3.363 8.124 1.00 21.89 C ATOM 1340 CD2 LEU A 280 17.244 -4.531 5.950 1.00 22.17 C ATOM 0 H LEU A 280 15.005 -0.819 5.527 1.00 19.87 H new ATOM 0 HA LEU A 280 15.599 -3.157 4.366 1.00 19.75 H new ATOM 0 HB2 LEU A 280 14.691 -2.622 6.978 1.00 20.02 H new ATOM 0 HB3 LEU A 280 14.699 -4.089 6.449 1.00 20.02 H new ATOM 0 HG LEU A 280 17.050 -2.525 6.296 1.00 20.53 H new ATOM 0 HD11 LEU A 280 17.833 -3.426 8.286 1.00 21.89 H new ATOM 0 HD12 LEU A 280 16.534 -2.555 8.535 1.00 21.89 H new ATOM 0 HD13 LEU A 280 16.435 -4.135 8.508 1.00 21.89 H new ATOM 0 HD21 LEU A 280 18.191 -4.572 6.154 1.00 22.17 H new ATOM 0 HD22 LEU A 280 16.811 -5.341 6.261 1.00 22.17 H new ATOM 0 HD23 LEU A 280 17.124 -4.448 4.991 1.00 22.17 H new ATOM 1341 N LEU A 281 12.631 -2.192 4.346 1.00 19.29 N ATOM 1342 CA LEU A 281 11.353 -2.410 3.657 1.00 18.95 C ATOM 1343 C LEU A 281 11.553 -2.516 2.140 1.00 19.01 C ATOM 1344 O LEU A 281 10.712 -3.068 1.434 1.00 18.58 O ATOM 1345 CB LEU A 281 10.345 -1.304 4.002 1.00 19.07 C ATOM 1346 CG LEU A 281 9.924 -1.143 5.473 1.00 18.04 C ATOM 1347 CD1 LEU A 281 8.980 0.055 5.650 1.00 19.09 C ATOM 1348 CD2 LEU A 281 9.286 -2.403 6.049 1.00 18.75 C ATOM 0 H LEU A 281 12.691 -1.440 4.759 1.00 19.29 H new ATOM 0 HA LEU A 281 10.990 -3.254 3.968 1.00 18.95 H new ATOM 0 HB2 LEU A 281 10.718 -0.459 3.706 1.00 19.07 H new ATOM 0 HB3 LEU A 281 9.543 -1.459 3.479 1.00 19.07 H new ATOM 0 HG LEU A 281 10.741 -0.981 5.971 1.00 18.04 H new ATOM 0 HD11 LEU A 281 8.730 0.135 6.584 1.00 19.09 H new ATOM 0 HD12 LEU A 281 9.429 0.866 5.366 1.00 19.09 H new ATOM 0 HD13 LEU A 281 8.184 -0.078 5.113 1.00 19.09 H new ATOM 0 HD21 LEU A 281 9.041 -2.248 6.974 1.00 18.75 H new ATOM 0 HD22 LEU A 281 8.493 -2.627 5.538 1.00 18.75 H new ATOM 0 HD23 LEU A 281 9.919 -3.137 6.002 1.00 18.75 H new ATOM 1349 N ALA A 282 12.684 -1.998 1.662 1.00 18.92 N ATOM 1350 CA ALA A 282 13.061 -2.053 0.256 1.00 19.51 C ATOM 1351 C ALA A 282 13.668 -3.403 -0.127 1.00 20.03 C ATOM 1352 O ALA A 282 13.943 -3.651 -1.306 1.00 20.30 O ATOM 1353 CB ALA A 282 14.045 -0.911 -0.069 1.00 19.52 C ATOM 0 H ALA A 282 13.262 -1.598 2.157 1.00 18.92 H new ATOM 0 HA ALA A 282 12.253 -1.944 -0.269 1.00 19.51 H new ATOM 0 HB1 ALA A 282 14.292 -0.953 -1.006 1.00 19.52 H new ATOM 0 HB2 ALA A 282 13.623 -0.057 0.116 1.00 19.52 H new ATOM 0 HB3 ALA A 282 14.840 -1.003 0.479 1.00 19.52 H new ATOM 1354 N GLU A 283 13.874 -4.269 0.865 1.00 20.35 N ATOM 1355 CA GLU A 283 14.447 -5.596 0.627 1.00 20.76 C ATOM 1356 C GLU A 283 13.352 -6.678 0.592 1.00 20.50 C ATOM 1357 O GLU A 283 12.651 -6.870 1.583 1.00 20.42 O ATOM 1358 CB GLU A 283 15.484 -5.914 1.706 1.00 21.14 C ATOM 1359 CG GLU A 283 16.287 -7.209 1.468 1.00 23.47 C ATOM 1360 CD GLU A 283 17.294 -7.109 0.319 1.00 26.71 C ATOM 1361 OE1 GLU A 283 17.544 -5.994 -0.193 1.00 26.98 O ATOM 1362 OE2 GLU A 283 17.832 -8.166 -0.080 1.00 27.36 O ATOM 0 H GLU A 283 13.688 -4.107 1.689 1.00 20.35 H new ATOM 0 HA GLU A 283 14.882 -5.591 -0.240 1.00 20.76 H new ATOM 0 HB2 GLU A 283 16.104 -5.171 1.770 1.00 21.14 H new ATOM 0 HB3 GLU A 283 15.032 -5.981 2.562 1.00 21.14 H new ATOM 0 HG2 GLU A 283 16.760 -7.441 2.282 1.00 23.47 H new ATOM 0 HG3 GLU A 283 15.669 -7.934 1.283 1.00 23.47 H new ATOM 1363 N PRO A 284 13.192 -7.369 -0.556 1.00 20.62 N ATOM 1364 CA PRO A 284 12.140 -8.387 -0.708 1.00 20.72 C ATOM 1365 C PRO A 284 12.024 -9.410 0.437 1.00 20.51 C ATOM 1366 O PRO A 284 10.910 -9.680 0.889 1.00 20.12 O ATOM 1367 CB PRO A 284 12.495 -9.074 -2.033 1.00 20.95 C ATOM 1368 CG PRO A 284 13.209 -8.035 -2.806 1.00 21.12 C ATOM 1369 CD PRO A 284 13.967 -7.195 -1.802 1.00 20.54 C ATOM 0 HA PRO A 284 11.267 -7.965 -0.691 1.00 20.72 H new ATOM 0 HB2 PRO A 284 13.054 -9.854 -1.889 1.00 20.95 H new ATOM 0 HB3 PRO A 284 11.700 -9.377 -2.498 1.00 20.95 H new ATOM 0 HG2 PRO A 284 13.816 -8.438 -3.447 1.00 21.12 H new ATOM 0 HG3 PRO A 284 12.585 -7.490 -3.310 1.00 21.12 H new ATOM 0 HD2 PRO A 284 14.882 -7.500 -1.699 1.00 20.54 H new ATOM 0 HD3 PRO A 284 14.006 -6.264 -2.072 1.00 20.54 H new ATOM 1370 N SER A 285 13.142 -9.961 0.917 1.00 20.44 N ATOM 1371 CA SER A 285 13.060 -10.978 1.979 1.00 20.54 C ATOM 1372 C SER A 285 12.520 -10.379 3.282 1.00 20.40 C ATOM 1373 O SER A 285 11.742 -11.014 4.003 1.00 20.50 O ATOM 1374 CB SER A 285 14.418 -11.648 2.228 1.00 20.69 C ATOM 1375 OG SER A 285 15.376 -10.706 2.661 1.00 20.89 O ATOM 0 H SER A 285 13.938 -9.769 0.653 1.00 20.44 H new ATOM 0 HA SER A 285 12.440 -11.658 1.672 1.00 20.54 H new ATOM 0 HB2 SER A 285 14.321 -12.345 2.895 1.00 20.69 H new ATOM 0 HB3 SER A 285 14.725 -12.076 1.413 1.00 20.69 H new ATOM 0 HG SER A 285 15.676 -10.286 1.998 1.00 20.89 H new ATOM 1376 N PHE A 286 12.944 -9.157 3.580 1.00 19.87 N ATOM 1377 CA PHE A 286 12.490 -8.471 4.784 1.00 19.56 C ATOM 1378 C PHE A 286 11.030 -8.036 4.681 1.00 19.05 C ATOM 1379 O PHE A 286 10.293 -8.092 5.662 1.00 18.44 O ATOM 1380 CB PHE A 286 13.362 -7.253 5.076 1.00 19.91 C ATOM 1381 CG PHE A 286 13.088 -6.634 6.411 1.00 21.16 C ATOM 1382 CD1 PHE A 286 13.695 -7.135 7.557 1.00 20.99 C ATOM 1383 CD2 PHE A 286 12.192 -5.572 6.533 1.00 21.53 C ATOM 1384 CE1 PHE A 286 13.434 -6.574 8.804 1.00 22.50 C ATOM 1385 CE2 PHE A 286 11.928 -5.004 7.783 1.00 21.60 C ATOM 1386 CZ PHE A 286 12.553 -5.509 8.915 1.00 22.11 C ATOM 0 H PHE A 286 13.496 -8.706 3.098 1.00 19.87 H new ATOM 0 HA PHE A 286 12.566 -9.107 5.513 1.00 19.56 H new ATOM 0 HB2 PHE A 286 14.295 -7.514 5.033 1.00 19.91 H new ATOM 0 HB3 PHE A 286 13.221 -6.589 4.383 1.00 19.91 H new ATOM 0 HD1 PHE A 286 14.282 -7.853 7.490 1.00 20.99 H new ATOM 0 HD2 PHE A 286 11.766 -5.239 5.776 1.00 21.53 H new ATOM 0 HE1 PHE A 286 13.851 -6.914 9.563 1.00 22.50 H new ATOM 0 HE2 PHE A 286 11.336 -4.291 7.856 1.00 21.60 H new ATOM 0 HZ PHE A 286 12.381 -5.133 9.748 1.00 22.11 H new ATOM 1387 N ALA A 287 10.629 -7.584 3.498 1.00 18.63 N ATOM 1388 CA ALA A 287 9.237 -7.165 3.267 1.00 18.82 C ATOM 1389 C ALA A 287 8.270 -8.336 3.420 1.00 18.84 C ATOM 1390 O ALA A 287 7.167 -8.182 3.956 1.00 19.38 O ATOM 1391 CB ALA A 287 9.100 -6.529 1.889 1.00 18.37 C ATOM 0 H ALA A 287 11.142 -7.510 2.812 1.00 18.63 H new ATOM 0 HA ALA A 287 9.006 -6.505 3.940 1.00 18.82 H new ATOM 0 HB1 ALA A 287 8.180 -6.257 1.748 1.00 18.37 H new ATOM 0 HB2 ALA A 287 9.679 -5.752 1.832 1.00 18.37 H new ATOM 0 HB3 ALA A 287 9.355 -7.172 1.209 1.00 18.37 H new ATOM 1392 N GLN A 288 8.693 -9.504 2.948 1.00 18.71 N ATOM 1393 CA GLN A 288 7.910 -10.735 3.101 1.00 18.71 C ATOM 1394 C GLN A 288 7.772 -11.105 4.576 1.00 18.32 C ATOM 1395 O GLN A 288 6.675 -11.424 5.042 1.00 17.57 O ATOM 1396 CB GLN A 288 8.555 -11.877 2.313 1.00 18.76 C ATOM 1397 CG GLN A 288 7.736 -13.170 2.272 1.00 20.06 C ATOM 1398 CD GLN A 288 6.477 -13.056 1.423 1.00 20.86 C ATOM 1399 OE1 GLN A 288 6.424 -12.295 0.448 1.00 20.39 O ATOM 1400 NE2 GLN A 288 5.454 -13.820 1.791 1.00 21.61 N ATOM 0 H GLN A 288 9.438 -9.609 2.531 1.00 18.71 H new ATOM 0 HA GLN A 288 7.021 -10.581 2.745 1.00 18.71 H new ATOM 0 HB2 GLN A 288 8.710 -11.578 1.403 1.00 18.76 H new ATOM 0 HB3 GLN A 288 9.423 -12.071 2.700 1.00 18.76 H new ATOM 0 HG2 GLN A 288 8.290 -13.886 1.924 1.00 20.06 H new ATOM 0 HG3 GLN A 288 7.488 -13.418 3.176 1.00 20.06 H new ATOM 0 HE21 GLN A 288 5.527 -14.337 2.474 1.00 21.61 H new ATOM 0 HE22 GLN A 288 4.719 -13.798 1.346 1.00 21.61 H new ATOM 1401 N PHE A 289 8.890 -11.044 5.302 1.00 18.25 N ATOM 1402 CA PHE A 289 8.927 -11.346 6.730 1.00 18.47 C ATOM 1403 C PHE A 289 7.956 -10.447 7.479 1.00 18.40 C ATOM 1404 O PHE A 289 7.151 -10.919 8.289 1.00 18.21 O ATOM 1405 CB PHE A 289 10.356 -11.183 7.278 1.00 18.93 C ATOM 1406 CG PHE A 289 10.452 -11.247 8.784 1.00 19.81 C ATOM 1407 CD1 PHE A 289 10.345 -12.462 9.451 1.00 21.29 C ATOM 1408 CD2 PHE A 289 10.659 -10.093 9.534 1.00 20.79 C ATOM 1409 CE1 PHE A 289 10.447 -12.529 10.846 1.00 21.13 C ATOM 1410 CE2 PHE A 289 10.745 -10.147 10.926 1.00 21.44 C ATOM 1411 CZ PHE A 289 10.639 -11.376 11.586 1.00 20.87 C ATOM 0 H PHE A 289 9.654 -10.824 4.974 1.00 18.25 H new ATOM 0 HA PHE A 289 8.657 -12.268 6.862 1.00 18.47 H new ATOM 0 HB2 PHE A 289 10.918 -11.876 6.898 1.00 18.93 H new ATOM 0 HB3 PHE A 289 10.712 -10.332 6.977 1.00 18.93 H new ATOM 0 HD1 PHE A 289 10.204 -13.241 8.964 1.00 21.29 H new ATOM 0 HD2 PHE A 289 10.741 -9.274 9.101 1.00 20.79 H new ATOM 0 HE1 PHE A 289 10.385 -13.351 11.276 1.00 21.13 H new ATOM 0 HE2 PHE A 289 10.873 -9.366 11.415 1.00 21.44 H new ATOM 0 HZ PHE A 289 10.697 -11.417 12.513 1.00 20.87 H new ATOM 1412 N SER A 290 8.020 -9.155 7.180 1.00 18.26 N ATOM 1413 CA SER A 290 7.160 -8.164 7.817 1.00 18.74 C ATOM 1414 C SER A 290 5.684 -8.415 7.524 1.00 18.44 C ATOM 1415 O SER A 290 4.870 -8.446 8.443 1.00 18.53 O ATOM 1416 CB SER A 290 7.545 -6.754 7.365 1.00 18.62 C ATOM 1417 OG SER A 290 8.837 -6.424 7.838 1.00 21.13 O ATOM 0 H SER A 290 8.564 -8.827 6.601 1.00 18.26 H new ATOM 0 HA SER A 290 7.291 -8.244 8.775 1.00 18.74 H new ATOM 0 HB2 SER A 290 7.525 -6.701 6.397 1.00 18.62 H new ATOM 0 HB3 SER A 290 6.898 -6.113 7.698 1.00 18.62 H new ATOM 0 HG SER A 290 9.415 -6.810 7.366 1.00 21.13 H new ATOM 1418 N GLN A 291 5.345 -8.576 6.248 1.00 18.35 N ATOM 1419 CA GLN A 291 3.945 -8.791 5.858 1.00 18.33 C ATOM 1420 C GLN A 291 3.377 -10.030 6.554 1.00 18.53 C ATOM 1421 O GLN A 291 2.213 -10.043 6.958 1.00 17.86 O ATOM 1422 CB GLN A 291 3.797 -8.928 4.337 1.00 18.39 C ATOM 1423 CG GLN A 291 2.352 -9.198 3.898 1.00 18.76 C ATOM 1424 CD GLN A 291 2.174 -9.342 2.402 1.00 18.85 C ATOM 1425 OE1 GLN A 291 3.058 -9.827 1.692 1.00 18.91 O ATOM 1426 NE2 GLN A 291 1.000 -8.945 1.917 1.00 19.83 N ATOM 0 H GLN A 291 5.903 -8.565 5.594 1.00 18.35 H new ATOM 0 HA GLN A 291 3.442 -8.011 6.139 1.00 18.33 H new ATOM 0 HB2 GLN A 291 4.113 -8.115 3.912 1.00 18.39 H new ATOM 0 HB3 GLN A 291 4.365 -9.650 4.025 1.00 18.39 H new ATOM 0 HG2 GLN A 291 2.040 -10.008 4.330 1.00 18.76 H new ATOM 0 HG3 GLN A 291 1.789 -8.474 4.212 1.00 18.76 H new ATOM 0 HE21 GLN A 291 0.408 -8.611 2.444 1.00 19.83 H new ATOM 0 HE22 GLN A 291 0.834 -9.022 1.077 1.00 19.83 H new ATOM 1427 N GLU A 292 4.200 -11.071 6.676 1.00 18.47 N ATOM 1428 CA GLU A 292 3.736 -12.325 7.267 1.00 19.13 C ATOM 1429 C GLU A 292 3.382 -12.210 8.747 1.00 19.26 C ATOM 1430 O GLU A 292 2.476 -12.901 9.215 1.00 19.33 O ATOM 1431 CB GLU A 292 4.719 -13.469 7.001 1.00 19.25 C ATOM 1432 CG GLU A 292 4.647 -13.962 5.565 1.00 19.14 C ATOM 1433 CD GLU A 292 5.446 -15.225 5.312 1.00 20.77 C ATOM 1434 OE1 GLU A 292 5.670 -16.006 6.272 1.00 21.54 O ATOM 1435 OE2 GLU A 292 5.828 -15.438 4.137 1.00 20.22 O ATOM 0 H GLU A 292 5.023 -11.072 6.425 1.00 18.47 H new ATOM 0 HA GLU A 292 2.903 -12.538 6.818 1.00 19.13 H new ATOM 0 HB2 GLU A 292 5.621 -13.170 7.194 1.00 19.25 H new ATOM 0 HB3 GLU A 292 4.529 -14.204 7.604 1.00 19.25 H new ATOM 0 HG2 GLU A 292 3.719 -14.124 5.334 1.00 19.14 H new ATOM 0 HG3 GLU A 292 4.968 -13.262 4.975 1.00 19.14 H new ATOM 1436 N ILE A 293 4.081 -11.336 9.470 1.00 19.43 N ATOM 1437 CA ILE A 293 3.693 -10.989 10.832 1.00 20.18 C ATOM 1438 C ILE A 293 2.298 -10.357 10.775 1.00 19.87 C ATOM 1439 O ILE A 293 1.398 -10.761 11.505 1.00 20.63 O ATOM 1440 CB ILE A 293 4.708 -10.019 11.513 1.00 19.75 C ATOM 1441 CG1 ILE A 293 6.095 -10.678 11.639 1.00 21.03 C ATOM 1442 CG2 ILE A 293 4.203 -9.578 12.888 1.00 20.11 C ATOM 1443 CD1 ILE A 293 7.148 -9.799 12.337 1.00 21.56 C ATOM 0 H ILE A 293 4.786 -10.932 9.187 1.00 19.43 H new ATOM 0 HA ILE A 293 3.687 -11.794 11.373 1.00 20.18 H new ATOM 0 HB ILE A 293 4.791 -9.233 10.951 1.00 19.75 H new ATOM 0 HG12 ILE A 293 6.004 -11.509 12.131 1.00 21.03 H new ATOM 0 HG13 ILE A 293 6.415 -10.907 10.752 1.00 21.03 H new ATOM 0 HG21 ILE A 293 4.848 -8.977 13.292 1.00 20.11 H new ATOM 0 HG22 ILE A 293 3.353 -9.121 12.789 1.00 20.11 H new ATOM 0 HG23 ILE A 293 4.087 -10.356 13.455 1.00 20.11 H new ATOM 0 HD11 ILE A 293 7.991 -10.276 12.380 1.00 21.56 H new ATOM 0 HD12 ILE A 293 7.267 -8.977 11.836 1.00 21.56 H new ATOM 0 HD13 ILE A 293 6.850 -9.589 13.236 1.00 21.56 H new ATOM 1444 N GLY A 294 2.127 -9.380 9.888 1.00 19.50 N ATOM 1445 CA GLY A 294 0.840 -8.695 9.734 1.00 19.40 C ATOM 1446 C GLY A 294 -0.288 -9.658 9.405 1.00 19.31 C ATOM 1447 O GLY A 294 -1.333 -9.655 10.065 1.00 19.24 O ATOM 0 H GLY A 294 2.745 -9.096 9.362 1.00 19.50 H new ATOM 0 HA2 GLY A 294 0.629 -8.220 10.553 1.00 19.40 H new ATOM 0 HA3 GLY A 294 0.911 -8.031 9.031 1.00 19.40 H new ATOM 1448 N LEU A 295 -0.070 -10.490 8.394 1.00 19.19 N ATOM 1449 CA LEU A 295 -1.082 -11.446 7.950 1.00 19.57 C ATOM 1450 C LEU A 295 -1.507 -12.390 9.077 1.00 20.11 C ATOM 1451 O LEU A 295 -2.697 -12.696 9.226 1.00 19.66 O ATOM 1452 CB LEU A 295 -0.581 -12.248 6.743 1.00 19.42 C ATOM 1453 CG LEU A 295 -0.489 -11.529 5.400 1.00 18.71 C ATOM 1454 CD1 LEU A 295 0.343 -12.348 4.432 1.00 17.54 C ATOM 1455 CD2 LEU A 295 -1.895 -11.275 4.839 1.00 18.23 C ATOM 0 H LEU A 295 0.664 -10.518 7.947 1.00 19.19 H new ATOM 0 HA LEU A 295 -1.862 -10.935 7.684 1.00 19.57 H new ATOM 0 HB2 LEU A 295 0.300 -12.591 6.958 1.00 19.42 H new ATOM 0 HB3 LEU A 295 -1.165 -13.015 6.631 1.00 19.42 H new ATOM 0 HG LEU A 295 -0.055 -10.671 5.526 1.00 18.71 H new ATOM 0 HD11 LEU A 295 0.398 -11.886 3.581 1.00 17.54 H new ATOM 0 HD12 LEU A 295 1.236 -12.467 4.793 1.00 17.54 H new ATOM 0 HD13 LEU A 295 -0.071 -13.215 4.302 1.00 17.54 H new ATOM 0 HD21 LEU A 295 -1.826 -10.818 3.986 1.00 18.23 H new ATOM 0 HD22 LEU A 295 -2.352 -12.122 4.716 1.00 18.23 H new ATOM 0 HD23 LEU A 295 -2.397 -10.725 5.460 1.00 18.23 H new ATOM 1456 N ALA A 296 -0.533 -12.829 9.873 1.00 20.18 N ATOM 1457 CA ALA A 296 -0.798 -13.724 10.999 1.00 21.01 C ATOM 1458 C ALA A 296 -1.645 -13.055 12.088 1.00 21.26 C ATOM 1459 O ALA A 296 -2.416 -13.729 12.778 1.00 21.59 O ATOM 1460 CB ALA A 296 0.513 -14.247 11.588 1.00 20.97 C ATOM 0 H ALA A 296 0.295 -12.618 9.777 1.00 20.18 H new ATOM 0 HA ALA A 296 -1.312 -14.471 10.655 1.00 21.01 H new ATOM 0 HB1 ALA A 296 0.320 -14.838 12.333 1.00 20.97 H new ATOM 0 HB2 ALA A 296 1.002 -14.734 10.907 1.00 20.97 H new ATOM 0 HB3 ALA A 296 1.049 -13.501 11.899 1.00 20.97 H new ATOM 1461 N SER A 297 -1.506 -11.734 12.225 1.00 21.38 N ATOM 1462 CA SER A 297 -2.213 -10.966 13.252 1.00 21.80 C ATOM 1463 C SER A 297 -3.689 -10.743 12.941 1.00 22.17 C ATOM 1464 O SER A 297 -4.479 -10.513 13.853 1.00 21.96 O ATOM 1465 CB SER A 297 -1.548 -9.597 13.460 1.00 21.84 C ATOM 1466 OG SER A 297 -1.899 -8.698 12.426 1.00 22.72 O ATOM 0 H SER A 297 -0.997 -11.257 11.722 1.00 21.38 H new ATOM 0 HA SER A 297 -2.158 -11.503 14.058 1.00 21.80 H new ATOM 0 HB2 SER A 297 -1.817 -9.230 14.317 1.00 21.84 H new ATOM 0 HB3 SER A 297 -0.584 -9.703 13.487 1.00 21.84 H new ATOM 0 HG SER A 297 -1.832 -9.085 11.683 1.00 22.72 H new ATOM 1467 N LEU A 298 -4.046 -10.780 11.659 1.00 22.55 N ATOM 1468 CA LEU A 298 -5.403 -10.425 11.224 1.00 23.57 C ATOM 1469 C LEU A 298 -6.486 -11.291 11.858 1.00 24.32 C ATOM 1470 O LEU A 298 -6.578 -12.489 11.577 1.00 24.30 O ATOM 1471 CB LEU A 298 -5.526 -10.465 9.701 1.00 23.55 C ATOM 1472 CG LEU A 298 -4.842 -9.384 8.863 1.00 23.73 C ATOM 1473 CD1 LEU A 298 -5.118 -9.676 7.396 1.00 24.29 C ATOM 1474 CD2 LEU A 298 -5.293 -7.968 9.237 1.00 23.94 C ATOM 0 H LEU A 298 -3.517 -11.009 11.020 1.00 22.55 H new ATOM 0 HA LEU A 298 -5.548 -9.517 11.533 1.00 23.57 H new ATOM 0 HB2 LEU A 298 -5.184 -11.323 9.404 1.00 23.55 H new ATOM 0 HB3 LEU A 298 -6.471 -10.446 9.485 1.00 23.55 H new ATOM 0 HG LEU A 298 -3.889 -9.410 9.041 1.00 23.73 H new ATOM 0 HD11 LEU A 298 -4.692 -9.000 6.846 1.00 24.29 H new ATOM 0 HD12 LEU A 298 -4.763 -10.549 7.167 1.00 24.29 H new ATOM 0 HD13 LEU A 298 -6.075 -9.665 7.238 1.00 24.29 H new ATOM 0 HD21 LEU A 298 -4.831 -7.323 8.679 1.00 23.94 H new ATOM 0 HD22 LEU A 298 -6.250 -7.886 9.101 1.00 23.94 H new ATOM 0 HD23 LEU A 298 -5.084 -7.797 10.169 1.00 23.94 H new ATOM 1475 N GLY A 299 -7.297 -10.663 12.712 1.00 24.97 N ATOM 1476 CA GLY A 299 -8.417 -11.332 13.384 1.00 25.84 C ATOM 1477 C GLY A 299 -7.992 -12.264 14.503 1.00 26.72 C ATOM 1478 O GLY A 299 -8.817 -12.996 15.055 1.00 26.58 O ATOM 0 H GLY A 299 -7.213 -9.833 12.919 1.00 24.97 H new ATOM 0 HA2 GLY A 299 -9.015 -10.659 13.745 1.00 25.84 H new ATOM 0 HA3 GLY A 299 -8.922 -11.837 12.728 1.00 25.84 H new ATOM 1479 N ALA A 300 -6.703 -12.228 14.842 1.00 26.86 N ATOM 1480 CA ALA A 300 -6.136 -13.089 15.872 1.00 27.47 C ATOM 1481 C ALA A 300 -6.573 -12.677 17.276 1.00 27.91 C ATOM 1482 O ALA A 300 -7.026 -11.552 17.498 1.00 27.74 O ATOM 1483 CB ALA A 300 -4.605 -13.095 15.770 1.00 27.12 C ATOM 0 H ALA A 300 -6.132 -11.699 14.477 1.00 26.86 H new ATOM 0 HA ALA A 300 -6.473 -13.985 15.719 1.00 27.47 H new ATOM 0 HB1 ALA A 300 -4.237 -13.670 16.459 1.00 27.12 H new ATOM 0 HB2 ALA A 300 -4.340 -13.426 14.897 1.00 27.12 H new ATOM 0 HB3 ALA A 300 -4.269 -12.193 15.889 1.00 27.12 H new ATOM 1484 N SER A 301 -6.419 -13.602 18.222 1.00 28.84 N ATOM 1485 CA SER A 301 -6.724 -13.338 19.620 1.00 29.56 C ATOM 1486 C SER A 301 -5.823 -12.233 20.170 1.00 30.45 C ATOM 1487 O SER A 301 -4.759 -11.942 19.604 1.00 30.39 O ATOM 1488 CB SER A 301 -6.564 -14.616 20.453 1.00 29.61 C ATOM 1489 OG SER A 301 -5.199 -15.002 20.542 1.00 29.82 O ATOM 0 H SER A 301 -6.135 -14.399 18.068 1.00 28.84 H new ATOM 0 HA SER A 301 -7.645 -13.041 19.679 1.00 29.56 H new ATOM 0 HB2 SER A 301 -6.921 -14.472 21.343 1.00 29.61 H new ATOM 0 HB3 SER A 301 -7.080 -15.333 20.053 1.00 29.61 H new ATOM 0 HG SER A 301 -4.959 -15.354 19.818 1.00 29.82 H new ATOM 1490 N GLU A 302 -6.264 -11.631 21.272 1.00 31.10 N ATOM 1491 CA GLU A 302 -5.501 -10.631 22.008 1.00 31.95 C ATOM 1492 C GLU A 302 -4.123 -11.175 22.396 1.00 31.95 C ATOM 1493 O GLU A 302 -3.110 -10.479 22.267 1.00 31.95 O ATOM 1494 CB GLU A 302 -6.280 -10.222 23.259 1.00 32.39 C ATOM 1495 CG GLU A 302 -5.961 -8.837 23.783 1.00 34.62 C ATOM 1496 CD GLU A 302 -6.324 -7.730 22.804 1.00 37.23 C ATOM 1497 OE1 GLU A 302 -7.320 -7.871 22.054 1.00 38.07 O ATOM 1498 OE2 GLU A 302 -5.610 -6.707 22.798 1.00 38.97 O ATOM 0 H GLU A 302 -7.033 -11.798 21.619 1.00 31.10 H new ATOM 0 HA GLU A 302 -5.368 -9.856 21.441 1.00 31.95 H new ATOM 0 HB2 GLU A 302 -7.229 -10.269 23.063 1.00 32.39 H new ATOM 0 HB3 GLU A 302 -6.103 -10.868 23.960 1.00 32.39 H new ATOM 0 HG2 GLU A 302 -6.438 -8.694 24.615 1.00 34.62 H new ATOM 0 HG3 GLU A 302 -5.014 -8.784 23.986 1.00 34.62 H new ATOM 1499 N GLU A 303 -4.107 -12.424 22.857 1.00 31.82 N ATOM 1500 CA GLU A 303 -2.887 -13.126 23.255 1.00 32.14 C ATOM 1501 C GLU A 303 -1.941 -13.340 22.072 1.00 31.25 C ATOM 1502 O GLU A 303 -0.725 -13.158 22.203 1.00 31.25 O ATOM 1503 CB GLU A 303 -3.258 -14.473 23.888 1.00 32.10 C ATOM 1504 CG GLU A 303 -2.124 -15.191 24.602 1.00 33.59 C ATOM 1505 CD GLU A 303 -2.559 -16.529 25.192 1.00 34.08 C ATOM 1506 OE1 GLU A 303 -3.750 -16.675 25.561 1.00 36.20 O ATOM 1507 OE2 GLU A 303 -1.703 -17.438 25.285 1.00 37.84 O ATOM 0 H GLU A 303 -4.819 -12.897 22.949 1.00 31.82 H new ATOM 0 HA GLU A 303 -2.419 -12.576 23.902 1.00 32.14 H new ATOM 0 HB2 GLU A 303 -3.979 -14.328 24.521 1.00 32.10 H new ATOM 0 HB3 GLU A 303 -3.603 -15.056 23.194 1.00 32.10 H new ATOM 0 HG2 GLU A 303 -1.395 -15.337 23.979 1.00 33.59 H new ATOM 0 HG3 GLU A 303 -1.782 -14.624 25.311 1.00 33.59 H new ATOM 1508 N ALA A 304 -2.503 -13.726 20.926 1.00 30.29 N ATOM 1509 CA ALA A 304 -1.720 -13.953 19.712 1.00 29.55 C ATOM 1510 C ALA A 304 -1.122 -12.663 19.149 1.00 29.06 C ATOM 1511 O ALA A 304 0.024 -12.661 18.681 1.00 28.76 O ATOM 1512 CB ALA A 304 -2.553 -14.660 18.662 1.00 29.53 C ATOM 0 H ALA A 304 -3.347 -13.863 20.831 1.00 30.29 H new ATOM 0 HA ALA A 304 -0.976 -14.524 19.960 1.00 29.55 H new ATOM 0 HB1 ALA A 304 -2.018 -14.802 17.866 1.00 29.53 H new ATOM 0 HB2 ALA A 304 -2.851 -15.516 19.007 1.00 29.53 H new ATOM 0 HB3 ALA A 304 -3.324 -14.115 18.440 1.00 29.53 H new ATOM 1513 N VAL A 305 -1.895 -11.576 19.204 1.00 28.16 N ATOM 1514 CA VAL A 305 -1.427 -10.261 18.749 1.00 27.66 C ATOM 1515 C VAL A 305 -0.257 -9.763 19.597 1.00 27.74 C ATOM 1516 O VAL A 305 0.728 -9.256 19.053 1.00 27.15 O ATOM 1517 CB VAL A 305 -2.571 -9.210 18.711 1.00 27.74 C ATOM 1518 CG1 VAL A 305 -2.022 -7.799 18.515 1.00 27.55 C ATOM 1519 CG2 VAL A 305 -3.548 -9.543 17.609 1.00 26.70 C ATOM 0 H VAL A 305 -2.701 -11.578 19.504 1.00 28.16 H new ATOM 0 HA VAL A 305 -1.113 -10.376 17.838 1.00 27.66 H new ATOM 0 HB VAL A 305 -3.031 -9.238 19.565 1.00 27.74 H new ATOM 0 HG11 VAL A 305 -2.756 -7.166 18.495 1.00 27.55 H new ATOM 0 HG12 VAL A 305 -1.426 -7.579 19.248 1.00 27.55 H new ATOM 0 HG13 VAL A 305 -1.535 -7.755 17.677 1.00 27.55 H new ATOM 0 HG21 VAL A 305 -4.257 -8.881 17.594 1.00 26.70 H new ATOM 0 HG22 VAL A 305 -3.087 -9.541 16.756 1.00 26.70 H new ATOM 0 HG23 VAL A 305 -3.929 -10.421 17.768 1.00 26.70 H new ATOM 1520 N GLN A 306 -0.357 -9.920 20.919 1.00 27.52 N ATOM 1521 CA GLN A 306 0.708 -9.478 21.817 1.00 28.09 C ATOM 1522 C GLN A 306 2.011 -10.225 21.551 1.00 27.13 C ATOM 1523 O GLN A 306 3.082 -9.626 21.570 1.00 27.31 O ATOM 1524 CB GLN A 306 0.319 -9.630 23.291 1.00 28.38 C ATOM 1525 CG GLN A 306 1.281 -8.896 24.223 1.00 32.19 C ATOM 1526 CD GLN A 306 1.637 -9.685 25.469 1.00 36.27 C ATOM 1527 OE1 GLN A 306 1.930 -10.886 25.407 1.00 38.01 O ATOM 1528 NE2 GLN A 306 1.632 -9.005 26.616 1.00 37.91 N ATOM 0 H GLN A 306 -1.032 -10.279 21.313 1.00 27.52 H new ATOM 0 HA GLN A 306 0.844 -8.535 21.634 1.00 28.09 H new ATOM 0 HB2 GLN A 306 -0.579 -9.289 23.423 1.00 28.38 H new ATOM 0 HB3 GLN A 306 0.302 -10.572 23.523 1.00 28.38 H new ATOM 0 HG2 GLN A 306 2.094 -8.688 23.737 1.00 32.19 H new ATOM 0 HG3 GLN A 306 0.883 -8.051 24.486 1.00 32.19 H new ATOM 0 HE21 GLN A 306 1.423 -8.171 26.620 1.00 37.91 H new ATOM 0 HE22 GLN A 306 1.838 -9.401 27.351 1.00 37.91 H new ATOM 1529 N LYS A 307 1.911 -11.529 21.312 1.00 26.60 N ATOM 1530 CA LYS A 307 3.082 -12.360 21.023 1.00 26.49 C ATOM 1531 C LYS A 307 3.716 -12.012 19.675 1.00 25.71 C ATOM 1532 O LYS A 307 4.944 -11.973 19.549 1.00 25.66 O ATOM 1533 CB LYS A 307 2.722 -13.846 21.083 1.00 26.26 C ATOM 1534 CG LYS A 307 2.478 -14.339 22.507 1.00 26.84 C ATOM 1535 CD LYS A 307 2.074 -15.807 22.549 1.00 27.57 C ATOM 1536 CE LYS A 307 1.760 -16.217 23.984 1.00 29.55 C ATOM 1537 NZ LYS A 307 1.504 -17.673 24.116 1.00 31.45 N ATOM 0 H LYS A 307 1.166 -11.958 21.312 1.00 26.60 H new ATOM 0 HA LYS A 307 3.742 -12.172 21.709 1.00 26.49 H new ATOM 0 HB2 LYS A 307 1.927 -14.004 20.550 1.00 26.26 H new ATOM 0 HB3 LYS A 307 3.438 -14.364 20.684 1.00 26.26 H new ATOM 0 HG2 LYS A 307 3.283 -14.212 23.033 1.00 26.84 H new ATOM 0 HG3 LYS A 307 1.782 -13.802 22.918 1.00 26.84 H new ATOM 0 HD2 LYS A 307 1.299 -15.954 21.985 1.00 27.57 H new ATOM 0 HD3 LYS A 307 2.790 -16.358 22.196 1.00 27.57 H new ATOM 0 HE2 LYS A 307 2.502 -15.969 24.558 1.00 29.55 H new ATOM 0 HE3 LYS A 307 0.984 -15.726 24.295 1.00 29.55 H new ATOM 0 HZ1 LYS A 307 1.326 -17.867 24.966 1.00 31.45 H new ATOM 0 HZ2 LYS A 307 0.809 -17.900 23.608 1.00 31.45 H new ATOM 0 HZ3 LYS A 307 2.223 -18.126 23.853 1.00 31.45 H new ATOM 1538 N LEU A 308 2.872 -11.765 18.677 1.00 24.83 N ATOM 1539 CA LEU A 308 3.341 -11.326 17.363 1.00 24.10 C ATOM 1540 C LEU A 308 3.971 -9.938 17.439 1.00 23.66 C ATOM 1541 O LEU A 308 5.013 -9.697 16.821 1.00 23.61 O ATOM 1542 CB LEU A 308 2.203 -11.360 16.335 1.00 23.92 C ATOM 1543 CG LEU A 308 1.747 -12.727 15.814 1.00 23.70 C ATOM 1544 CD1 LEU A 308 0.343 -12.633 15.220 1.00 21.48 C ATOM 1545 CD2 LEU A 308 2.718 -13.297 14.795 1.00 25.42 C ATOM 0 H LEU A 308 2.018 -11.846 18.740 1.00 24.83 H new ATOM 0 HA LEU A 308 4.027 -11.946 17.069 1.00 24.10 H new ATOM 0 HB2 LEU A 308 1.433 -10.920 16.729 1.00 23.92 H new ATOM 0 HB3 LEU A 308 2.475 -10.827 15.572 1.00 23.92 H new ATOM 0 HG LEU A 308 1.728 -13.334 16.570 1.00 23.70 H new ATOM 0 HD11 LEU A 308 0.070 -13.505 14.895 1.00 21.48 H new ATOM 0 HD12 LEU A 308 -0.278 -12.333 15.902 1.00 21.48 H new ATOM 0 HD13 LEU A 308 0.344 -12.001 14.485 1.00 21.48 H new ATOM 0 HD21 LEU A 308 2.397 -14.160 14.489 1.00 25.42 H new ATOM 0 HD22 LEU A 308 2.787 -12.692 14.040 1.00 25.42 H new ATOM 0 HD23 LEU A 308 3.591 -13.404 15.204 1.00 25.42 H new ATOM 1546 N ALA A 309 3.349 -9.034 18.200 1.00 22.98 N ATOM 1547 CA ALA A 309 3.874 -7.674 18.377 1.00 22.92 C ATOM 1548 C ALA A 309 5.229 -7.669 19.087 1.00 22.66 C ATOM 1549 O ALA A 309 6.104 -6.870 18.752 1.00 22.10 O ATOM 1550 CB ALA A 309 2.881 -6.796 19.126 1.00 22.71 C ATOM 0 H ALA A 309 2.618 -9.189 18.625 1.00 22.98 H new ATOM 0 HA ALA A 309 4.006 -7.306 17.489 1.00 22.92 H new ATOM 0 HB1 ALA A 309 3.251 -5.905 19.230 1.00 22.71 H new ATOM 0 HB2 ALA A 309 2.052 -6.745 18.625 1.00 22.71 H new ATOM 0 HB3 ALA A 309 2.707 -7.177 20.001 1.00 22.71 H new ATOM 1551 N THR A 310 5.401 -8.565 20.056 1.00 22.19 N ATOM 1552 CA THR A 310 6.685 -8.706 20.747 1.00 22.37 C ATOM 1553 C THR A 310 7.764 -9.274 19.814 1.00 21.76 C ATOM 1554 O THR A 310 8.907 -8.797 19.822 1.00 21.84 O ATOM 1555 CB THR A 310 6.552 -9.545 22.051 1.00 22.80 C ATOM 1556 OG1 THR A 310 5.563 -8.947 22.892 1.00 23.89 O ATOM 1557 CG2 THR A 310 7.876 -9.567 22.815 1.00 22.62 C ATOM 0 H THR A 310 4.788 -9.102 20.330 1.00 22.19 H new ATOM 0 HA THR A 310 6.969 -7.817 21.011 1.00 22.37 H new ATOM 0 HB THR A 310 6.303 -10.451 21.811 1.00 22.80 H new ATOM 0 HG1 THR A 310 4.799 -9.096 22.576 1.00 23.89 H new ATOM 0 HG21 THR A 310 7.775 -10.093 23.623 1.00 22.62 H new ATOM 0 HG22 THR A 310 8.565 -9.961 22.257 1.00 22.62 H new ATOM 0 HG23 THR A 310 8.130 -8.661 23.050 1.00 22.62 H new ATOM 1558 N CYS A 311 7.409 -10.273 19.008 1.00 21.50 N ATOM 1559 CA CYS A 311 8.344 -10.821 18.011 1.00 21.52 C ATOM 1560 C CYS A 311 8.757 -9.741 17.003 1.00 21.12 C ATOM 1561 O CYS A 311 9.933 -9.615 16.664 1.00 20.12 O ATOM 1562 CB CYS A 311 7.753 -12.024 17.276 1.00 21.71 C ATOM 1563 SG CYS A 311 7.644 -13.548 18.274 1.00 24.75 S ATOM 0 H CYS A 311 6.636 -10.650 19.018 1.00 21.50 H new ATOM 0 HA CYS A 311 9.130 -11.123 18.493 1.00 21.52 H new ATOM 0 HB2 CYS A 311 6.864 -11.792 16.963 1.00 21.71 H new ATOM 0 HB3 CYS A 311 8.292 -12.204 16.490 1.00 21.71 H new ATOM 0 HG CYS A 311 6.688 -13.486 18.996 1.00 24.75 H new ATOM 1564 N TYR A 312 7.775 -8.973 16.539 1.00 20.55 N ATOM 1565 CA TYR A 312 8.022 -7.823 15.670 1.00 20.91 C ATOM 1566 C TYR A 312 8.996 -6.821 16.314 1.00 20.91 C ATOM 1567 O TYR A 312 9.945 -6.360 15.671 1.00 20.92 O ATOM 1568 CB TYR A 312 6.694 -7.133 15.318 1.00 20.70 C ATOM 1569 CG TYR A 312 6.885 -5.773 14.686 1.00 21.00 C ATOM 1570 CD1 TYR A 312 6.977 -5.637 13.304 1.00 21.53 C ATOM 1571 CD2 TYR A 312 6.999 -4.622 15.477 1.00 21.85 C ATOM 1572 CE1 TYR A 312 7.162 -4.384 12.717 1.00 21.91 C ATOM 1573 CE2 TYR A 312 7.198 -3.367 14.900 1.00 21.33 C ATOM 1574 CZ TYR A 312 7.285 -3.260 13.527 1.00 20.95 C ATOM 1575 OH TYR A 312 7.476 -2.022 12.951 1.00 22.94 O ATOM 0 H TYR A 312 6.944 -9.104 16.719 1.00 20.55 H new ATOM 0 HA TYR A 312 8.437 -8.149 14.856 1.00 20.91 H new ATOM 0 HB2 TYR A 312 6.192 -7.699 14.711 1.00 20.70 H new ATOM 0 HB3 TYR A 312 6.161 -7.038 16.123 1.00 20.70 H new ATOM 0 HD1 TYR A 312 6.914 -6.392 12.764 1.00 21.53 H new ATOM 0 HD2 TYR A 312 6.941 -4.696 16.402 1.00 21.85 H new ATOM 0 HE1 TYR A 312 7.203 -4.301 11.792 1.00 21.91 H new ATOM 0 HE2 TYR A 312 7.271 -2.610 15.436 1.00 21.33 H new ATOM 0 HH TYR A 312 7.862 -1.515 13.498 1.00 22.94 H new ATOM 1576 N PHE A 313 8.747 -6.496 17.581 1.00 21.08 N ATOM 1577 CA PHE A 313 9.547 -5.531 18.330 1.00 21.39 C ATOM 1578 C PHE A 313 11.010 -5.971 18.396 1.00 21.29 C ATOM 1579 O PHE A 313 11.920 -5.184 18.145 1.00 21.05 O ATOM 1580 CB PHE A 313 8.971 -5.371 19.743 1.00 21.82 C ATOM 1581 CG PHE A 313 9.567 -4.235 20.529 1.00 22.16 C ATOM 1582 CD1 PHE A 313 9.010 -2.967 20.468 1.00 21.56 C ATOM 1583 CD2 PHE A 313 10.673 -4.444 21.357 1.00 22.81 C ATOM 1584 CE1 PHE A 313 9.547 -1.910 21.206 1.00 23.02 C ATOM 1585 CE2 PHE A 313 11.218 -3.391 22.100 1.00 22.48 C ATOM 1586 CZ PHE A 313 10.659 -2.125 22.021 1.00 22.19 C ATOM 0 H PHE A 313 8.100 -6.835 18.035 1.00 21.08 H new ATOM 0 HA PHE A 313 9.513 -4.676 17.873 1.00 21.39 H new ATOM 0 HB2 PHE A 313 8.013 -5.237 19.677 1.00 21.82 H new ATOM 0 HB3 PHE A 313 9.109 -6.197 20.233 1.00 21.82 H new ATOM 0 HD1 PHE A 313 8.268 -2.818 19.928 1.00 21.56 H new ATOM 0 HD2 PHE A 313 11.051 -5.292 21.415 1.00 22.81 H new ATOM 0 HE1 PHE A 313 9.164 -1.064 21.154 1.00 23.02 H new ATOM 0 HE2 PHE A 313 11.955 -3.540 22.647 1.00 22.48 H new ATOM 0 HZ PHE A 313 11.023 -1.422 22.509 1.00 22.19 H new ATOM 1587 N PHE A 314 11.222 -7.239 18.715 1.00 21.08 N ATOM 1588 CA PHE A 314 12.575 -7.758 18.881 1.00 21.47 C ATOM 1589 C PHE A 314 13.240 -8.249 17.588 1.00 20.95 C ATOM 1590 O PHE A 314 14.347 -8.794 17.617 1.00 21.41 O ATOM 1591 CB PHE A 314 12.603 -8.799 20.009 1.00 21.93 C ATOM 1592 CG PHE A 314 12.510 -8.183 21.385 1.00 22.57 C ATOM 1593 CD1 PHE A 314 13.593 -7.489 21.917 1.00 23.58 C ATOM 1594 CD2 PHE A 314 11.342 -8.274 22.132 1.00 23.07 C ATOM 1595 CE1 PHE A 314 13.520 -6.899 23.185 1.00 23.87 C ATOM 1596 CE2 PHE A 314 11.254 -7.693 23.400 1.00 23.25 C ATOM 1597 CZ PHE A 314 12.352 -7.002 23.926 1.00 23.90 C ATOM 0 H PHE A 314 10.598 -7.817 18.840 1.00 21.08 H new ATOM 0 HA PHE A 314 13.132 -7.007 19.140 1.00 21.47 H new ATOM 0 HB2 PHE A 314 11.867 -9.419 19.888 1.00 21.93 H new ATOM 0 HB3 PHE A 314 13.422 -9.315 19.946 1.00 21.93 H new ATOM 0 HD1 PHE A 314 14.377 -7.416 21.423 1.00 23.58 H new ATOM 0 HD2 PHE A 314 10.609 -8.728 21.783 1.00 23.07 H new ATOM 0 HE1 PHE A 314 14.252 -6.440 23.529 1.00 23.87 H new ATOM 0 HE2 PHE A 314 10.469 -7.765 23.893 1.00 23.25 H new ATOM 0 HZ PHE A 314 12.298 -6.613 24.769 1.00 23.90 H new ATOM 1598 N THR A 315 12.578 -8.032 16.454 1.00 20.35 N ATOM 1599 CA THR A 315 13.196 -8.271 15.148 1.00 19.86 C ATOM 1600 C THR A 315 13.243 -6.965 14.357 1.00 19.71 C ATOM 1601 O THR A 315 14.294 -6.318 14.266 1.00 19.41 O ATOM 1602 CB THR A 315 12.481 -9.376 14.330 1.00 19.89 C ATOM 1603 OG1 THR A 315 11.064 -9.126 14.284 1.00 19.82 O ATOM 1604 CG2 THR A 315 12.747 -10.748 14.931 1.00 20.25 C ATOM 0 H THR A 315 11.768 -7.746 16.417 1.00 20.35 H new ATOM 0 HA THR A 315 14.096 -8.593 15.311 1.00 19.86 H new ATOM 0 HB THR A 315 12.834 -9.361 13.427 1.00 19.89 H new ATOM 0 HG1 THR A 315 10.727 -9.285 15.037 1.00 19.82 H new ATOM 0 HG21 THR A 315 12.292 -11.425 14.406 1.00 20.25 H new ATOM 0 HG22 THR A 315 13.701 -10.924 14.927 1.00 20.25 H new ATOM 0 HG23 THR A 315 12.418 -10.771 15.843 1.00 20.25 H new ATOM 1605 N VAL A 316 12.088 -6.566 13.825 1.00 19.01 N ATOM 1606 CA VAL A 316 11.965 -5.362 12.992 1.00 18.74 C ATOM 1607 C VAL A 316 12.433 -4.091 13.705 1.00 19.06 C ATOM 1608 O VAL A 316 13.091 -3.254 13.092 1.00 18.77 O ATOM 1609 CB VAL A 316 10.518 -5.194 12.455 1.00 18.55 C ATOM 1610 CG1 VAL A 316 10.366 -3.913 11.639 1.00 18.42 C ATOM 1611 CG2 VAL A 316 10.115 -6.407 11.608 1.00 18.38 C ATOM 0 H VAL A 316 11.347 -6.988 13.937 1.00 19.01 H new ATOM 0 HA VAL A 316 12.561 -5.493 12.238 1.00 18.74 H new ATOM 0 HB VAL A 316 9.928 -5.132 13.222 1.00 18.55 H new ATOM 0 HG11 VAL A 316 9.453 -3.839 11.319 1.00 18.42 H new ATOM 0 HG12 VAL A 316 10.576 -3.147 12.196 1.00 18.42 H new ATOM 0 HG13 VAL A 316 10.972 -3.937 10.882 1.00 18.42 H new ATOM 0 HG21 VAL A 316 9.210 -6.287 11.280 1.00 18.38 H new ATOM 0 HG22 VAL A 316 10.722 -6.493 10.856 1.00 18.38 H new ATOM 0 HG23 VAL A 316 10.158 -7.210 12.151 1.00 18.38 H new ATOM 1612 N GLU A 317 12.108 -3.945 14.993 1.00 19.27 N ATOM 1613 CA GLU A 317 12.508 -2.740 15.724 1.00 19.69 C ATOM 1614 C GLU A 317 13.905 -2.804 16.371 1.00 20.09 C ATOM 1615 O GLU A 317 14.646 -1.821 16.319 1.00 20.11 O ATOM 1616 CB GLU A 317 11.456 -2.312 16.761 1.00 19.56 C ATOM 1617 CG GLU A 317 10.060 -1.967 16.189 1.00 20.11 C ATOM 1618 CD GLU A 317 9.967 -0.629 15.439 1.00 20.62 C ATOM 1619 OE1 GLU A 317 8.885 -0.357 14.868 1.00 21.53 O ATOM 1620 OE2 GLU A 317 10.935 0.167 15.403 1.00 19.69 O ATOM 0 H GLU A 317 11.665 -4.520 15.454 1.00 19.27 H new ATOM 0 HA GLU A 317 12.566 -2.061 15.034 1.00 19.69 H new ATOM 0 HB2 GLU A 317 11.355 -3.026 17.410 1.00 19.56 H new ATOM 0 HB3 GLU A 317 11.792 -1.538 17.240 1.00 19.56 H new ATOM 0 HG2 GLU A 317 9.790 -2.678 15.587 1.00 20.11 H new ATOM 0 HG3 GLU A 317 9.422 -1.956 16.919 1.00 20.11 H new ATOM 1621 N PHE A 318 14.255 -3.938 16.983 1.00 20.55 N ATOM 1622 CA PHE A 318 15.483 -4.011 17.800 1.00 21.08 C ATOM 1623 C PHE A 318 16.343 -5.259 17.557 1.00 21.64 C ATOM 1624 O PHE A 318 17.183 -5.629 18.382 1.00 22.26 O ATOM 1625 CB PHE A 318 15.146 -3.813 19.292 1.00 20.76 C ATOM 1626 CG PHE A 318 14.714 -2.417 19.611 1.00 20.92 C ATOM 1627 CD1 PHE A 318 13.360 -2.080 19.630 1.00 19.32 C ATOM 1628 CD2 PHE A 318 15.658 -1.417 19.829 1.00 20.64 C ATOM 1629 CE1 PHE A 318 12.952 -0.774 19.888 1.00 20.39 C ATOM 1630 CE2 PHE A 318 15.263 -0.109 20.089 1.00 20.59 C ATOM 1631 CZ PHE A 318 13.907 0.215 20.116 1.00 20.39 C ATOM 0 H PHE A 318 13.805 -4.670 16.942 1.00 20.55 H new ATOM 0 HA PHE A 318 16.047 -3.279 17.505 1.00 21.08 H new ATOM 0 HB2 PHE A 318 14.442 -4.430 19.544 1.00 20.76 H new ATOM 0 HB3 PHE A 318 15.924 -4.036 19.827 1.00 20.76 H new ATOM 0 HD1 PHE A 318 12.722 -2.737 19.468 1.00 19.32 H new ATOM 0 HD2 PHE A 318 16.564 -1.626 19.800 1.00 20.64 H new ATOM 0 HE1 PHE A 318 12.047 -0.563 19.908 1.00 20.39 H new ATOM 0 HE2 PHE A 318 15.902 0.548 20.245 1.00 20.59 H new ATOM 0 HZ PHE A 318 13.640 1.090 20.286 1.00 20.39 H new ATOM 1632 N GLY A 319 16.163 -5.862 16.390 1.00 22.07 N ATOM 1633 CA GLY A 319 16.842 -7.100 16.046 1.00 22.66 C ATOM 1634 C GLY A 319 18.301 -6.955 15.665 1.00 23.33 C ATOM 1635 O GLY A 319 18.720 -5.946 15.090 1.00 22.36 O ATOM 0 H GLY A 319 15.642 -5.563 15.774 1.00 22.07 H new ATOM 0 HA2 GLY A 319 16.779 -7.706 16.800 1.00 22.66 H new ATOM 0 HA3 GLY A 319 16.370 -7.516 15.308 1.00 22.66 H new ATOM 1636 N LEU A 320 19.065 -7.989 15.999 1.00 24.10 N ATOM 1637 CA LEU A 320 20.423 -8.164 15.516 1.00 25.21 C ATOM 1638 C LEU A 320 20.439 -9.413 14.643 1.00 25.87 C ATOM 1639 O LEU A 320 19.549 -10.268 14.742 1.00 25.77 O ATOM 1640 CB LEU A 320 21.413 -8.315 16.686 1.00 25.40 C ATOM 1641 CG LEU A 320 21.497 -7.212 17.754 1.00 26.63 C ATOM 1642 CD1 LEU A 320 22.590 -7.491 18.765 1.00 27.19 C ATOM 1643 CD2 LEU A 320 21.724 -5.847 17.133 1.00 27.12 C ATOM 0 H LEU A 320 18.801 -8.618 16.522 1.00 24.10 H new ATOM 0 HA LEU A 320 20.699 -7.385 15.008 1.00 25.21 H new ATOM 0 HB2 LEU A 320 21.201 -9.145 17.141 1.00 25.40 H new ATOM 0 HB3 LEU A 320 22.299 -8.419 16.305 1.00 25.40 H new ATOM 0 HG LEU A 320 20.642 -7.210 18.211 1.00 26.63 H new ATOM 0 HD11 LEU A 320 22.614 -6.777 19.421 1.00 27.19 H new ATOM 0 HD12 LEU A 320 22.411 -8.334 19.211 1.00 27.19 H new ATOM 0 HD13 LEU A 320 23.446 -7.541 18.311 1.00 27.19 H new ATOM 0 HD21 LEU A 320 21.772 -5.177 17.833 1.00 27.12 H new ATOM 0 HD22 LEU A 320 22.556 -5.853 16.634 1.00 27.12 H new ATOM 0 HD23 LEU A 320 20.990 -5.637 16.535 1.00 27.12 H new ATOM 1644 N CYS A 321 21.437 -9.515 13.776 1.00 26.28 N ATOM 1645 CA CYS A 321 21.608 -10.714 12.974 1.00 27.27 C ATOM 1646 C CYS A 321 23.084 -11.070 12.912 1.00 27.65 C ATOM 1647 O CYS A 321 23.941 -10.199 13.070 1.00 27.67 O ATOM 1648 CB CYS A 321 21.049 -10.515 11.564 1.00 27.35 C ATOM 1649 SG CYS A 321 21.781 -9.117 10.697 1.00 28.66 S ATOM 0 H CYS A 321 22.024 -8.902 13.638 1.00 26.28 H new ATOM 0 HA CYS A 321 21.116 -11.441 13.387 1.00 27.27 H new ATOM 0 HB2 CYS A 321 21.198 -11.322 11.047 1.00 27.35 H new ATOM 0 HB3 CYS A 321 20.089 -10.387 11.619 1.00 27.35 H new ATOM 0 HG CYS A 321 21.297 -9.026 9.603 1.00 28.66 H new ATOM 1650 N LYS A 322 23.368 -12.348 12.685 1.00 28.54 N ATOM 1651 CA LYS A 322 24.739 -12.816 12.510 1.00 29.30 C ATOM 1652 C LYS A 322 25.048 -12.932 11.019 1.00 29.41 C ATOM 1653 O LYS A 322 24.390 -13.687 10.293 1.00 29.65 O ATOM 1654 CB LYS A 322 24.944 -14.150 13.238 1.00 29.77 C ATOM 1655 CG LYS A 322 26.400 -14.471 13.584 1.00 32.01 C ATOM 1656 CD LYS A 322 26.581 -14.721 15.093 1.00 35.32 C ATOM 1657 CE LYS A 322 26.212 -16.146 15.511 1.00 36.62 C ATOM 1658 NZ LYS A 322 27.358 -17.100 15.343 1.00 37.62 N ATOM 0 H LYS A 322 22.774 -12.967 12.628 1.00 28.54 H new ATOM 0 HA LYS A 322 25.356 -12.177 12.900 1.00 29.30 H new ATOM 0 HB2 LYS A 322 24.424 -14.141 14.057 1.00 29.77 H new ATOM 0 HB3 LYS A 322 24.590 -14.864 12.685 1.00 29.77 H new ATOM 0 HG2 LYS A 322 26.686 -15.254 13.089 1.00 32.01 H new ATOM 0 HG3 LYS A 322 26.969 -13.736 13.306 1.00 32.01 H new ATOM 0 HD2 LYS A 322 27.504 -14.547 15.336 1.00 35.32 H new ATOM 0 HD3 LYS A 322 26.033 -14.092 15.588 1.00 35.32 H new ATOM 0 HE2 LYS A 322 25.927 -16.146 16.438 1.00 36.62 H new ATOM 0 HE3 LYS A 322 25.458 -16.452 14.982 1.00 36.62 H new ATOM 0 HZ1 LYS A 322 27.105 -17.915 15.595 1.00 37.62 H new ATOM 0 HZ2 LYS A 322 27.607 -17.118 14.489 1.00 37.62 H new ATOM 0 HZ3 LYS A 322 28.043 -16.833 15.845 1.00 37.62 H new ATOM 1659 N GLN A 323 26.028 -12.158 10.557 1.00 29.09 N ATOM 1660 CA GLN A 323 26.438 -12.207 9.156 1.00 29.46 C ATOM 1661 C GLN A 323 27.936 -12.420 9.005 1.00 29.92 C ATOM 1662 O GLN A 323 28.744 -11.633 9.514 1.00 29.86 O ATOM 1663 CB GLN A 323 25.982 -10.960 8.394 1.00 29.35 C ATOM 1664 CG GLN A 323 24.477 -10.932 8.165 1.00 28.92 C ATOM 1665 CD GLN A 323 23.994 -9.715 7.400 1.00 28.86 C ATOM 1666 OE1 GLN A 323 24.729 -8.741 7.202 1.00 27.45 O ATOM 1667 NE2 GLN A 323 22.738 -9.759 6.980 1.00 26.95 N ATOM 0 H GLN A 323 26.468 -11.598 11.039 1.00 29.09 H new ATOM 0 HA GLN A 323 25.996 -12.976 8.763 1.00 29.46 H new ATOM 0 HB2 GLN A 323 26.245 -10.168 8.889 1.00 29.35 H new ATOM 0 HB3 GLN A 323 26.437 -10.924 7.538 1.00 29.35 H new ATOM 0 HG2 GLN A 323 24.218 -11.731 7.681 1.00 28.92 H new ATOM 0 HG3 GLN A 323 24.027 -10.962 9.024 1.00 28.92 H new ATOM 0 HE21 GLN A 323 22.256 -10.454 7.136 1.00 26.95 H new ATOM 0 HE22 GLN A 323 22.404 -9.092 6.551 1.00 26.95 H new ATOM 1668 N ASP A 324 28.288 -13.493 8.297 1.00 30.62 N ATOM 1669 CA ASP A 324 29.680 -13.922 8.143 1.00 31.32 C ATOM 1670 C ASP A 324 30.379 -14.034 9.505 1.00 31.43 C ATOM 1671 O ASP A 324 31.546 -13.661 9.649 1.00 31.77 O ATOM 1672 CB ASP A 324 30.445 -12.976 7.199 1.00 31.57 C ATOM 1673 CG ASP A 324 29.860 -12.937 5.789 1.00 32.80 C ATOM 1674 OD1 ASP A 324 29.962 -11.874 5.147 1.00 34.84 O ATOM 1675 OD2 ASP A 324 29.304 -13.952 5.311 1.00 33.57 O ATOM 0 H ASP A 324 27.722 -13.996 7.889 1.00 30.62 H new ATOM 0 HA ASP A 324 29.678 -14.805 7.741 1.00 31.32 H new ATOM 0 HB2 ASP A 324 30.438 -12.080 7.571 1.00 31.57 H new ATOM 0 HB3 ASP A 324 31.373 -13.256 7.151 1.00 31.57 H new ATOM 1676 N GLY A 325 29.644 -14.531 10.502 1.00 31.44 N ATOM 1677 CA GLY A 325 30.161 -14.722 11.858 1.00 31.41 C ATOM 1678 C GLY A 325 30.090 -13.518 12.788 1.00 31.28 C ATOM 1679 O GLY A 325 30.246 -13.659 14.005 1.00 31.43 O ATOM 0 H GLY A 325 28.823 -14.769 10.408 1.00 31.44 H new ATOM 0 HA2 GLY A 325 29.673 -15.452 12.269 1.00 31.41 H new ATOM 0 HA3 GLY A 325 31.088 -15.001 11.793 1.00 31.41 H new ATOM 1680 N GLN A 326 29.852 -12.337 12.222 1.00 31.07 N ATOM 1681 CA GLN A 326 29.847 -11.087 12.988 1.00 30.83 C ATOM 1682 C GLN A 326 28.424 -10.631 13.296 1.00 30.12 C ATOM 1683 O GLN A 326 27.505 -10.895 12.519 1.00 29.91 O ATOM 1684 CB GLN A 326 30.569 -9.983 12.212 1.00 30.89 C ATOM 1685 CG GLN A 326 31.975 -10.355 11.726 1.00 32.16 C ATOM 1686 CD GLN A 326 32.617 -9.276 10.861 1.00 32.41 C ATOM 1687 OE1 GLN A 326 32.162 -8.033 11.008 1.00 34.85 O flip ATOM 1688 NE2 GLN A 326 33.511 -9.564 10.067 1.00 33.09 N flip ATOM 0 H GLN A 326 29.689 -12.235 11.384 1.00 31.07 H new ATOM 0 HA GLN A 326 30.309 -11.256 13.824 1.00 30.83 H new ATOM 0 HB2 GLN A 326 30.029 -9.738 11.444 1.00 30.89 H new ATOM 0 HB3 GLN A 326 30.633 -9.197 12.776 1.00 30.89 H new ATOM 0 HG2 GLN A 326 32.542 -10.525 12.494 1.00 32.16 H new ATOM 0 HG3 GLN A 326 31.928 -11.181 11.220 1.00 32.16 H new ATOM 0 HE21 GLN A 326 33.780 -10.378 9.999 1.00 33.09 H new ATOM 0 HE22 GLN A 326 33.867 -8.951 9.580 1.00 33.09 H new ATOM 1689 N LEU A 327 28.255 -9.940 14.421 1.00 29.12 N ATOM 1690 CA LEU A 327 26.964 -9.357 14.779 1.00 28.66 C ATOM 1691 C LEU A 327 26.729 -8.058 14.024 1.00 27.93 C ATOM 1692 O LEU A 327 27.577 -7.156 14.024 1.00 27.61 O ATOM 1693 CB LEU A 327 26.858 -9.097 16.285 1.00 28.78 C ATOM 1694 CG LEU A 327 26.806 -10.251 17.287 1.00 30.03 C ATOM 1695 CD1 LEU A 327 26.421 -9.695 18.655 1.00 30.93 C ATOM 1696 CD2 LEU A 327 25.822 -11.345 16.856 1.00 31.66 C ATOM 0 H LEU A 327 28.880 -9.797 14.994 1.00 29.12 H new ATOM 0 HA LEU A 327 26.283 -10.002 14.530 1.00 28.66 H new ATOM 0 HB2 LEU A 327 27.615 -8.543 16.531 1.00 28.78 H new ATOM 0 HB3 LEU A 327 26.059 -8.564 16.425 1.00 28.78 H new ATOM 0 HG LEU A 327 27.683 -10.664 17.328 1.00 30.03 H new ATOM 0 HD11 LEU A 327 26.385 -10.419 19.300 1.00 30.93 H new ATOM 0 HD12 LEU A 327 27.082 -9.044 18.937 1.00 30.93 H new ATOM 0 HD13 LEU A 327 25.551 -9.269 18.598 1.00 30.93 H new ATOM 0 HD21 LEU A 327 25.819 -12.056 17.516 1.00 31.66 H new ATOM 0 HD22 LEU A 327 24.931 -10.969 16.783 1.00 31.66 H new ATOM 0 HD23 LEU A 327 26.093 -11.704 15.996 1.00 31.66 H new ATOM 1697 N ARG A 328 25.573 -7.979 13.373 1.00 26.61 N ATOM 1698 CA ARG A 328 25.143 -6.764 12.705 1.00 25.48 C ATOM 1699 C ARG A 328 23.734 -6.428 13.180 1.00 24.60 C ATOM 1700 O ARG A 328 23.068 -7.259 13.798 1.00 23.26 O ATOM 1701 CB ARG A 328 25.177 -6.936 11.180 1.00 25.79 C ATOM 1702 CG ARG A 328 26.580 -7.113 10.580 1.00 26.07 C ATOM 1703 CD ARG A 328 27.426 -5.876 10.789 1.00 27.28 C ATOM 1704 NE ARG A 328 28.767 -6.051 10.250 1.00 29.70 N ATOM 1705 CZ ARG A 328 29.340 -5.243 9.367 1.00 30.96 C ATOM 1706 NH1 ARG A 328 30.573 -5.510 8.945 1.00 32.41 N ATOM 1707 NH2 ARG A 328 28.697 -4.170 8.912 1.00 31.59 N ATOM 0 H ARG A 328 25.017 -8.632 13.308 1.00 26.61 H new ATOM 0 HA ARG A 328 25.747 -6.038 12.926 1.00 25.48 H new ATOM 0 HB2 ARG A 328 24.638 -7.707 10.943 1.00 25.79 H new ATOM 0 HB3 ARG A 328 24.760 -6.162 10.771 1.00 25.79 H new ATOM 0 HG2 ARG A 328 27.015 -7.878 10.988 1.00 26.07 H new ATOM 0 HG3 ARG A 328 26.507 -7.301 9.631 1.00 26.07 H new ATOM 0 HD2 ARG A 328 27.001 -5.116 10.362 1.00 27.28 H new ATOM 0 HD3 ARG A 328 27.480 -5.676 11.737 1.00 27.28 H new ATOM 0 HE ARG A 328 29.221 -6.728 10.524 1.00 29.70 H new ATOM 0 HH11 ARG A 328 30.990 -6.200 9.244 1.00 32.41 H new ATOM 0 HH12 ARG A 328 30.953 -4.993 8.373 1.00 32.41 H new ATOM 0 HH21 ARG A 328 27.902 -3.995 9.190 1.00 31.59 H new ATOM 0 HH22 ARG A 328 29.076 -3.652 8.340 1.00 31.59 H new ATOM 1708 N VAL A 329 23.284 -5.210 12.904 1.00 23.82 N ATOM 1709 CA VAL A 329 21.945 -4.809 13.328 1.00 23.15 C ATOM 1710 C VAL A 329 20.992 -4.545 12.165 1.00 22.54 C ATOM 1711 O VAL A 329 21.375 -3.989 11.126 1.00 21.82 O ATOM 1712 CB VAL A 329 21.942 -3.669 14.422 1.00 24.13 C ATOM 1713 CG1 VAL A 329 23.328 -3.138 14.709 1.00 24.33 C ATOM 1714 CG2 VAL A 329 20.933 -2.551 14.119 1.00 23.45 C ATOM 0 H VAL A 329 23.728 -4.608 12.479 1.00 23.82 H new ATOM 0 HA VAL A 329 21.581 -5.587 13.779 1.00 23.15 H new ATOM 0 HB VAL A 329 21.635 -4.088 15.241 1.00 24.13 H new ATOM 0 HG11 VAL A 329 23.275 -2.443 15.384 1.00 24.33 H new ATOM 0 HG12 VAL A 329 23.891 -3.859 15.031 1.00 24.33 H new ATOM 0 HG13 VAL A 329 23.709 -2.770 13.896 1.00 24.33 H new ATOM 0 HG21 VAL A 329 20.973 -1.881 14.819 1.00 23.45 H new ATOM 0 HG22 VAL A 329 21.150 -2.141 13.267 1.00 23.45 H new ATOM 0 HG23 VAL A 329 20.038 -2.924 14.080 1.00 23.45 H new ATOM 1715 N PHE A 330 19.750 -4.991 12.343 1.00 21.67 N ATOM 1716 CA PHE A 330 18.711 -4.735 11.362 1.00 21.20 C ATOM 1717 C PHE A 330 17.500 -4.057 11.993 1.00 21.06 C ATOM 1718 O PHE A 330 16.611 -3.591 11.281 1.00 20.91 O ATOM 1719 CB PHE A 330 18.340 -6.007 10.574 1.00 21.33 C ATOM 1720 CG PHE A 330 17.532 -7.027 11.351 1.00 21.19 C ATOM 1721 CD1 PHE A 330 16.137 -7.046 11.255 1.00 20.45 C ATOM 1722 CD2 PHE A 330 18.162 -7.999 12.124 1.00 21.22 C ATOM 1723 CE1 PHE A 330 15.382 -8.001 11.942 1.00 21.65 C ATOM 1724 CE2 PHE A 330 17.412 -8.964 12.815 1.00 22.58 C ATOM 1725 CZ PHE A 330 16.014 -8.960 12.721 1.00 21.79 C ATOM 0 H PHE A 330 19.493 -5.444 13.027 1.00 21.67 H new ATOM 0 HA PHE A 330 19.069 -4.110 10.713 1.00 21.20 H new ATOM 0 HB2 PHE A 330 17.837 -5.748 9.786 1.00 21.33 H new ATOM 0 HB3 PHE A 330 19.156 -6.429 10.264 1.00 21.33 H new ATOM 0 HD1 PHE A 330 15.705 -6.414 10.726 1.00 20.45 H new ATOM 0 HD2 PHE A 330 19.090 -8.009 12.183 1.00 21.22 H new ATOM 0 HE1 PHE A 330 14.454 -7.994 11.877 1.00 21.65 H new ATOM 0 HE2 PHE A 330 17.842 -9.605 13.334 1.00 22.58 H new ATOM 0 HZ PHE A 330 15.513 -9.596 13.178 1.00 21.79 H new ATOM 1726 N GLY A 331 17.487 -3.988 13.326 1.00 20.72 N ATOM 1727 CA GLY A 331 16.419 -3.315 14.059 1.00 20.03 C ATOM 1728 C GLY A 331 16.370 -1.822 13.788 1.00 19.71 C ATOM 1729 O GLY A 331 17.348 -1.102 14.008 1.00 19.75 O ATOM 0 H GLY A 331 18.097 -4.330 13.827 1.00 20.72 H new ATOM 0 HA2 GLY A 331 15.567 -3.711 13.818 1.00 20.03 H new ATOM 0 HA3 GLY A 331 16.542 -3.463 15.010 1.00 20.03 H new ATOM 1730 N ALA A 332 15.214 -1.353 13.324 1.00 19.16 N ATOM 1731 CA ALA A 332 15.033 0.050 12.960 1.00 19.03 C ATOM 1732 C ALA A 332 15.225 1.022 14.125 1.00 19.11 C ATOM 1733 O ALA A 332 15.747 2.131 13.938 1.00 19.03 O ATOM 1734 CB ALA A 332 13.668 0.244 12.325 1.00 18.98 C ATOM 0 H ALA A 332 14.513 -1.839 13.211 1.00 19.16 H new ATOM 0 HA ALA A 332 15.732 0.262 12.322 1.00 19.03 H new ATOM 0 HB1 ALA A 332 13.552 1.177 12.085 1.00 18.98 H new ATOM 0 HB2 ALA A 332 13.600 -0.305 11.528 1.00 18.98 H new ATOM 0 HB3 ALA A 332 12.978 -0.015 12.955 1.00 18.98 H new ATOM 1735 N GLY A 333 14.811 0.601 15.319 1.00 18.81 N ATOM 1736 CA GLY A 333 14.947 1.406 16.540 1.00 19.15 C ATOM 1737 C GLY A 333 16.400 1.590 16.939 1.00 19.17 C ATOM 1738 O GLY A 333 16.756 2.586 17.570 1.00 19.46 O ATOM 0 H GLY A 333 14.440 -0.164 15.447 1.00 18.81 H new ATOM 0 HA2 GLY A 333 14.538 2.274 16.401 1.00 19.15 H new ATOM 0 HA3 GLY A 333 14.465 0.978 17.265 1.00 19.15 H new ATOM 1739 N LEU A 334 17.233 0.624 16.561 1.00 19.24 N ATOM 1740 CA LEU A 334 18.679 0.725 16.750 1.00 19.66 C ATOM 1741 C LEU A 334 19.297 1.574 15.644 1.00 19.63 C ATOM 1742 O LEU A 334 20.144 2.422 15.911 1.00 20.65 O ATOM 1743 CB LEU A 334 19.329 -0.663 16.791 1.00 19.43 C ATOM 1744 CG LEU A 334 18.935 -1.614 17.925 1.00 20.15 C ATOM 1745 CD1 LEU A 334 19.521 -2.997 17.702 1.00 21.15 C ATOM 1746 CD2 LEU A 334 19.377 -1.061 19.277 1.00 21.11 C ATOM 0 H LEU A 334 16.977 -0.108 16.188 1.00 19.24 H new ATOM 0 HA LEU A 334 18.844 1.156 17.603 1.00 19.66 H new ATOM 0 HB2 LEU A 334 19.133 -1.107 15.951 1.00 19.43 H new ATOM 0 HB3 LEU A 334 20.290 -0.539 16.829 1.00 19.43 H new ATOM 0 HG LEU A 334 17.968 -1.689 17.926 1.00 20.15 H new ATOM 0 HD11 LEU A 334 19.259 -3.581 18.431 1.00 21.15 H new ATOM 0 HD12 LEU A 334 19.190 -3.358 16.864 1.00 21.15 H new ATOM 0 HD13 LEU A 334 20.489 -2.937 17.668 1.00 21.15 H new ATOM 0 HD21 LEU A 334 19.118 -1.678 19.979 1.00 21.11 H new ATOM 0 HD22 LEU A 334 20.341 -0.952 19.283 1.00 21.11 H new ATOM 0 HD23 LEU A 334 18.954 -0.202 19.429 1.00 21.11 H new ATOM 1747 N LEU A 335 18.853 1.366 14.406 1.00 19.94 N ATOM 1748 CA LEU A 335 19.444 2.037 13.249 1.00 19.93 C ATOM 1749 C LEU A 335 19.176 3.549 13.187 1.00 20.40 C ATOM 1750 O LEU A 335 19.838 4.255 12.426 1.00 20.64 O ATOM 1751 CB LEU A 335 19.012 1.361 11.948 1.00 20.23 C ATOM 1752 CG LEU A 335 19.582 -0.046 11.722 1.00 19.88 C ATOM 1753 CD1 LEU A 335 18.703 -0.831 10.756 1.00 21.23 C ATOM 1754 CD2 LEU A 335 21.022 0.014 11.240 1.00 21.59 C ATOM 0 H LEU A 335 18.204 0.835 14.213 1.00 19.94 H new ATOM 0 HA LEU A 335 20.403 1.945 13.361 1.00 19.93 H new ATOM 0 HB2 LEU A 335 18.044 1.308 11.934 1.00 20.23 H new ATOM 0 HB3 LEU A 335 19.276 1.925 11.204 1.00 20.23 H new ATOM 0 HG LEU A 335 19.583 -0.513 12.572 1.00 19.88 H new ATOM 0 HD11 LEU A 335 19.077 -1.716 10.624 1.00 21.23 H new ATOM 0 HD12 LEU A 335 17.809 -0.909 11.123 1.00 21.23 H new ATOM 0 HD13 LEU A 335 18.663 -0.368 9.905 1.00 21.23 H new ATOM 0 HD21 LEU A 335 21.356 -0.887 11.106 1.00 21.59 H new ATOM 0 HD22 LEU A 335 21.063 0.502 10.403 1.00 21.59 H new ATOM 0 HD23 LEU A 335 21.567 0.465 11.904 1.00 21.59 H new ATOM 1755 N SER A 336 18.219 4.032 13.982 1.00 20.50 N ATOM 1756 CA SER A 336 17.900 5.462 14.031 1.00 20.94 C ATOM 1757 C SER A 336 18.404 6.178 15.298 1.00 21.42 C ATOM 1758 O SER A 336 18.206 7.386 15.449 1.00 21.70 O ATOM 1759 CB SER A 336 16.389 5.665 13.888 1.00 20.70 C ATOM 1760 OG SER A 336 15.692 5.032 14.952 1.00 19.66 O ATOM 0 H SER A 336 17.740 3.545 14.504 1.00 20.50 H new ATOM 0 HA SER A 336 18.373 5.866 13.287 1.00 20.94 H new ATOM 0 HB2 SER A 336 16.185 6.613 13.881 1.00 20.70 H new ATOM 0 HB3 SER A 336 16.089 5.304 13.039 1.00 20.70 H new ATOM 0 HG SER A 336 15.807 5.468 15.661 1.00 19.66 H new ATOM 1761 N SER A 337 19.034 5.430 16.201 1.00 22.21 N ATOM 1762 CA SER A 337 19.569 5.982 17.448 1.00 22.94 C ATOM 1763 C SER A 337 21.079 5.870 17.481 1.00 23.26 C ATOM 1764 O SER A 337 21.624 4.772 17.648 1.00 22.93 O ATOM 1765 CB SER A 337 18.982 5.261 18.666 1.00 22.99 C ATOM 1766 OG SER A 337 19.639 5.653 19.865 1.00 23.72 O ATOM 0 H SER A 337 19.164 4.585 16.109 1.00 22.21 H new ATOM 0 HA SER A 337 19.316 6.918 17.483 1.00 22.94 H new ATOM 0 HB2 SER A 337 18.035 5.457 18.735 1.00 22.99 H new ATOM 0 HB3 SER A 337 19.065 4.302 18.548 1.00 22.99 H new ATOM 0 HG SER A 337 19.826 6.471 19.827 1.00 23.72 H new ATOM 1767 N ILE A 338 21.748 7.008 17.327 1.00 24.03 N ATOM 1768 CA ILE A 338 23.209 7.070 17.417 1.00 24.52 C ATOM 1769 C ILE A 338 23.704 6.305 18.653 1.00 24.90 C ATOM 1770 O ILE A 338 24.583 5.452 18.546 1.00 25.15 O ATOM 1771 CB ILE A 338 23.721 8.539 17.425 1.00 24.80 C ATOM 1772 CG1 ILE A 338 23.371 9.229 16.103 1.00 24.63 C ATOM 1773 CG2 ILE A 338 25.242 8.587 17.682 1.00 24.53 C ATOM 1774 CD1 ILE A 338 23.183 10.739 16.191 1.00 23.61 C ATOM 0 H ILE A 338 21.372 7.765 17.168 1.00 24.03 H new ATOM 0 HA ILE A 338 23.574 6.643 16.626 1.00 24.52 H new ATOM 0 HB ILE A 338 23.281 9.015 18.147 1.00 24.80 H new ATOM 0 HG12 ILE A 338 24.073 9.042 15.461 1.00 24.63 H new ATOM 0 HG13 ILE A 338 22.556 8.835 15.755 1.00 24.63 H new ATOM 0 HG21 ILE A 338 25.541 9.510 17.683 1.00 24.53 H new ATOM 0 HG22 ILE A 338 25.438 8.183 18.542 1.00 24.53 H new ATOM 0 HG23 ILE A 338 25.704 8.099 16.983 1.00 24.53 H new ATOM 0 HD11 ILE A 338 22.965 11.090 15.313 1.00 23.61 H new ATOM 0 HD12 ILE A 338 22.461 10.940 16.807 1.00 23.61 H new ATOM 0 HD13 ILE A 338 24.003 11.149 16.508 1.00 23.61 H new ATOM 1775 N SER A 339 23.108 6.592 19.809 1.00 25.39 N ATOM 1776 CA SER A 339 23.574 6.032 21.077 1.00 25.85 C ATOM 1777 C SER A 339 23.289 4.538 21.254 1.00 25.66 C ATOM 1778 O SER A 339 24.182 3.792 21.648 1.00 25.26 O ATOM 1779 CB SER A 339 23.062 6.852 22.276 1.00 25.92 C ATOM 1780 OG SER A 339 21.699 7.221 22.119 1.00 27.88 O ATOM 0 H SER A 339 22.427 7.113 19.881 1.00 25.39 H new ATOM 0 HA SER A 339 24.541 6.102 21.046 1.00 25.85 H new ATOM 0 HB2 SER A 339 23.165 6.334 23.090 1.00 25.92 H new ATOM 0 HB3 SER A 339 23.604 7.650 22.377 1.00 25.92 H new ATOM 0 HG SER A 339 21.450 7.664 22.787 1.00 27.88 H new ATOM 1781 N GLU A 340 22.065 4.089 20.960 1.00 25.59 N ATOM 1782 CA GLU A 340 21.753 2.663 21.123 1.00 25.60 C ATOM 1783 C GLU A 340 22.411 1.756 20.077 1.00 25.48 C ATOM 1784 O GLU A 340 22.731 0.602 20.375 1.00 25.52 O ATOM 1785 CB GLU A 340 20.242 2.390 21.201 1.00 25.51 C ATOM 1786 CG GLU A 340 19.937 1.063 21.893 1.00 25.49 C ATOM 1787 CD GLU A 340 18.477 0.835 22.258 1.00 25.78 C ATOM 1788 OE1 GLU A 340 18.178 -0.280 22.727 1.00 26.40 O ATOM 1789 OE2 GLU A 340 17.633 1.741 22.092 1.00 27.35 O ATOM 0 H GLU A 340 21.417 4.577 20.673 1.00 25.59 H new ATOM 0 HA GLU A 340 22.146 2.431 21.979 1.00 25.60 H new ATOM 0 HB2 GLU A 340 19.808 3.112 21.682 1.00 25.51 H new ATOM 0 HB3 GLU A 340 19.869 2.381 20.306 1.00 25.51 H new ATOM 0 HG2 GLU A 340 20.226 0.340 21.314 1.00 25.49 H new ATOM 0 HG3 GLU A 340 20.469 1.008 22.702 1.00 25.49 H new ATOM 1790 N LEU A 341 22.614 2.273 18.864 1.00 25.54 N ATOM 1791 CA LEU A 341 23.302 1.522 17.813 1.00 25.51 C ATOM 1792 C LEU A 341 24.712 1.125 18.261 1.00 26.33 C ATOM 1793 O LEU A 341 25.127 -0.015 18.071 1.00 26.51 O ATOM 1794 CB LEU A 341 23.364 2.325 16.508 1.00 25.12 C ATOM 1795 CG LEU A 341 23.944 1.648 15.261 1.00 24.94 C ATOM 1796 CD1 LEU A 341 23.166 0.386 14.891 1.00 23.78 C ATOM 1797 CD2 LEU A 341 23.966 2.609 14.085 1.00 24.81 C ATOM 0 H LEU A 341 22.360 3.060 18.629 1.00 25.54 H new ATOM 0 HA LEU A 341 22.792 0.714 17.647 1.00 25.51 H new ATOM 0 HB2 LEU A 341 22.462 2.613 16.295 1.00 25.12 H new ATOM 0 HB3 LEU A 341 23.885 3.126 16.678 1.00 25.12 H new ATOM 0 HG LEU A 341 24.854 1.389 15.473 1.00 24.94 H new ATOM 0 HD11 LEU A 341 23.558 -0.016 14.100 1.00 23.78 H new ATOM 0 HD12 LEU A 341 23.204 -0.245 15.627 1.00 23.78 H new ATOM 0 HD13 LEU A 341 22.241 0.617 14.711 1.00 23.78 H new ATOM 0 HD21 LEU A 341 24.336 2.161 13.308 1.00 24.81 H new ATOM 0 HD22 LEU A 341 23.062 2.902 13.889 1.00 24.81 H new ATOM 0 HD23 LEU A 341 24.514 3.378 14.306 1.00 24.81 H new ATOM 1798 N LYS A 342 25.433 2.077 18.853 1.00 27.29 N ATOM 1799 CA LYS A 342 26.772 1.820 19.398 1.00 28.26 C ATOM 1800 C LYS A 342 26.690 0.835 20.557 1.00 28.80 C ATOM 1801 O LYS A 342 27.468 -0.120 20.626 1.00 29.21 O ATOM 1802 CB LYS A 342 27.423 3.121 19.871 1.00 28.11 C ATOM 1803 CG LYS A 342 27.936 4.018 18.755 1.00 28.66 C ATOM 1804 CD LYS A 342 28.790 5.163 19.302 1.00 29.15 C ATOM 1805 CE LYS A 342 27.928 6.287 19.865 1.00 30.67 C ATOM 1806 NZ LYS A 342 27.604 6.618 21.694 0.00 53.36 N ATOM 0 H LYS A 342 25.163 2.888 18.951 1.00 27.29 H new ATOM 0 HA LYS A 342 27.317 1.438 18.693 1.00 28.26 H new ATOM 0 HB2 LYS A 342 26.778 3.618 20.398 1.00 28.11 H new ATOM 0 HB3 LYS A 342 28.162 2.903 20.460 1.00 28.11 H new ATOM 0 HG2 LYS A 342 28.460 3.492 18.131 1.00 28.66 H new ATOM 0 HG3 LYS A 342 27.185 4.381 18.260 1.00 28.66 H new ATOM 0 HD2 LYS A 342 29.378 4.826 19.996 1.00 29.15 H new ATOM 0 HD3 LYS A 342 29.356 5.511 18.596 1.00 29.15 H new ATOM 0 HE2 LYS A 342 28.303 7.109 19.512 1.00 30.67 H new ATOM 0 HE3 LYS A 342 27.054 6.177 19.459 1.00 30.67 H new ATOM 0 HZ1 LYS A 342 27.072 7.327 21.778 0.00 53.36 H new ATOM 0 HZ2 LYS A 342 27.211 5.908 22.059 0.00 53.36 H new ATOM 0 HZ3 LYS A 342 28.376 6.776 22.109 0.00 53.36 H new ATOM 1807 N HIS A 343 25.726 1.056 21.450 1.00 29.40 N ATOM 1808 CA HIS A 343 25.551 0.205 22.622 1.00 30.35 C ATOM 1809 C HIS A 343 25.277 -1.253 22.259 1.00 30.66 C ATOM 1810 O HIS A 343 25.868 -2.167 22.853 1.00 30.29 O ATOM 1811 CB HIS A 343 24.443 0.745 23.528 1.00 30.44 C ATOM 1812 CG HIS A 343 24.094 -0.175 24.654 1.00 31.64 C ATOM 1813 ND1 HIS A 343 24.947 -0.412 25.710 1.00 32.59 N ATOM 1814 CD2 HIS A 343 22.995 -0.933 24.878 1.00 31.78 C ATOM 1815 CE1 HIS A 343 24.386 -1.271 26.541 1.00 33.13 C ATOM 1816 NE2 HIS A 343 23.200 -1.601 26.061 1.00 33.46 N ATOM 0 H HIS A 343 25.159 1.700 21.393 1.00 29.40 H new ATOM 0 HA HIS A 343 26.393 0.225 23.104 1.00 30.35 H new ATOM 0 HB2 HIS A 343 24.721 1.600 23.892 1.00 30.44 H new ATOM 0 HB3 HIS A 343 23.649 0.908 22.995 1.00 30.44 H new ATOM 0 HD2 HIS A 343 22.243 -0.991 24.334 1.00 31.78 H new ATOM 0 HE1 HIS A 343 24.762 -1.590 27.330 1.00 33.13 H new ATOM 0 HE2 HIS A 343 22.646 -2.146 26.429 1.00 33.46 H new ATOM 1817 N ALA A 344 24.390 -1.461 21.283 1.00 31.09 N ATOM 1818 CA ALA A 344 23.986 -2.802 20.848 1.00 31.63 C ATOM 1819 C ALA A 344 25.163 -3.709 20.479 1.00 32.19 C ATOM 1820 O ALA A 344 25.146 -4.898 20.785 1.00 31.85 O ATOM 1821 CB ALA A 344 23.009 -2.713 19.683 1.00 31.65 C ATOM 0 H ALA A 344 24.004 -0.825 20.852 1.00 31.09 H new ATOM 0 HA ALA A 344 23.552 -3.212 21.612 1.00 31.63 H new ATOM 0 HB1 ALA A 344 22.752 -3.607 19.407 1.00 31.65 H new ATOM 0 HB2 ALA A 344 22.220 -2.220 19.959 1.00 31.65 H new ATOM 0 HB3 ALA A 344 23.432 -2.255 18.940 1.00 31.65 H new ATOM 1822 N LEU A 345 26.176 -3.145 19.824 1.00 32.86 N ATOM 1823 CA LEU A 345 27.330 -3.932 19.372 1.00 33.82 C ATOM 1824 C LEU A 345 28.632 -3.673 20.155 1.00 34.90 C ATOM 1825 O LEU A 345 29.716 -4.041 19.688 1.00 35.00 O ATOM 1826 CB LEU A 345 27.568 -3.715 17.868 1.00 33.37 C ATOM 1827 CG LEU A 345 26.447 -4.020 16.861 1.00 32.83 C ATOM 1828 CD1 LEU A 345 26.945 -3.794 15.439 1.00 31.93 C ATOM 1829 CD2 LEU A 345 25.900 -5.437 17.009 1.00 31.75 C ATOM 0 H LEU A 345 26.217 -2.308 19.630 1.00 32.86 H new ATOM 0 HA LEU A 345 27.096 -4.857 19.549 1.00 33.82 H new ATOM 0 HB2 LEU A 345 27.820 -2.786 17.747 1.00 33.37 H new ATOM 0 HB3 LEU A 345 28.336 -4.252 17.617 1.00 33.37 H new ATOM 0 HG LEU A 345 25.716 -3.411 17.051 1.00 32.83 H new ATOM 0 HD11 LEU A 345 26.232 -3.989 14.811 1.00 31.93 H new ATOM 0 HD12 LEU A 345 27.222 -2.870 15.336 1.00 31.93 H new ATOM 0 HD13 LEU A 345 27.699 -4.379 15.263 1.00 31.93 H new ATOM 0 HD21 LEU A 345 25.198 -5.583 16.356 1.00 31.75 H new ATOM 0 HD22 LEU A 345 26.615 -6.077 16.864 1.00 31.75 H new ATOM 0 HD23 LEU A 345 25.539 -5.553 17.902 1.00 31.75 H new ATOM 1830 N SER A 346 28.516 -3.087 21.349 1.00 36.06 N ATOM 1831 CA SER A 346 29.671 -2.507 22.077 1.00 37.32 C ATOM 1832 C SER A 346 30.848 -3.408 22.557 1.00 38.29 C ATOM 1833 O SER A 346 32.000 -2.994 22.427 1.00 38.92 O ATOM 1834 CB SER A 346 29.208 -1.543 23.191 1.00 36.83 C ATOM 1835 OG SER A 346 28.223 -2.121 24.030 1.00 36.64 O ATOM 0 H SER A 346 27.768 -3.010 21.767 1.00 36.06 H new ATOM 0 HA SER A 346 30.108 -2.040 21.348 1.00 37.32 H new ATOM 0 HB2 SER A 346 29.973 -1.281 23.727 1.00 36.83 H new ATOM 0 HB3 SER A 346 28.853 -0.735 22.789 1.00 36.83 H new ATOM 0 HG SER A 346 27.499 -2.186 23.609 1.00 36.64 H new ATOM 1836 N GLY A 347 30.618 -4.601 23.114 1.00 39.24 N ATOM 1837 CA GLY A 347 29.316 -5.166 23.430 1.00 39.99 C ATOM 1838 C GLY A 347 29.173 -5.340 24.930 1.00 40.76 C ATOM 1839 O GLY A 347 29.696 -6.295 25.514 1.00 40.99 O ATOM 0 H GLY A 347 31.262 -5.129 23.328 1.00 39.24 H new ATOM 0 HA2 GLY A 347 28.614 -4.586 23.096 1.00 39.99 H new ATOM 0 HA3 GLY A 347 29.211 -6.022 22.986 1.00 39.99 H new ATOM 1840 N HIS A 348 28.470 -4.396 25.547 1.00 41.29 N ATOM 1841 CA HIS A 348 28.162 -4.424 26.972 1.00 41.72 C ATOM 1842 C HIS A 348 26.697 -4.787 27.205 1.00 41.75 C ATOM 1843 O HIS A 348 26.173 -4.625 28.310 1.00 41.97 O ATOM 1844 CB HIS A 348 28.471 -3.065 27.599 1.00 41.91 C ATOM 1845 CG HIS A 348 29.888 -2.623 27.412 1.00 42.71 C ATOM 1846 ND1 HIS A 348 30.246 -1.618 26.541 1.00 43.34 N ATOM 1847 CD2 HIS A 348 31.038 -3.056 27.980 1.00 43.64 C ATOM 1848 CE1 HIS A 348 31.555 -1.447 26.582 1.00 43.86 C ATOM 1849 NE2 HIS A 348 32.060 -2.308 27.447 1.00 44.20 N ATOM 0 H HIS A 348 28.153 -3.708 25.141 1.00 41.29 H new ATOM 0 HA HIS A 348 28.714 -5.102 27.391 1.00 41.72 H new ATOM 0 HB2 HIS A 348 27.880 -2.399 27.215 1.00 41.91 H new ATOM 0 HB3 HIS A 348 28.276 -3.104 28.548 1.00 41.91 H new ATOM 0 HD2 HIS A 348 31.121 -3.733 28.612 1.00 43.64 H new ATOM 0 HE1 HIS A 348 32.039 -0.826 26.086 1.00 43.86 H new ATOM 0 HE2 HIS A 348 32.893 -2.388 27.645 1.00 44.20 H new ATOM 1850 N ALA A 349 26.045 -5.276 26.153 1.00 41.76 N ATOM 1851 CA ALA A 349 24.634 -5.645 26.200 1.00 41.64 C ATOM 1852 C ALA A 349 24.452 -7.157 26.110 1.00 41.48 C ATOM 1853 O ALA A 349 25.292 -7.856 25.545 1.00 41.61 O ATOM 1854 CB ALA A 349 23.881 -4.953 25.076 1.00 41.67 C ATOM 0 H ALA A 349 26.413 -5.404 25.386 1.00 41.76 H new ATOM 0 HA ALA A 349 24.273 -5.355 27.052 1.00 41.64 H new ATOM 0 HB1 ALA A 349 22.944 -5.202 25.112 1.00 41.67 H new ATOM 0 HB2 ALA A 349 23.964 -3.992 25.175 1.00 41.67 H new ATOM 0 HB3 ALA A 349 24.254 -5.223 24.222 1.00 41.67 H new ATOM 1855 N LYS A 350 23.356 -7.655 26.677 1.00 41.44 N ATOM 1856 CA LYS A 350 23.034 -9.078 26.632 1.00 41.48 C ATOM 1857 C LYS A 350 22.357 -9.434 25.309 1.00 41.20 C ATOM 1858 O LYS A 350 21.452 -8.730 24.851 1.00 41.32 O ATOM 1859 CB LYS A 350 22.169 -9.473 27.843 1.00 41.75 C ATOM 1860 CG LYS A 350 21.391 -10.796 27.735 1.00 42.68 C ATOM 1861 CD LYS A 350 22.273 -12.050 27.691 1.00 45.04 C ATOM 1862 CE LYS A 350 22.650 -12.555 29.079 1.00 46.27 C ATOM 1863 NZ LYS A 350 23.857 -11.860 29.602 1.00 47.21 N ATOM 0 H LYS A 350 22.778 -7.177 27.098 1.00 41.44 H new ATOM 0 HA LYS A 350 23.858 -9.588 26.683 1.00 41.48 H new ATOM 0 HB2 LYS A 350 22.744 -9.523 28.622 1.00 41.75 H new ATOM 0 HB3 LYS A 350 21.532 -8.760 28.006 1.00 41.75 H new ATOM 0 HG2 LYS A 350 20.787 -10.866 28.491 1.00 42.68 H new ATOM 0 HG3 LYS A 350 20.843 -10.772 26.935 1.00 42.68 H new ATOM 0 HD2 LYS A 350 21.806 -12.752 27.212 1.00 45.04 H new ATOM 0 HD3 LYS A 350 23.081 -11.855 27.192 1.00 45.04 H new ATOM 0 HE2 LYS A 350 21.907 -12.418 29.687 1.00 46.27 H new ATOM 0 HE3 LYS A 350 22.815 -13.510 29.043 1.00 46.27 H new ATOM 0 HZ1 LYS A 350 24.342 -12.429 30.085 1.00 47.21 H new ATOM 0 HZ2 LYS A 350 24.345 -11.559 28.921 1.00 47.21 H new ATOM 0 HZ3 LYS A 350 23.608 -11.175 30.113 1.00 47.21 H new ATOM 1864 N VAL A 351 22.822 -10.518 24.696 1.00 40.79 N ATOM 1865 CA VAL A 351 22.280 -11.001 23.431 1.00 40.23 C ATOM 1866 C VAL A 351 21.885 -12.470 23.544 1.00 39.97 C ATOM 1867 O VAL A 351 22.653 -13.290 24.054 1.00 40.01 O ATOM 1868 CB VAL A 351 23.282 -10.822 22.263 1.00 40.28 C ATOM 1869 CG1 VAL A 351 23.065 -11.346 21.183 0.00 57.57 C ATOM 1870 CG2 VAL A 351 23.527 -9.336 21.981 1.00 40.08 C ATOM 0 H VAL A 351 23.466 -10.997 25.005 1.00 40.79 H new ATOM 0 HA VAL A 351 21.494 -10.467 23.237 1.00 40.23 H new ATOM 0 HB VAL A 351 24.041 -11.307 22.623 1.00 40.28 H new ATOM 0 HG11 VAL A 351 23.786 -11.134 20.570 0.00 57.57 H new ATOM 0 HG12 VAL A 351 23.008 -12.308 21.295 0.00 57.57 H new ATOM 0 HG13 VAL A 351 22.228 -11.013 20.824 0.00 57.57 H new ATOM 0 HG21 VAL A 351 24.156 -9.245 21.248 1.00 40.08 H new ATOM 0 HG22 VAL A 351 22.689 -8.909 21.743 1.00 40.08 H new ATOM 0 HG23 VAL A 351 23.891 -8.912 22.774 1.00 40.08 H new ATOM 1871 N LYS A 352 20.680 -12.786 23.078 1.00 39.19 N ATOM 1872 CA LYS A 352 20.158 -14.152 23.092 1.00 38.70 C ATOM 1873 C LYS A 352 19.774 -14.559 21.671 1.00 37.95 C ATOM 1874 O LYS A 352 19.552 -13.687 20.825 1.00 37.92 O ATOM 1875 CB LYS A 352 18.934 -14.249 24.014 1.00 38.86 C ATOM 1876 CG LYS A 352 19.203 -13.981 25.493 1.00 40.26 C ATOM 1877 CD LYS A 352 19.611 -15.244 26.257 1.00 43.03 C ATOM 1878 CE LYS A 352 19.830 -14.937 27.741 1.00 44.27 C ATOM 1879 NZ LYS A 352 19.946 -16.167 28.589 1.00 45.60 N ATOM 0 H LYS A 352 20.137 -12.210 22.742 1.00 39.19 H new ATOM 0 HA LYS A 352 20.843 -14.751 23.428 1.00 38.70 H new ATOM 0 HB2 LYS A 352 18.264 -13.620 23.704 1.00 38.86 H new ATOM 0 HB3 LYS A 352 18.552 -15.136 23.926 1.00 38.86 H new ATOM 0 HG2 LYS A 352 19.905 -13.317 25.575 1.00 40.26 H new ATOM 0 HG3 LYS A 352 18.407 -13.604 25.900 1.00 40.26 H new ATOM 0 HD2 LYS A 352 18.923 -15.921 26.161 1.00 43.03 H new ATOM 0 HD3 LYS A 352 20.424 -15.609 25.875 1.00 43.03 H new ATOM 0 HE2 LYS A 352 20.636 -14.406 27.840 1.00 44.27 H new ATOM 0 HE3 LYS A 352 19.093 -14.396 28.065 1.00 44.27 H new ATOM 0 HZ1 LYS A 352 20.072 -15.932 29.438 1.00 45.60 H new ATOM 0 HZ2 LYS A 352 19.199 -16.646 28.522 1.00 45.60 H new ATOM 0 HZ3 LYS A 352 20.637 -16.655 28.312 1.00 45.60 H new ATOM 1880 N PRO A 353 19.693 -15.878 21.390 1.00 37.22 N ATOM 1881 CA PRO A 353 19.243 -16.274 20.055 1.00 36.58 C ATOM 1882 C PRO A 353 17.768 -15.932 19.857 1.00 36.02 C ATOM 1883 O PRO A 353 16.993 -15.979 20.821 1.00 35.89 O ATOM 1884 CB PRO A 353 19.432 -17.799 20.046 1.00 36.64 C ATOM 1885 CG PRO A 353 20.280 -18.114 21.240 1.00 36.95 C ATOM 1886 CD PRO A 353 19.991 -17.047 22.238 1.00 37.19 C ATOM 0 HA PRO A 353 19.730 -15.821 19.349 1.00 36.58 H new ATOM 0 HB2 PRO A 353 18.578 -18.256 20.096 1.00 36.64 H new ATOM 0 HB3 PRO A 353 19.862 -18.091 19.227 1.00 36.64 H new ATOM 0 HG2 PRO A 353 20.067 -18.991 21.596 1.00 36.95 H new ATOM 0 HG3 PRO A 353 21.221 -18.125 21.005 1.00 36.95 H new ATOM 0 HD2 PRO A 353 19.240 -17.280 22.807 1.00 37.19 H new ATOM 0 HD3 PRO A 353 20.749 -16.885 22.821 1.00 37.19 H new ATOM 1887 N PHE A 354 17.389 -15.573 18.632 1.00 35.22 N ATOM 1888 CA PHE A 354 15.982 -15.324 18.329 1.00 34.66 C ATOM 1889 C PHE A 354 15.219 -16.636 18.284 1.00 34.58 C ATOM 1890 O PHE A 354 15.522 -17.521 17.482 1.00 34.40 O ATOM 1891 CB PHE A 354 15.788 -14.544 17.022 1.00 34.37 C ATOM 1892 CG PHE A 354 14.344 -14.446 16.586 1.00 33.30 C ATOM 1893 CD1 PHE A 354 13.411 -13.765 17.364 1.00 32.97 C ATOM 1894 CD2 PHE A 354 13.919 -15.041 15.401 1.00 33.25 C ATOM 1895 CE1 PHE A 354 12.069 -13.673 16.968 1.00 31.64 C ATOM 1896 CE2 PHE A 354 12.581 -14.954 14.994 1.00 32.37 C ATOM 1897 CZ PHE A 354 11.659 -14.267 15.783 1.00 32.21 C ATOM 0 H PHE A 354 17.926 -15.469 17.968 1.00 35.22 H new ATOM 0 HA PHE A 354 15.629 -14.768 19.041 1.00 34.66 H new ATOM 0 HB2 PHE A 354 16.147 -13.649 17.132 1.00 34.37 H new ATOM 0 HB3 PHE A 354 16.302 -14.972 16.319 1.00 34.37 H new ATOM 0 HD1 PHE A 354 13.682 -13.365 18.159 1.00 32.97 H new ATOM 0 HD2 PHE A 354 14.531 -15.502 14.873 1.00 33.25 H new ATOM 0 HE1 PHE A 354 11.456 -13.216 17.497 1.00 31.64 H new ATOM 0 HE2 PHE A 354 12.309 -15.353 14.200 1.00 32.37 H new ATOM 0 HZ PHE A 354 10.770 -14.207 15.515 1.00 32.21 H new ATOM 1898 N ASP A 355 14.224 -16.739 19.159 1.00 34.60 N ATOM 1899 CA ASP A 355 13.414 -17.939 19.304 1.00 34.77 C ATOM 1900 C ASP A 355 12.027 -17.483 19.741 1.00 34.73 C ATOM 1901 O ASP A 355 11.838 -17.114 20.903 1.00 34.72 O ATOM 1902 CB ASP A 355 14.040 -18.869 20.349 1.00 34.74 C ATOM 1903 CG ASP A 355 13.359 -20.227 20.423 1.00 35.38 C ATOM 1904 OD1 ASP A 355 12.526 -20.554 19.547 1.00 35.06 O ATOM 1905 OD2 ASP A 355 13.669 -20.977 21.371 1.00 36.47 O ATOM 0 H ASP A 355 13.999 -16.103 19.692 1.00 34.60 H new ATOM 0 HA ASP A 355 13.361 -18.434 18.472 1.00 34.77 H new ATOM 0 HB2 ASP A 355 14.979 -18.995 20.141 1.00 34.74 H new ATOM 0 HB3 ASP A 355 13.997 -18.444 21.220 1.00 34.74 H new ATOM 1906 N PRO A 356 11.058 -17.488 18.806 1.00 34.73 N ATOM 1907 CA PRO A 356 9.751 -16.870 19.037 1.00 35.04 C ATOM 1908 C PRO A 356 9.083 -17.261 20.360 1.00 35.23 C ATOM 1909 O PRO A 356 8.602 -16.385 21.077 1.00 34.95 O ATOM 1910 CB PRO A 356 8.931 -17.335 17.834 1.00 34.86 C ATOM 1911 CG PRO A 356 9.942 -17.522 16.756 1.00 35.10 C ATOM 1912 CD PRO A 356 11.150 -18.081 17.459 1.00 34.71 C ATOM 0 HA PRO A 356 9.829 -15.906 19.117 1.00 35.04 H new ATOM 0 HB2 PRO A 356 8.459 -18.160 18.024 1.00 34.86 H new ATOM 0 HB3 PRO A 356 8.263 -16.677 17.584 1.00 34.86 H new ATOM 0 HG2 PRO A 356 9.620 -18.130 16.072 1.00 35.10 H new ATOM 0 HG3 PRO A 356 10.147 -16.682 16.316 1.00 35.10 H new ATOM 0 HD2 PRO A 356 11.129 -19.050 17.492 1.00 34.71 H new ATOM 0 HD3 PRO A 356 11.973 -17.830 17.012 1.00 34.71 H new ATOM 1913 N LYS A 357 9.083 -18.550 20.696 1.00 35.79 N ATOM 1914 CA LYS A 357 8.442 -19.008 21.936 1.00 36.46 C ATOM 1915 C LYS A 357 9.077 -18.434 23.215 1.00 36.28 C ATOM 1916 O LYS A 357 8.392 -18.275 24.227 1.00 36.65 O ATOM 1917 CB LYS A 357 8.329 -20.544 21.989 1.00 36.55 C ATOM 1918 CG LYS A 357 9.638 -21.315 21.832 1.00 37.20 C ATOM 1919 CD LYS A 357 9.456 -22.771 22.260 1.00 37.41 C ATOM 1920 CE LYS A 357 10.611 -23.651 21.790 1.00 39.15 C ATOM 1921 NZ LYS A 357 10.497 -23.988 20.333 1.00 40.15 N ATOM 0 H LYS A 357 9.445 -19.173 20.226 1.00 35.79 H new ATOM 0 HA LYS A 357 7.542 -18.646 21.911 1.00 36.46 H new ATOM 0 HB2 LYS A 357 7.927 -20.792 22.836 1.00 36.55 H new ATOM 0 HB3 LYS A 357 7.719 -20.830 21.291 1.00 36.55 H new ATOM 0 HG2 LYS A 357 9.933 -21.278 20.909 1.00 37.20 H new ATOM 0 HG3 LYS A 357 10.331 -20.899 22.368 1.00 37.20 H new ATOM 0 HD2 LYS A 357 9.387 -22.817 23.226 1.00 37.41 H new ATOM 0 HD3 LYS A 357 8.623 -23.112 21.899 1.00 37.41 H new ATOM 0 HE2 LYS A 357 11.452 -23.195 21.952 1.00 39.15 H new ATOM 0 HE3 LYS A 357 10.627 -24.469 22.311 1.00 39.15 H new ATOM 0 HZ1 LYS A 357 11.184 -24.500 20.092 1.00 40.15 H new ATOM 0 HZ2 LYS A 357 9.736 -24.425 20.188 1.00 40.15 H new ATOM 0 HZ3 LYS A 357 10.504 -23.238 19.853 1.00 40.15 H new ATOM 1922 N ILE A 358 10.365 -18.092 23.152 1.00 36.04 N ATOM 1923 CA ILE A 358 11.042 -17.378 24.240 1.00 35.71 C ATOM 1924 C ILE A 358 10.937 -15.856 24.074 1.00 35.26 C ATOM 1925 O ILE A 358 10.615 -15.134 25.019 1.00 34.95 O ATOM 1926 CB ILE A 358 12.539 -17.759 24.333 1.00 35.74 C ATOM 1927 CG1 ILE A 358 12.712 -19.129 24.994 1.00 36.30 C ATOM 1928 CG2 ILE A 358 13.389 -16.627 24.998 0.00 50.24 C ATOM 1929 CD1 ILE A 358 13.873 -19.963 24.923 0.00 54.21 C ATOM 0 H ILE A 358 10.871 -18.267 22.479 1.00 36.04 H new ATOM 0 HA ILE A 358 10.590 -17.645 25.056 1.00 35.71 H new ATOM 0 HB ILE A 358 12.890 -17.844 23.433 1.00 35.74 H new ATOM 0 HG12 ILE A 358 12.553 -18.984 25.940 1.00 36.30 H new ATOM 0 HG13 ILE A 358 11.980 -19.672 24.663 1.00 36.30 H new ATOM 0 HG21 ILE A 358 14.318 -16.901 25.039 0.00 50.24 H new ATOM 0 HG22 ILE A 358 13.315 -15.815 24.472 0.00 50.24 H new ATOM 0 HG23 ILE A 358 13.062 -16.461 25.896 0.00 50.24 H new ATOM 0 HD11 ILE A 358 13.719 -20.776 25.430 0.00 54.21 H new ATOM 0 HD12 ILE A 358 14.053 -20.189 23.997 0.00 54.21 H new ATOM 0 HD13 ILE A 358 14.634 -19.490 25.294 0.00 54.21 H new ATOM 1930 N THR A 359 11.203 -15.385 22.860 1.00 35.11 N ATOM 1931 CA THR A 359 11.258 -13.952 22.557 1.00 34.69 C ATOM 1932 C THR A 359 9.940 -13.224 22.841 1.00 34.82 C ATOM 1933 O THR A 359 9.950 -12.100 23.341 1.00 34.41 O ATOM 1934 CB THR A 359 11.729 -13.723 21.096 1.00 34.76 C ATOM 1935 OG1 THR A 359 13.052 -14.249 20.943 1.00 34.36 O ATOM 1936 CG2 THR A 359 11.732 -12.237 20.726 1.00 33.79 C ATOM 0 H THR A 359 11.358 -15.890 22.181 1.00 35.11 H new ATOM 0 HA THR A 359 11.910 -13.562 23.160 1.00 34.69 H new ATOM 0 HB THR A 359 11.108 -14.177 20.505 1.00 34.76 H new ATOM 0 HG1 THR A 359 13.589 -13.797 21.405 1.00 34.36 H new ATOM 0 HG21 THR A 359 12.031 -12.132 19.809 1.00 33.79 H new ATOM 0 HG22 THR A 359 10.835 -11.879 20.816 1.00 33.79 H new ATOM 0 HG23 THR A 359 12.332 -11.757 21.318 1.00 33.79 H new ATOM 1937 N CYS A 360 8.815 -13.875 22.549 1.00 35.46 N ATOM 1938 CA CYS A 360 7.493 -13.259 22.729 1.00 36.01 C ATOM 1939 C CYS A 360 7.141 -12.916 24.188 1.00 36.55 C ATOM 1940 O CYS A 360 6.273 -12.073 24.442 1.00 36.80 O ATOM 1941 CB CYS A 360 6.396 -14.126 22.103 1.00 36.01 C ATOM 1942 SG CYS A 360 5.998 -15.629 23.023 1.00 36.05 S ATOM 0 H CYS A 360 8.792 -14.679 22.244 1.00 35.46 H new ATOM 0 HA CYS A 360 7.543 -12.409 22.264 1.00 36.01 H new ATOM 0 HB2 CYS A 360 5.590 -13.593 22.016 1.00 36.01 H new ATOM 0 HB3 CYS A 360 6.670 -14.374 21.206 1.00 36.01 H new ATOM 0 HG CYS A 360 5.441 -15.337 24.045 1.00 36.05 H new ATOM 1943 N LYS A 361 7.819 -13.561 25.135 1.00 36.84 N ATOM 1944 CA LYS A 361 7.586 -13.306 26.555 1.00 37.45 C ATOM 1945 C LYS A 361 8.403 -12.134 27.091 1.00 37.41 C ATOM 1946 O LYS A 361 8.117 -11.614 28.172 1.00 37.50 O ATOM 1947 CB LYS A 361 7.864 -14.561 27.389 1.00 37.69 C ATOM 1948 CG LYS A 361 6.695 -15.534 27.480 1.00 38.75 C ATOM 1949 CD LYS A 361 6.805 -16.647 26.457 1.00 40.83 C ATOM 1950 CE LYS A 361 5.876 -17.818 26.788 1.00 41.70 C ATOM 1951 NZ LYS A 361 4.438 -17.557 26.453 1.00 42.36 N ATOM 0 H LYS A 361 8.422 -14.153 24.975 1.00 36.84 H new ATOM 0 HA LYS A 361 6.650 -13.065 26.636 1.00 37.45 H new ATOM 0 HB2 LYS A 361 8.627 -15.025 27.009 1.00 37.69 H new ATOM 0 HB3 LYS A 361 8.114 -14.290 28.286 1.00 37.69 H new ATOM 0 HG2 LYS A 361 6.661 -15.916 28.371 1.00 38.75 H new ATOM 0 HG3 LYS A 361 5.863 -15.053 27.346 1.00 38.75 H new ATOM 0 HD2 LYS A 361 6.588 -16.300 25.577 1.00 40.83 H new ATOM 0 HD3 LYS A 361 7.722 -16.962 26.419 1.00 40.83 H new ATOM 0 HE2 LYS A 361 6.175 -18.605 26.305 1.00 41.70 H new ATOM 0 HE3 LYS A 361 5.948 -18.021 27.734 1.00 41.70 H new ATOM 0 HZ1 LYS A 361 3.949 -18.269 26.667 1.00 42.36 H new ATOM 0 HZ2 LYS A 361 4.149 -16.851 26.912 1.00 42.36 H new ATOM 0 HZ3 LYS A 361 4.361 -17.395 25.581 1.00 42.36 H new ATOM 1952 N GLN A 362 9.410 -11.718 26.328 1.00 37.25 N ATOM 1953 CA GLN A 362 10.289 -10.627 26.728 1.00 37.33 C ATOM 1954 C GLN A 362 9.548 -9.293 26.793 1.00 37.47 C ATOM 1955 O GLN A 362 8.769 -8.965 25.896 1.00 37.45 O ATOM 1956 CB GLN A 362 11.469 -10.528 25.762 1.00 37.28 C ATOM 1957 CG GLN A 362 12.673 -9.801 26.326 1.00 37.57 C ATOM 1958 CD GLN A 362 13.349 -10.574 27.445 1.00 38.14 C ATOM 1959 OE1 GLN A 362 13.405 -11.807 27.425 1.00 38.90 O ATOM 1960 NE2 GLN A 362 13.877 -9.852 28.421 1.00 38.45 N ATOM 0 H GLN A 362 9.602 -12.062 25.563 1.00 37.25 H new ATOM 0 HA GLN A 362 10.616 -10.823 27.620 1.00 37.33 H new ATOM 0 HB2 GLN A 362 11.737 -11.423 25.502 1.00 37.28 H new ATOM 0 HB3 GLN A 362 11.177 -10.073 24.956 1.00 37.28 H new ATOM 0 HG2 GLN A 362 13.313 -9.642 25.615 1.00 37.57 H new ATOM 0 HG3 GLN A 362 12.396 -8.933 26.658 1.00 37.57 H new ATOM 0 HE21 GLN A 362 13.819 -8.994 28.401 1.00 38.45 H new ATOM 0 HE22 GLN A 362 14.278 -10.241 29.075 1.00 38.45 H new ATOM 1961 N GLU A 363 9.794 -8.534 27.857 1.00 37.60 N ATOM 1962 CA GLU A 363 9.177 -7.222 28.027 1.00 38.10 C ATOM 1963 C GLU A 363 9.779 -6.211 27.047 1.00 37.80 C ATOM 1964 O GLU A 363 11.002 -6.103 26.930 1.00 37.67 O ATOM 1965 CB GLU A 363 9.335 -6.731 29.472 1.00 37.99 C ATOM 1966 CG GLU A 363 8.545 -5.466 29.801 1.00 38.79 C ATOM 1967 CD GLU A 363 8.876 -4.875 31.171 1.00 39.43 C ATOM 1968 OE1 GLU A 363 9.493 -5.571 32.012 1.00 41.53 O ATOM 1969 OE2 GLU A 363 8.512 -3.704 31.406 1.00 40.35 O ATOM 0 H GLU A 363 10.320 -8.763 28.497 1.00 37.60 H new ATOM 0 HA GLU A 363 8.230 -7.306 27.836 1.00 38.10 H new ATOM 0 HB2 GLU A 363 9.056 -7.438 30.074 1.00 37.99 H new ATOM 0 HB3 GLU A 363 10.275 -6.566 29.644 1.00 37.99 H new ATOM 0 HG2 GLU A 363 8.719 -4.799 29.119 1.00 38.79 H new ATOM 0 HG3 GLU A 363 7.597 -5.668 29.765 1.00 38.79 H new ATOM 1970 N CYS A 364 8.909 -5.491 26.339 1.00 37.72 N ATOM 1971 CA CYS A 364 9.331 -4.424 25.434 1.00 37.44 C ATOM 1972 C CYS A 364 9.507 -3.135 26.224 1.00 37.68 C ATOM 1973 O CYS A 364 8.559 -2.640 26.834 1.00 37.85 O ATOM 1974 CB CYS A 364 8.307 -4.217 24.318 1.00 37.33 C ATOM 1975 SG CYS A 364 7.960 -5.676 23.316 1.00 35.80 S ATOM 0 H CYS A 364 8.058 -5.608 26.370 1.00 37.72 H new ATOM 0 HA CYS A 364 10.174 -4.676 25.026 1.00 37.44 H new ATOM 0 HB2 CYS A 364 7.477 -3.909 24.713 1.00 37.33 H new ATOM 0 HB3 CYS A 364 8.624 -3.509 23.735 1.00 37.33 H new ATOM 0 HG CYS A 364 8.683 -5.686 22.359 1.00 35.80 H new ATOM 1976 N LEU A 365 10.724 -2.599 26.215 1.00 37.73 N ATOM 1977 CA LEU A 365 11.039 -1.395 26.979 1.00 37.79 C ATOM 1978 C LEU A 365 10.911 -0.113 26.163 1.00 38.01 C ATOM 1979 O LEU A 365 11.317 -0.050 25.001 1.00 37.77 O ATOM 1980 CB LEU A 365 12.438 -1.488 27.599 1.00 37.74 C ATOM 1981 CG LEU A 365 12.778 -2.698 28.482 1.00 37.87 C ATOM 1982 CD1 LEU A 365 14.148 -2.522 29.124 1.00 36.96 C ATOM 1983 CD2 LEU A 365 11.712 -2.963 29.551 1.00 37.82 C ATOM 0 H LEU A 365 11.386 -2.920 25.770 1.00 37.73 H new ATOM 0 HA LEU A 365 10.376 -1.347 27.686 1.00 37.79 H new ATOM 0 HB2 LEU A 365 13.082 -1.463 26.874 1.00 37.74 H new ATOM 0 HB3 LEU A 365 12.577 -0.688 28.130 1.00 37.74 H new ATOM 0 HG LEU A 365 12.797 -3.476 27.903 1.00 37.87 H new ATOM 0 HD11 LEU A 365 14.348 -3.293 29.678 1.00 36.96 H new ATOM 0 HD12 LEU A 365 14.822 -2.439 28.431 1.00 36.96 H new ATOM 0 HD13 LEU A 365 14.148 -1.722 29.673 1.00 36.96 H new ATOM 0 HD21 LEU A 365 11.970 -3.733 30.081 1.00 37.82 H new ATOM 0 HD22 LEU A 365 11.631 -2.187 30.127 1.00 37.82 H new ATOM 0 HD23 LEU A 365 10.860 -3.137 29.122 1.00 37.82 H new ATOM 1984 N ILE A 366 10.327 0.898 26.796 1.00 38.30 N ATOM 1985 CA ILE A 366 10.243 2.246 26.257 1.00 38.76 C ATOM 1986 C ILE A 366 10.901 3.208 27.246 1.00 38.71 C ATOM 1987 O ILE A 366 10.949 2.923 28.447 1.00 38.95 O ATOM 1988 CB ILE A 366 8.773 2.664 25.985 1.00 39.02 C ATOM 1989 CG1 ILE A 366 7.806 1.994 26.973 1.00 39.50 C ATOM 1990 CG2 ILE A 366 8.365 2.277 24.577 1.00 39.40 C ATOM 1991 CD1 ILE A 366 7.602 2.740 28.276 1.00 40.10 C ATOM 0 H ILE A 366 9.960 0.815 27.569 1.00 38.30 H new ATOM 0 HA ILE A 366 10.707 2.275 25.405 1.00 38.76 H new ATOM 0 HB ILE A 366 8.724 3.626 26.096 1.00 39.02 H new ATOM 0 HG12 ILE A 366 6.945 1.887 26.539 1.00 39.50 H new ATOM 0 HG13 ILE A 366 8.135 1.104 27.174 1.00 39.50 H new ATOM 0 HG21 ILE A 366 7.446 2.544 24.421 1.00 39.40 H new ATOM 0 HG22 ILE A 366 8.943 2.723 23.938 1.00 39.40 H new ATOM 0 HG23 ILE A 366 8.445 1.316 24.469 1.00 39.40 H new ATOM 0 HD11 ILE A 366 6.981 2.249 28.836 1.00 40.10 H new ATOM 0 HD12 ILE A 366 8.452 2.827 28.736 1.00 40.10 H new ATOM 0 HD13 ILE A 366 7.243 3.622 28.091 1.00 40.10 H new ATOM 1992 N THR A 367 11.414 4.332 26.741 1.00 38.39 N ATOM 1993 CA THR A 367 12.086 5.351 27.570 1.00 38.21 C ATOM 1994 C THR A 367 13.575 5.036 27.792 1.00 37.51 C ATOM 1995 O THR A 367 14.365 5.934 28.092 1.00 37.63 O ATOM 1996 CB THR A 367 11.349 5.584 28.938 1.00 38.10 C ATOM 1997 OG1 THR A 367 9.957 5.819 28.697 1.00 39.46 O ATOM 1998 CG2 THR A 367 11.924 6.767 29.699 1.00 38.94 C ATOM 0 H THR A 367 11.384 4.530 25.905 1.00 38.39 H new ATOM 0 HA THR A 367 12.038 6.179 27.068 1.00 38.21 H new ATOM 0 HB THR A 367 11.474 4.788 29.478 1.00 38.10 H new ATOM 0 HG1 THR A 367 9.563 5.942 29.428 1.00 39.46 H new ATOM 0 HG21 THR A 367 11.445 6.878 30.535 1.00 38.94 H new ATOM 0 HG22 THR A 367 12.863 6.608 29.884 1.00 38.94 H new ATOM 0 HG23 THR A 367 11.832 7.571 29.165 1.00 38.94 H new ATOM 1999 N THR A 368 13.953 3.769 27.621 1.00 36.84 N ATOM 2000 CA THR A 368 15.339 3.330 27.811 1.00 36.09 C ATOM 2001 C THR A 368 15.848 2.445 26.669 1.00 35.55 C ATOM 2002 O THR A 368 15.061 1.951 25.861 1.00 35.34 O ATOM 2003 CB THR A 368 15.492 2.518 29.116 1.00 36.35 C ATOM 2004 OG1 THR A 368 14.617 1.384 29.075 1.00 36.34 O ATOM 2005 CG2 THR A 368 15.170 3.373 30.341 1.00 35.94 C ATOM 0 H THR A 368 13.414 3.139 27.392 1.00 36.84 H new ATOM 0 HA THR A 368 15.861 4.147 27.842 1.00 36.09 H new ATOM 0 HB THR A 368 16.414 2.224 29.188 1.00 36.35 H new ATOM 0 HG1 THR A 368 14.987 0.760 28.652 1.00 36.34 H new ATOM 0 HG21 THR A 368 15.274 2.840 31.144 1.00 35.94 H new ATOM 0 HG22 THR A 368 15.775 4.130 30.376 1.00 35.94 H new ATOM 0 HG23 THR A 368 14.256 3.693 30.282 1.00 35.94 H new ATOM 2006 N PHE A 369 17.167 2.242 26.623 1.00 34.65 N ATOM 2007 CA PHE A 369 17.772 1.167 25.835 1.00 33.92 C ATOM 2008 C PHE A 369 17.113 -0.157 26.229 1.00 33.80 C ATOM 2009 O PHE A 369 16.607 -0.294 27.350 1.00 33.59 O ATOM 2010 CB PHE A 369 19.276 1.063 26.131 1.00 33.65 C ATOM 2011 CG PHE A 369 20.111 2.205 25.589 1.00 33.02 C ATOM 2012 CD1 PHE A 369 19.530 3.312 24.970 1.00 32.19 C ATOM 2013 CD2 PHE A 369 21.499 2.171 25.723 1.00 32.57 C ATOM 2014 CE1 PHE A 369 20.316 4.360 24.488 1.00 31.71 C ATOM 2015 CE2 PHE A 369 22.293 3.214 25.242 1.00 32.53 C ATOM 2016 CZ PHE A 369 21.699 4.310 24.623 1.00 32.28 C ATOM 0 H PHE A 369 17.736 2.726 27.049 1.00 34.65 H new ATOM 0 HA PHE A 369 17.643 1.356 24.892 1.00 33.92 H new ATOM 0 HB2 PHE A 369 19.401 1.015 27.092 1.00 33.65 H new ATOM 0 HB3 PHE A 369 19.609 0.231 25.760 1.00 33.65 H new ATOM 0 HD1 PHE A 369 18.606 3.352 24.877 1.00 32.19 H new ATOM 0 HD2 PHE A 369 21.901 1.443 26.139 1.00 32.57 H new ATOM 0 HE1 PHE A 369 19.915 5.091 24.077 1.00 31.71 H new ATOM 0 HE2 PHE A 369 23.218 3.176 25.335 1.00 32.53 H new ATOM 0 HZ PHE A 369 22.225 5.006 24.301 1.00 32.28 H new ATOM 2017 N GLN A 370 17.112 -1.131 25.323 1.00 33.54 N ATOM 2018 CA GLN A 370 16.627 -2.469 25.666 1.00 33.57 C ATOM 2019 C GLN A 370 17.597 -3.176 26.618 1.00 34.14 C ATOM 2020 O GLN A 370 18.782 -2.837 26.669 1.00 33.93 O ATOM 2021 CB GLN A 370 16.394 -3.326 24.411 1.00 33.42 C ATOM 2022 CG GLN A 370 15.381 -2.759 23.420 1.00 31.88 C ATOM 2023 CD GLN A 370 14.059 -2.372 24.061 1.00 30.94 C ATOM 2024 OE1 GLN A 370 13.419 -3.323 24.734 1.00 30.61 O flip ATOM 2025 NE2 GLN A 370 13.627 -1.224 23.960 1.00 28.96 N flip ATOM 0 H GLN A 370 17.384 -1.042 24.512 1.00 33.54 H new ATOM 0 HA GLN A 370 15.775 -2.359 26.116 1.00 33.57 H new ATOM 0 HB2 GLN A 370 17.242 -3.443 23.954 1.00 33.42 H new ATOM 0 HB3 GLN A 370 16.097 -4.207 24.688 1.00 33.42 H new ATOM 0 HG2 GLN A 370 15.763 -1.979 22.988 1.00 31.88 H new ATOM 0 HG3 GLN A 370 15.216 -3.416 22.726 1.00 31.88 H new ATOM 0 HE21 GLN A 370 14.070 -0.635 23.516 1.00 28.96 H new ATOM 0 HE22 GLN A 370 12.882 -1.010 24.334 1.00 28.96 H new ATOM 2026 N ASP A 371 17.080 -4.149 27.369 1.00 34.63 N ATOM 2027 CA ASP A 371 17.888 -4.938 28.301 1.00 35.06 C ATOM 2028 C ASP A 371 18.441 -6.207 27.660 1.00 34.49 C ATOM 2029 O ASP A 371 19.410 -6.794 28.150 1.00 34.74 O ATOM 2030 CB ASP A 371 17.080 -5.282 29.554 1.00 35.61 C ATOM 2031 CG ASP A 371 17.379 -4.349 30.713 1.00 37.98 C ATOM 2032 OD1 ASP A 371 17.733 -4.854 31.799 1.00 40.80 O ATOM 2033 OD2 ASP A 371 17.277 -3.114 30.539 1.00 40.75 O ATOM 0 H ASP A 371 16.249 -4.371 27.352 1.00 34.63 H new ATOM 0 HA ASP A 371 18.648 -4.390 28.553 1.00 35.06 H new ATOM 0 HB2 ASP A 371 16.133 -5.241 29.346 1.00 35.61 H new ATOM 0 HB3 ASP A 371 17.273 -6.195 29.819 1.00 35.61 H new ATOM 2034 N VAL A 372 17.816 -6.628 26.564 1.00 33.62 N ATOM 2035 CA VAL A 372 18.287 -7.772 25.789 1.00 32.61 C ATOM 2036 C VAL A 372 18.009 -7.543 24.303 1.00 32.08 C ATOM 2037 O VAL A 372 16.987 -6.952 23.945 1.00 31.70 O ATOM 2038 CB VAL A 372 17.631 -9.098 26.261 1.00 32.83 C ATOM 2039 CG1 VAL A 372 16.141 -9.119 25.943 1.00 32.68 C ATOM 2040 CG2 VAL A 372 18.334 -10.305 25.646 1.00 32.68 C ATOM 0 H VAL A 372 17.107 -6.258 26.249 1.00 33.62 H new ATOM 0 HA VAL A 372 19.243 -7.854 25.930 1.00 32.61 H new ATOM 0 HB VAL A 372 17.731 -9.150 27.224 1.00 32.83 H new ATOM 0 HG11 VAL A 372 15.757 -9.956 26.247 1.00 32.68 H new ATOM 0 HG12 VAL A 372 15.703 -8.380 26.394 1.00 32.68 H new ATOM 0 HG13 VAL A 372 16.013 -9.035 24.985 1.00 32.68 H new ATOM 0 HG21 VAL A 372 17.908 -11.120 25.955 1.00 32.68 H new ATOM 0 HG22 VAL A 372 18.275 -10.256 24.679 1.00 32.68 H new ATOM 0 HG23 VAL A 372 19.267 -10.307 25.913 1.00 32.68 H new ATOM 2041 N TYR A 373 18.934 -7.996 23.460 1.00 31.03 N ATOM 2042 CA TYR A 373 18.742 -8.011 22.015 1.00 30.39 C ATOM 2043 C TYR A 373 18.766 -9.448 21.530 1.00 30.06 C ATOM 2044 O TYR A 373 19.581 -10.252 21.993 1.00 30.33 O ATOM 2045 CB TYR A 373 19.823 -7.193 21.297 1.00 30.02 C ATOM 2046 CG TYR A 373 19.950 -5.773 21.802 1.00 29.83 C ATOM 2047 CD1 TYR A 373 21.064 -5.375 22.540 1.00 29.93 C ATOM 2048 CD2 TYR A 373 18.945 -4.832 21.565 1.00 28.09 C ATOM 2049 CE1 TYR A 373 21.182 -4.081 23.017 1.00 29.45 C ATOM 2050 CE2 TYR A 373 19.053 -3.536 22.036 1.00 28.07 C ATOM 2051 CZ TYR A 373 20.174 -3.166 22.766 1.00 29.23 C ATOM 2052 OH TYR A 373 20.294 -1.886 23.244 1.00 29.23 O ATOM 0 H TYR A 373 19.695 -8.305 23.714 1.00 31.03 H new ATOM 0 HA TYR A 373 17.885 -7.605 21.810 1.00 30.39 H new ATOM 0 HB2 TYR A 373 20.677 -7.641 21.399 1.00 30.02 H new ATOM 0 HB3 TYR A 373 19.625 -7.173 20.348 1.00 30.02 H new ATOM 0 HD1 TYR A 373 21.740 -5.990 22.715 1.00 29.93 H new ATOM 0 HD2 TYR A 373 18.190 -5.081 21.082 1.00 28.09 H new ATOM 0 HE1 TYR A 373 21.934 -3.828 23.503 1.00 29.45 H new ATOM 0 HE2 TYR A 373 18.380 -2.917 21.865 1.00 28.07 H new ATOM 0 HH TYR A 373 19.601 -1.451 23.057 1.00 29.23 H new ATOM 2053 N PHE A 374 17.864 -9.769 20.608 1.00 29.37 N ATOM 2054 CA PHE A 374 17.795 -11.099 20.016 1.00 28.93 C ATOM 2055 C PHE A 374 18.463 -11.166 18.648 1.00 29.24 C ATOM 2056 O PHE A 374 18.300 -10.264 17.814 1.00 28.97 O ATOM 2057 CB PHE A 374 16.343 -11.582 19.954 1.00 28.95 C ATOM 2058 CG PHE A 374 15.724 -11.779 21.310 1.00 28.47 C ATOM 2059 CD1 PHE A 374 15.060 -10.736 21.943 1.00 28.26 C ATOM 2060 CD2 PHE A 374 15.835 -13.002 21.970 1.00 29.49 C ATOM 2061 CE1 PHE A 374 14.504 -10.905 23.204 1.00 28.94 C ATOM 2062 CE2 PHE A 374 15.278 -13.180 23.232 1.00 29.38 C ATOM 2063 CZ PHE A 374 14.610 -12.131 23.849 1.00 28.84 C ATOM 0 H PHE A 374 17.274 -9.220 20.308 1.00 29.37 H new ATOM 0 HA PHE A 374 18.296 -11.698 20.592 1.00 28.93 H new ATOM 0 HB2 PHE A 374 15.816 -10.939 19.455 1.00 28.95 H new ATOM 0 HB3 PHE A 374 16.308 -12.419 19.464 1.00 28.95 H new ATOM 0 HD1 PHE A 374 14.987 -9.913 21.516 1.00 28.26 H new ATOM 0 HD2 PHE A 374 16.286 -13.706 21.562 1.00 29.49 H new ATOM 0 HE1 PHE A 374 14.061 -10.199 23.616 1.00 28.94 H new ATOM 0 HE2 PHE A 374 15.353 -14.001 23.662 1.00 29.38 H new ATOM 0 HZ PHE A 374 14.235 -12.249 24.692 1.00 28.84 H new ATOM 2064 N VAL A 375 19.216 -12.245 18.437 1.00 29.37 N ATOM 2065 CA VAL A 375 20.025 -12.448 17.241 1.00 29.97 C ATOM 2066 C VAL A 375 19.365 -13.465 16.302 1.00 30.21 C ATOM 2067 O VAL A 375 19.150 -14.618 16.677 1.00 30.13 O ATOM 2068 CB VAL A 375 21.454 -12.951 17.609 1.00 29.77 C ATOM 2069 CG1 VAL A 375 22.355 -12.962 16.386 1.00 30.09 C ATOM 2070 CG2 VAL A 375 22.063 -12.097 18.713 1.00 30.39 C ATOM 0 H VAL A 375 19.270 -12.893 19.000 1.00 29.37 H new ATOM 0 HA VAL A 375 20.094 -11.591 16.792 1.00 29.97 H new ATOM 0 HB VAL A 375 21.375 -13.860 17.937 1.00 29.77 H new ATOM 0 HG11 VAL A 375 23.237 -13.277 16.637 1.00 30.09 H new ATOM 0 HG12 VAL A 375 21.980 -13.552 15.713 1.00 30.09 H new ATOM 0 HG13 VAL A 375 22.423 -12.064 16.026 1.00 30.09 H new ATOM 0 HG21 VAL A 375 22.950 -12.427 18.926 1.00 30.39 H new ATOM 0 HG22 VAL A 375 22.124 -11.176 18.414 1.00 30.39 H new ATOM 0 HG23 VAL A 375 21.503 -12.143 19.504 1.00 30.39 H new ATOM 2071 N SER A 376 19.039 -13.015 15.090 1.00 30.50 N ATOM 2072 CA SER A 376 18.510 -13.881 14.036 1.00 31.03 C ATOM 2073 C SER A 376 19.644 -14.328 13.119 1.00 31.62 C ATOM 2074 O SER A 376 20.644 -13.625 12.971 1.00 31.82 O ATOM 2075 CB SER A 376 17.441 -13.141 13.217 1.00 30.99 C ATOM 2076 OG SER A 376 16.311 -12.803 14.014 1.00 30.56 O ATOM 0 H SER A 376 19.119 -12.192 14.855 1.00 30.50 H new ATOM 0 HA SER A 376 18.102 -14.659 14.448 1.00 31.03 H new ATOM 0 HB2 SER A 376 17.824 -12.334 12.838 1.00 30.99 H new ATOM 0 HB3 SER A 376 17.159 -13.697 12.474 1.00 30.99 H new ATOM 0 HG SER A 376 15.895 -13.503 14.222 1.00 30.56 H new ATOM 2077 N GLU A 377 19.483 -15.495 12.504 1.00 32.30 N ATOM 2078 CA GLU A 377 20.480 -16.036 11.574 1.00 33.15 C ATOM 2079 C GLU A 377 20.449 -15.306 10.232 1.00 32.91 C ATOM 2080 O GLU A 377 21.493 -14.966 9.663 1.00 33.20 O ATOM 2081 CB GLU A 377 20.245 -17.535 11.364 1.00 33.61 C ATOM 2082 CG GLU A 377 20.526 -18.389 12.594 1.00 36.22 C ATOM 2083 CD GLU A 377 22.011 -18.559 12.858 1.00 39.81 C ATOM 2084 OE1 GLU A 377 22.487 -18.062 13.906 1.00 41.67 O ATOM 2085 OE2 GLU A 377 22.702 -19.174 12.009 1.00 41.21 O ATOM 0 H GLU A 377 18.794 -15.998 12.612 1.00 32.30 H new ATOM 0 HA GLU A 377 21.357 -15.900 11.966 1.00 33.15 H new ATOM 0 HB2 GLU A 377 19.325 -17.673 11.090 1.00 33.61 H new ATOM 0 HB3 GLU A 377 20.807 -17.841 10.635 1.00 33.61 H new ATOM 0 HG2 GLU A 377 20.107 -17.982 13.369 1.00 36.22 H new ATOM 0 HG3 GLU A 377 20.119 -19.262 12.478 1.00 36.22 H new ATOM 2086 N SER A 378 19.238 -15.066 9.742 1.00 32.38 N ATOM 2087 CA SER A 378 19.004 -14.362 8.493 1.00 31.93 C ATOM 2088 C SER A 378 17.528 -14.003 8.457 1.00 31.45 C ATOM 2089 O SER A 378 16.751 -14.492 9.282 1.00 31.00 O ATOM 2090 CB SER A 378 19.344 -15.256 7.298 1.00 32.02 C ATOM 2091 OG SER A 378 18.517 -16.408 7.286 1.00 32.94 O ATOM 0 H SER A 378 18.515 -15.314 10.137 1.00 32.38 H new ATOM 0 HA SER A 378 19.563 -13.571 8.440 1.00 31.93 H new ATOM 0 HB2 SER A 378 19.228 -14.760 6.473 1.00 32.02 H new ATOM 0 HB3 SER A 378 20.276 -15.521 7.341 1.00 32.02 H new ATOM 0 HG SER A 378 18.714 -16.888 6.625 1.00 32.94 H new ATOM 2092 N PHE A 379 17.143 -13.152 7.507 1.00 31.06 N ATOM 2093 CA PHE A 379 15.732 -12.827 7.305 1.00 30.59 C ATOM 2094 C PHE A 379 14.963 -14.075 6.863 1.00 30.79 C ATOM 2095 O PHE A 379 13.815 -14.281 7.262 1.00 30.63 O ATOM 2096 CB PHE A 379 15.551 -11.694 6.283 1.00 30.32 C ATOM 2097 CG PHE A 379 16.256 -10.402 6.645 1.00 30.06 C ATOM 2098 CD1 PHE A 379 16.680 -9.532 5.642 1.00 29.37 C ATOM 2099 CD2 PHE A 379 16.492 -10.051 7.975 1.00 29.86 C ATOM 2100 CE1 PHE A 379 17.322 -8.333 5.955 1.00 29.32 C ATOM 2101 CE2 PHE A 379 17.148 -8.856 8.294 1.00 29.83 C ATOM 2102 CZ PHE A 379 17.558 -8.000 7.281 1.00 28.87 C ATOM 0 H PHE A 379 17.683 -12.753 6.969 1.00 31.06 H new ATOM 0 HA PHE A 379 15.374 -12.516 8.151 1.00 30.59 H new ATOM 0 HB2 PHE A 379 15.877 -11.996 5.421 1.00 30.32 H new ATOM 0 HB3 PHE A 379 14.603 -11.514 6.181 1.00 30.32 H new ATOM 0 HD1 PHE A 379 16.533 -9.754 4.751 1.00 29.37 H new ATOM 0 HD2 PHE A 379 16.210 -10.617 8.657 1.00 29.86 H new ATOM 0 HE1 PHE A 379 17.591 -7.758 5.276 1.00 29.32 H new ATOM 0 HE2 PHE A 379 17.309 -8.636 9.183 1.00 29.83 H new ATOM 0 HZ PHE A 379 17.991 -7.204 7.491 1.00 28.87 H new ATOM 2103 N GLU A 380 15.606 -14.911 6.051 1.00 30.98 N ATOM 2104 CA GLU A 380 15.021 -16.181 5.632 1.00 31.44 C ATOM 2105 C GLU A 380 14.714 -17.073 6.839 1.00 31.07 C ATOM 2106 O GLU A 380 13.604 -17.604 6.958 1.00 30.88 O ATOM 2107 CB GLU A 380 15.945 -16.906 4.650 1.00 31.70 C ATOM 2108 CG GLU A 380 15.972 -16.306 3.241 1.00 33.98 C ATOM 2109 CD GLU A 380 16.937 -15.130 3.085 1.00 36.06 C ATOM 2110 OE1 GLU A 380 17.571 -14.707 4.080 1.00 37.60 O ATOM 2111 OE2 GLU A 380 17.065 -14.631 1.947 1.00 37.58 O ATOM 0 H GLU A 380 16.389 -14.759 5.729 1.00 30.98 H new ATOM 0 HA GLU A 380 14.184 -15.988 5.181 1.00 31.44 H new ATOM 0 HB2 GLU A 380 16.846 -16.901 5.008 1.00 31.70 H new ATOM 0 HB3 GLU A 380 15.669 -17.834 4.589 1.00 31.70 H new ATOM 0 HG2 GLU A 380 16.217 -17.000 2.609 1.00 33.98 H new ATOM 0 HG3 GLU A 380 15.078 -16.012 3.007 1.00 33.98 H new ATOM 2112 N ASP A 381 15.690 -17.211 7.738 1.00 30.62 N ATOM 2113 CA ASP A 381 15.532 -18.055 8.924 1.00 30.56 C ATOM 2114 C ASP A 381 14.490 -17.521 9.907 1.00 30.30 C ATOM 2115 O ASP A 381 13.680 -18.293 10.441 1.00 30.11 O ATOM 2116 CB ASP A 381 16.866 -18.266 9.649 1.00 30.85 C ATOM 2117 CG ASP A 381 16.786 -19.370 10.691 1.00 31.63 C ATOM 2118 OD1 ASP A 381 16.555 -20.536 10.308 1.00 32.71 O ATOM 2119 OD2 ASP A 381 16.944 -19.075 11.892 1.00 33.36 O ATOM 0 H ASP A 381 16.455 -16.822 7.679 1.00 30.62 H new ATOM 0 HA ASP A 381 15.211 -18.908 8.593 1.00 30.56 H new ATOM 0 HB2 ASP A 381 17.553 -18.485 9.001 1.00 30.85 H new ATOM 0 HB3 ASP A 381 17.134 -17.438 10.078 1.00 30.85 H new ATOM 2120 N ALA A 382 14.519 -16.210 10.145 1.00 29.48 N ATOM 2121 CA ALA A 382 13.576 -15.563 11.051 1.00 29.02 C ATOM 2122 C ALA A 382 12.144 -15.808 10.579 1.00 28.78 C ATOM 2123 O ALA A 382 11.258 -16.098 11.386 1.00 28.26 O ATOM 2124 CB ALA A 382 13.864 -14.069 11.143 1.00 29.06 C ATOM 0 H ALA A 382 15.086 -15.673 9.785 1.00 29.48 H new ATOM 0 HA ALA A 382 13.680 -15.946 11.936 1.00 29.02 H new ATOM 0 HB1 ALA A 382 13.230 -13.654 11.748 1.00 29.06 H new ATOM 0 HB2 ALA A 382 14.765 -13.933 11.476 1.00 29.06 H new ATOM 0 HB3 ALA A 382 13.781 -13.668 10.263 1.00 29.06 H new ATOM 2125 N LYS A 383 11.946 -15.702 9.266 1.00 28.68 N ATOM 2126 CA LYS A 383 10.657 -15.967 8.627 1.00 29.15 C ATOM 2127 C LYS A 383 10.203 -17.412 8.852 1.00 29.02 C ATOM 2128 O LYS A 383 9.032 -17.654 9.137 1.00 29.14 O ATOM 2129 CB LYS A 383 10.737 -15.654 7.126 1.00 28.94 C ATOM 2130 CG LYS A 383 9.397 -15.701 6.388 1.00 28.88 C ATOM 2131 CD LYS A 383 9.586 -15.651 4.877 1.00 29.81 C ATOM 2132 CE LYS A 383 10.397 -16.845 4.384 1.00 30.74 C ATOM 2133 NZ LYS A 383 10.724 -16.758 2.943 1.00 32.54 N ATOM 0 H LYS A 383 12.564 -15.471 8.714 1.00 28.68 H new ATOM 0 HA LYS A 383 9.996 -15.387 9.036 1.00 29.15 H new ATOM 0 HB2 LYS A 383 11.123 -14.772 7.013 1.00 28.94 H new ATOM 0 HB3 LYS A 383 11.344 -16.285 6.709 1.00 28.94 H new ATOM 0 HG2 LYS A 383 8.923 -16.512 6.629 1.00 28.88 H new ATOM 0 HG3 LYS A 383 8.845 -14.955 6.671 1.00 28.88 H new ATOM 0 HD2 LYS A 383 8.720 -15.642 4.440 1.00 29.81 H new ATOM 0 HD3 LYS A 383 10.036 -14.827 4.632 1.00 29.81 H new ATOM 0 HE2 LYS A 383 11.219 -16.906 4.895 1.00 30.74 H new ATOM 0 HE3 LYS A 383 9.899 -17.660 4.550 1.00 30.74 H new ATOM 0 HZ1 LYS A 383 11.012 -17.550 2.655 1.00 32.54 H new ATOM 0 HZ2 LYS A 383 9.997 -16.523 2.487 1.00 32.54 H new ATOM 0 HZ3 LYS A 383 11.361 -16.149 2.819 1.00 32.54 H new ATOM 2134 N GLU A 384 11.131 -18.359 8.727 1.00 29.42 N ATOM 2135 CA GLU A 384 10.817 -19.782 8.922 1.00 29.85 C ATOM 2136 C GLU A 384 10.460 -20.096 10.376 1.00 29.63 C ATOM 2137 O GLU A 384 9.523 -20.859 10.640 1.00 29.73 O ATOM 2138 CB GLU A 384 11.966 -20.682 8.446 1.00 30.14 C ATOM 2139 CG GLU A 384 12.256 -20.628 6.940 1.00 32.20 C ATOM 2140 CD GLU A 384 11.143 -21.201 6.067 1.00 34.95 C ATOM 2141 OE1 GLU A 384 10.257 -21.926 6.585 1.00 36.66 O ATOM 2142 OE2 GLU A 384 11.161 -20.927 4.844 1.00 36.95 O ATOM 0 H GLU A 384 11.953 -18.201 8.529 1.00 29.42 H new ATOM 0 HA GLU A 384 10.036 -19.971 8.378 1.00 29.85 H new ATOM 0 HB2 GLU A 384 12.772 -20.434 8.925 1.00 30.14 H new ATOM 0 HB3 GLU A 384 11.762 -21.599 8.689 1.00 30.14 H new ATOM 0 HG2 GLU A 384 12.412 -19.705 6.684 1.00 32.20 H new ATOM 0 HG3 GLU A 384 13.076 -21.114 6.761 1.00 32.20 H new ATOM 2143 N LYS A 385 11.201 -19.504 11.312 1.00 29.41 N ATOM 2144 CA LYS A 385 10.889 -19.637 12.738 1.00 29.07 C ATOM 2145 C LYS A 385 9.530 -19.018 13.077 1.00 29.01 C ATOM 2146 O LYS A 385 8.773 -19.573 13.870 1.00 28.53 O ATOM 2147 CB LYS A 385 11.986 -19.016 13.602 1.00 29.41 C ATOM 2148 CG LYS A 385 13.259 -19.846 13.681 1.00 29.45 C ATOM 2149 CD LYS A 385 14.270 -19.202 14.610 1.00 31.08 C ATOM 2150 CE LYS A 385 15.552 -20.024 14.682 1.00 32.26 C ATOM 2151 NZ LYS A 385 15.358 -21.279 15.450 1.00 34.36 N ATOM 0 H LYS A 385 11.891 -19.019 11.143 1.00 29.41 H new ATOM 0 HA LYS A 385 10.844 -20.586 12.934 1.00 29.07 H new ATOM 0 HB2 LYS A 385 12.204 -18.139 13.249 1.00 29.41 H new ATOM 0 HB3 LYS A 385 11.642 -18.883 14.499 1.00 29.41 H new ATOM 0 HG2 LYS A 385 13.048 -20.739 13.996 1.00 29.45 H new ATOM 0 HG3 LYS A 385 13.643 -19.941 12.795 1.00 29.45 H new ATOM 0 HD2 LYS A 385 14.474 -18.306 14.299 1.00 31.08 H new ATOM 0 HD3 LYS A 385 13.888 -19.115 15.497 1.00 31.08 H new ATOM 0 HE2 LYS A 385 15.851 -20.237 13.784 1.00 32.26 H new ATOM 0 HE3 LYS A 385 16.252 -19.496 15.096 1.00 32.26 H new ATOM 0 HZ1 LYS A 385 16.129 -21.720 15.498 1.00 34.36 H new ATOM 0 HZ2 LYS A 385 15.077 -21.084 16.272 1.00 34.36 H new ATOM 0 HZ3 LYS A 385 14.751 -21.786 15.042 1.00 34.36 H new ATOM 2152 N MET A 386 9.218 -17.876 12.466 1.00 28.66 N ATOM 2153 CA MET A 386 7.916 -17.241 12.671 1.00 28.63 C ATOM 2154 C MET A 386 6.770 -18.074 12.095 1.00 29.17 C ATOM 2155 O MET A 386 5.692 -18.156 12.691 1.00 28.98 O ATOM 2156 CB MET A 386 7.902 -15.821 12.100 1.00 28.38 C ATOM 2157 CG MET A 386 8.560 -14.798 13.017 1.00 27.26 C ATOM 2158 SD MET A 386 7.917 -14.832 14.707 1.00 26.06 S ATOM 2159 CE MET A 386 6.331 -14.016 14.487 1.00 25.71 C ATOM 0 H MET A 386 9.743 -17.454 11.931 1.00 28.66 H new ATOM 0 HA MET A 386 7.774 -17.186 13.629 1.00 28.63 H new ATOM 0 HB2 MET A 386 8.357 -15.819 11.243 1.00 28.38 H new ATOM 0 HB3 MET A 386 6.984 -15.555 11.934 1.00 28.38 H new ATOM 0 HG2 MET A 386 9.516 -14.960 13.038 1.00 27.26 H new ATOM 0 HG3 MET A 386 8.431 -13.911 12.647 1.00 27.26 H new ATOM 0 HE1 MET A 386 6.008 -13.698 15.345 1.00 25.71 H new ATOM 0 HE2 MET A 386 6.435 -13.264 13.883 1.00 25.71 H new ATOM 0 HE3 MET A 386 5.693 -14.644 14.114 1.00 25.71 H new ATOM 2160 N ARG A 387 7.013 -18.700 10.947 1.00 29.70 N ATOM 2161 CA ARG A 387 6.022 -19.578 10.333 1.00 30.36 C ATOM 2162 C ARG A 387 5.691 -20.766 11.232 1.00 31.53 C ATOM 2163 O ARG A 387 4.519 -21.101 11.410 1.00 31.41 O ATOM 2164 CB ARG A 387 6.491 -20.055 8.965 1.00 30.42 C ATOM 2165 CG ARG A 387 6.409 -18.984 7.889 1.00 29.50 C ATOM 2166 CD ARG A 387 6.955 -19.493 6.570 1.00 27.68 C ATOM 2167 NE ARG A 387 6.842 -18.478 5.525 1.00 27.14 N ATOM 2168 CZ ARG A 387 7.309 -18.610 4.287 1.00 26.91 C ATOM 2169 NH1 ARG A 387 7.946 -19.716 3.916 1.00 26.70 N ATOM 2170 NH2 ARG A 387 7.150 -17.620 3.415 1.00 25.92 N ATOM 0 H ARG A 387 7.748 -18.629 10.506 1.00 29.70 H new ATOM 0 HA ARG A 387 5.210 -19.061 10.215 1.00 30.36 H new ATOM 0 HB2 ARG A 387 7.408 -20.364 9.035 1.00 30.42 H new ATOM 0 HB3 ARG A 387 5.955 -20.817 8.695 1.00 30.42 H new ATOM 0 HG2 ARG A 387 5.487 -18.706 7.775 1.00 29.50 H new ATOM 0 HG3 ARG A 387 6.909 -18.201 8.169 1.00 29.50 H new ATOM 0 HD2 ARG A 387 7.885 -19.747 6.678 1.00 27.68 H new ATOM 0 HD3 ARG A 387 6.472 -20.291 6.303 1.00 27.68 H new ATOM 0 HE ARG A 387 6.445 -17.742 5.725 1.00 27.14 H new ATOM 0 HH11 ARG A 387 8.060 -20.356 4.479 1.00 26.70 H new ATOM 0 HH12 ARG A 387 8.244 -19.792 3.113 1.00 26.70 H new ATOM 0 HH21 ARG A 387 6.747 -16.898 3.652 1.00 25.92 H new ATOM 0 HH22 ARG A 387 7.450 -17.701 2.613 1.00 25.92 H new ATOM 2171 N GLU A 388 6.716 -21.391 11.814 1.00 32.51 N ATOM 2172 CA GLU A 388 6.473 -22.540 12.690 1.00 33.99 C ATOM 2173 C GLU A 388 5.777 -22.100 13.979 1.00 33.97 C ATOM 2174 O GLU A 388 4.914 -22.811 14.497 1.00 34.15 O ATOM 2175 CB GLU A 388 7.755 -23.350 12.965 1.00 33.79 C ATOM 2176 CG GLU A 388 8.768 -22.684 13.893 1.00 35.76 C ATOM 2177 CD GLU A 388 9.733 -23.675 14.546 1.00 36.05 C ATOM 2178 OE1 GLU A 388 9.369 -24.865 14.700 1.00 39.11 O ATOM 2179 OE2 GLU A 388 10.853 -23.256 14.916 1.00 38.30 O ATOM 0 H GLU A 388 7.542 -21.172 11.718 1.00 32.51 H new ATOM 0 HA GLU A 388 5.874 -23.143 12.223 1.00 33.99 H new ATOM 0 HB2 GLU A 388 7.503 -24.205 13.348 1.00 33.79 H new ATOM 0 HB3 GLU A 388 8.189 -23.536 12.118 1.00 33.79 H new ATOM 0 HG2 GLU A 388 9.278 -22.030 13.389 1.00 35.76 H new ATOM 0 HG3 GLU A 388 8.293 -22.200 14.587 1.00 35.76 H new ATOM 2180 N PHE A 389 6.128 -20.907 14.461 1.00 34.14 N ATOM 2181 CA PHE A 389 5.572 -20.366 15.694 1.00 34.65 C ATOM 2182 C PHE A 389 4.098 -19.985 15.583 1.00 35.04 C ATOM 2183 O PHE A 389 3.324 -20.246 16.503 1.00 35.05 O ATOM 2184 CB PHE A 389 6.388 -19.161 16.169 1.00 34.47 C ATOM 2185 CG PHE A 389 5.807 -18.467 17.369 1.00 34.57 C ATOM 2186 CD1 PHE A 389 5.849 -19.066 18.628 1.00 34.15 C ATOM 2187 CD2 PHE A 389 5.220 -17.214 17.243 1.00 33.95 C ATOM 2188 CE1 PHE A 389 5.310 -18.422 19.744 1.00 34.68 C ATOM 2189 CE2 PHE A 389 4.681 -16.565 18.349 1.00 34.65 C ATOM 2190 CZ PHE A 389 4.726 -17.169 19.603 1.00 34.39 C ATOM 0 H PHE A 389 6.698 -20.389 14.078 1.00 34.14 H new ATOM 0 HA PHE A 389 5.627 -21.080 16.348 1.00 34.65 H new ATOM 0 HB2 PHE A 389 7.288 -19.454 16.380 1.00 34.47 H new ATOM 0 HB3 PHE A 389 6.461 -18.524 15.441 1.00 34.47 H new ATOM 0 HD1 PHE A 389 6.240 -19.904 18.725 1.00 34.15 H new ATOM 0 HD2 PHE A 389 5.187 -16.804 16.409 1.00 33.95 H new ATOM 0 HE1 PHE A 389 5.342 -18.831 20.579 1.00 34.68 H new ATOM 0 HE2 PHE A 389 4.290 -15.727 18.251 1.00 34.65 H new ATOM 0 HZ PHE A 389 4.367 -16.735 20.343 1.00 34.39 H new ATOM 2191 N THR A 390 3.718 -19.366 14.466 1.00 35.59 N ATOM 2192 CA THR A 390 2.342 -18.884 14.285 1.00 36.59 C ATOM 2193 C THR A 390 1.332 -20.029 14.188 1.00 37.24 C ATOM 2194 O THR A 390 0.156 -19.859 14.516 1.00 37.59 O ATOM 2195 CB THR A 390 2.201 -17.945 13.069 1.00 36.44 C ATOM 2196 OG1 THR A 390 2.689 -18.600 11.894 1.00 37.38 O ATOM 2197 CG2 THR A 390 2.981 -16.659 13.287 1.00 35.88 C ATOM 0 H THR A 390 4.239 -19.214 13.799 1.00 35.59 H new ATOM 0 HA THR A 390 2.139 -18.371 15.083 1.00 36.59 H new ATOM 0 HB THR A 390 1.262 -17.726 12.959 1.00 36.44 H new ATOM 0 HG1 THR A 390 3.529 -18.584 11.892 1.00 37.38 H new ATOM 0 HG21 THR A 390 2.880 -16.084 12.513 1.00 35.88 H new ATOM 0 HG22 THR A 390 2.642 -16.204 14.074 1.00 35.88 H new ATOM 0 HG23 THR A 390 3.920 -16.867 13.414 1.00 35.88 H new ATOM 2198 N LYS A 391 1.803 -21.191 13.741 1.00 38.14 N ATOM 2199 CA LYS A 391 1.000 -22.414 13.750 1.00 39.05 C ATOM 2200 C LYS A 391 0.679 -22.864 15.176 1.00 39.52 C ATOM 2201 O LYS A 391 -0.382 -23.436 15.425 1.00 39.82 O ATOM 2202 CB LYS A 391 1.718 -23.539 12.998 1.00 39.02 C ATOM 2203 CG LYS A 391 1.615 -23.441 11.488 1.00 39.31 C ATOM 2204 CD LYS A 391 2.772 -24.693 10.895 0.00 66.03 C ATOM 2205 CE LYS A 391 2.880 -24.471 9.144 0.00 72.92 C ATOM 2206 NZ LYS A 391 3.357 -25.628 8.610 0.00 68.62 N ATOM 0 H LYS A 391 2.596 -21.293 13.424 1.00 38.14 H new ATOM 0 HA LYS A 391 0.164 -22.215 13.300 1.00 39.05 H new ATOM 0 HB2 LYS A 391 2.655 -23.536 13.249 1.00 39.02 H new ATOM 0 HB3 LYS A 391 1.351 -24.391 13.283 1.00 39.02 H new ATOM 0 HG2 LYS A 391 0.712 -23.617 11.181 1.00 39.31 H new ATOM 0 HG3 LYS A 391 1.855 -22.556 11.172 1.00 39.31 H new ATOM 0 HD2 LYS A 391 3.641 -24.587 11.312 0.00 66.03 H new ATOM 0 HD3 LYS A 391 2.459 -25.585 11.113 0.00 66.03 H new ATOM 0 HE2 LYS A 391 2.009 -24.259 8.773 0.00 72.92 H new ATOM 0 HE3 LYS A 391 3.468 -23.730 8.930 0.00 72.92 H new ATOM 0 HZ1 LYS A 391 3.421 -25.543 7.726 0.00 68.62 H new ATOM 0 HZ2 LYS A 391 4.161 -25.803 8.950 0.00 68.62 H new ATOM 0 HZ3 LYS A 391 2.801 -26.296 8.804 0.00 68.62 H new ATOM 2207 N THR A 392 1.598 -22.600 16.103 1.00 40.10 N ATOM 2208 CA THR A 392 1.432 -23.006 17.499 1.00 40.75 C ATOM 2209 C THR A 392 0.473 -22.111 18.294 1.00 41.14 C ATOM 2210 O THR A 392 -0.031 -22.520 19.341 1.00 41.35 O ATOM 2211 CB THR A 392 2.797 -23.143 18.234 1.00 40.77 C ATOM 2212 OG1 THR A 392 3.241 -21.860 18.694 1.00 41.02 O ATOM 2213 CG2 THR A 392 3.390 -24.578 17.588 0.00 54.46 C ATOM 0 H THR A 392 2.332 -22.182 15.942 1.00 40.10 H new ATOM 0 HA THR A 392 1.018 -23.882 17.458 1.00 40.75 H new ATOM 0 HB THR A 392 3.149 -23.356 19.112 1.00 40.77 H new ATOM 0 HG1 THR A 392 3.282 -21.328 18.045 1.00 41.02 H new ATOM 0 HG21 THR A 392 4.256 -24.775 17.977 0.00 54.46 H new ATOM 0 HG22 THR A 392 2.775 -25.301 17.787 0.00 54.46 H new ATOM 0 HG23 THR A 392 3.481 -24.487 16.627 0.00 54.46 H new ATOM 2214 N ILE A 393 0.218 -20.900 17.800 1.00 41.48 N ATOM 2215 CA ILE A 393 -0.713 -19.984 18.477 1.00 41.68 C ATOM 2216 C ILE A 393 -1.982 -19.718 17.665 1.00 41.77 C ATOM 2217 O ILE A 393 -2.177 -20.287 16.590 1.00 42.01 O ATOM 2218 CB ILE A 393 -0.046 -18.635 18.887 1.00 41.76 C ATOM 2219 CG1 ILE A 393 0.451 -17.861 17.654 1.00 41.70 C ATOM 2220 CG2 ILE A 393 1.075 -18.879 19.912 1.00 42.21 C ATOM 2221 CD1 ILE A 393 0.830 -16.408 17.927 1.00 41.61 C ATOM 0 H ILE A 393 0.569 -20.588 17.080 1.00 41.48 H new ATOM 0 HA ILE A 393 -0.971 -20.448 19.289 1.00 41.68 H new ATOM 0 HB ILE A 393 -0.715 -18.077 19.314 1.00 41.76 H new ATOM 0 HG12 ILE A 393 1.222 -18.321 17.287 1.00 41.70 H new ATOM 0 HG13 ILE A 393 -0.241 -17.880 16.974 1.00 41.70 H new ATOM 0 HG21 ILE A 393 1.480 -18.032 20.157 1.00 42.21 H new ATOM 0 HG22 ILE A 393 0.704 -19.301 20.703 1.00 42.21 H new ATOM 0 HG23 ILE A 393 1.749 -19.458 19.523 1.00 42.21 H new ATOM 0 HD11 ILE A 393 1.131 -15.992 17.104 1.00 41.61 H new ATOM 0 HD12 ILE A 393 0.057 -15.930 18.266 1.00 41.61 H new ATOM 0 HD13 ILE A 393 1.543 -16.377 18.584 1.00 41.61 H new TER 2222 ILE A 393 HETATM 2223 FE FE A 400 9.653 1.632 14.210 1.00 19.22 FE HETATM 2224 O38 ML0 A 401 15.971 7.086 19.149 1.00 27.55 O HETATM 2225 C36 ML0 A 401 15.402 6.388 18.274 1.00 28.09 C HETATM 2226 O37 ML0 A 401 15.542 6.598 17.040 1.00 26.43 O HETATM 2227 C34 ML0 A 401 14.486 5.275 18.700 1.00 28.27 C HETATM 2228 N35 ML0 A 401 14.609 4.972 20.119 1.00 28.53 N HETATM 2229 C33 ML0 A 401 13.077 5.758 18.392 1.00 28.84 C HETATM 2230 C30 ML0 A 401 12.018 4.702 18.607 1.00 28.82 C HETATM 2231 C29 ML0 A 401 11.090 4.895 19.628 1.00 29.70 C HETATM 2232 C28 ML0 A 401 10.094 3.947 19.843 1.00 29.84 C HETATM 2233 C31 ML0 A 401 11.945 3.567 17.797 1.00 28.03 C HETATM 2234 C32 ML0 A 401 10.946 2.619 18.018 1.00 29.28 C HETATM 2235 C27 ML0 A 401 10.019 2.806 19.048 1.00 30.60 C HETATM 2236 C22 ML0 A 401 8.921 1.826 19.294 1.00 30.80 C HETATM 2237 C21 ML0 A 401 8.321 1.734 20.550 1.00 32.21 C HETATM 2238 N23 ML0 A 401 8.459 1.046 18.282 1.00 31.94 N HETATM 2239 C24 ML0 A 401 7.446 0.167 18.482 1.00 31.96 C HETATM 2240 N26 ML0 A 401 7.008 -0.608 17.465 1.00 31.78 N HETATM 2241 N25 ML0 A 401 6.863 0.057 19.697 1.00 31.39 N HETATM 2242 C20 ML0 A 401 7.281 0.825 20.734 1.00 33.73 C HETATM 2243 O16 ML0 A 401 6.691 0.718 21.970 1.00 35.04 O HETATM 2244 C14 ML0 A 401 5.792 -0.354 22.259 1.00 41.14 C HETATM 2245 C15 ML0 A 401 6.129 -0.911 23.635 1.00 41.65 C HETATM 2246 F19 ML0 A 401 7.421 -1.156 23.717 1.00 42.64 F HETATM 2247 F18 ML0 A 401 5.813 -0.030 24.564 1.00 42.75 F HETATM 2248 F17 ML0 A 401 5.454 -2.031 23.806 1.00 43.26 F HETATM 2249 C11 ML0 A 401 4.375 0.096 22.205 1.00 41.93 C HETATM 2250 C10 ML0 A 401 4.026 1.427 22.446 1.00 42.26 C HETATM 2251 C9 ML0 A 401 2.688 1.823 22.394 1.00 43.27 C HETATM 2252 C12 ML0 A 401 3.377 -0.834 21.913 1.00 42.47 C HETATM 2253 C13 ML0 A 401 2.043 -0.438 21.862 1.00 43.15 C HETATM 2254 C8 ML0 A 401 1.689 0.892 22.098 1.00 43.49 C HETATM 2255 C3 ML0 A 401 0.252 1.299 22.037 1.00 43.41 C HETATM 2256 C2 ML0 A 401 -0.108 2.562 21.565 1.00 44.23 C HETATM 2257 C4 ML0 A 401 -0.750 0.417 22.456 1.00 44.52 C HETATM 2258 C5 ML0 A 401 -2.094 0.797 22.398 1.00 44.86 C HETATM 2259 F7 ML0 A 401 -3.053 -0.059 22.799 1.00 45.08 F HETATM 2260 C6 ML0 A 401 -2.442 2.062 21.923 1.00 44.69 C HETATM 2261 C1 ML0 A 401 -1.448 2.944 21.505 1.00 44.17 C HETATM 0 HN3A ML0 A 401 14.129 4.350 20.469 1.00 28.53 H new HETATM 0 HN35 ML0 A 401 15.161 5.415 20.607 1.00 28.53 H new HETATM 0 HN2A ML0 A 401 6.365 -1.165 17.595 1.00 31.78 H new HETATM 0 HN26 ML0 A 401 7.372 -0.544 16.688 1.00 31.78 H new HETATM 0 H33A ML0 A 401 12.876 6.525 18.950 1.00 28.84 H new HETATM 0 H9 ML0 A 401 2.451 2.748 22.564 1.00 43.27 H new HETATM 0 H6 ML0 A 401 -3.374 2.327 21.884 1.00 44.69 H new HETATM 0 H4 ML0 A 401 -0.511 -0.462 22.788 1.00 44.52 H new HETATM 0 H34 ML0 A 401 14.710 4.457 18.230 1.00 28.27 H new HETATM 0 H33 ML0 A 401 13.040 6.060 17.471 1.00 28.84 H new HETATM 0 H32 ML0 A 401 10.894 1.830 17.457 1.00 29.28 H new HETATM 0 H31 ML0 A 401 12.588 3.438 17.082 1.00 28.03 H new HETATM 0 H29 ML0 A 401 11.138 5.687 20.187 1.00 29.70 H new HETATM 0 H28 ML0 A 401 9.447 4.082 20.553 1.00 29.84 H new HETATM 0 H21 ML0 A 401 8.623 2.293 21.283 1.00 32.21 H new HETATM 0 H2 ML0 A 401 0.581 3.181 21.276 1.00 44.23 H new HETATM 0 H14 ML0 A 401 5.895 -1.047 21.588 1.00 41.14 H new HETATM 0 H13 ML0 A 401 1.354 -1.091 21.661 1.00 43.15 H new HETATM 0 H12 ML0 A 401 3.613 -1.760 21.745 1.00 42.47 H new HETATM 0 H10 ML0 A 401 4.715 2.078 22.650 1.00 42.26 H new HETATM 0 H1 ML0 A 401 -1.688 3.823 21.172 1.00 44.17 H new HETATM 2262 O HOH A 402 7.934 2.637 13.307 1.00 26.67 O HETATM 2263 O HOH A 403 6.308 2.579 15.376 1.00 48.30 O HETATM 2264 O HOH A 404 8.654 2.325 15.898 1.00 31.81 O HETATM 2265 O HOH A 405 5.115 13.461 1.685 1.00 20.44 O HETATM 2266 O HOH A 406 -6.534 -8.033 13.711 1.00 21.83 O HETATM 2267 O HOH A 407 16.019 -7.821 19.521 1.00 24.78 O HETATM 2268 O HOH A 408 9.136 12.908 6.004 1.00 23.46 O HETATM 2269 O HOH A 409 15.572 -9.974 -0.659 1.00 22.96 O HETATM 2270 O HOH A 410 1.115 -1.326 -0.091 1.00 19.80 O HETATM 2271 O HOH A 411 1.644 13.410 9.783 1.00 23.67 O HETATM 2272 O HOH A 412 -4.067 13.966 2.408 1.00 25.83 O HETATM 2273 O HOH A 413 11.587 20.488 3.770 1.00 26.75 O HETATM 2274 O HOH A 414 16.855 3.362 20.259 1.00 24.58 O HETATM 2275 O HOH A 415 12.882 20.811 18.626 1.00 35.27 O HETATM 2276 O HOH A 416 15.227 1.130 23.298 1.00 25.33 O HETATM 2277 O HOH A 417 1.427 6.101 -0.092 1.00 41.66 O HETATM 2278 O HOH A 418 16.321 -10.780 16.002 1.00 25.27 O HETATM 2279 O HOH A 419 -3.085 -9.053 2.137 1.00 26.09 O HETATM 2280 O HOH A 420 12.064 13.234 -0.693 1.00 26.61 O HETATM 2281 O HOH A 421 3.034 12.117 11.806 1.00 22.97 O HETATM 2282 O HOH A 422 -3.276 9.061 12.015 1.00 28.58 O HETATM 2283 O HOH A 423 20.009 9.214 16.438 1.00 21.09 O HETATM 2284 O HOH A 424 1.459 19.890 2.471 1.00 34.03 O HETATM 2285 O HOH A 425 5.377 16.464 -5.252 1.00 31.97 O HETATM 2286 O HOH A 426 2.105 15.175 -1.828 1.00 24.84 O HETATM 2287 O HOH A 427 -3.479 -4.464 20.071 1.00 29.49 O HETATM 2288 O HOH A 428 -1.378 -4.691 -0.386 1.00 36.58 O HETATM 2289 O HOH A 429 -8.850 -12.455 22.421 1.00 33.85 O HETATM 2290 O HOH A 430 7.102 -13.375 9.986 1.00 27.62 O HETATM 2291 O HOH A 431 -8.015 13.403 2.369 1.00 27.49 O HETATM 2292 O HOH A 432 12.052 -2.006 8.889 1.00 24.25 O HETATM 2293 O HOH A 433 24.716 14.307 2.762 1.00 28.31 O HETATM 2294 O HOH A 434 17.815 -0.724 29.715 1.00 40.23 O HETATM 2295 O HOH A 435 20.519 10.432 25.070 1.00 47.15 O HETATM 2296 O HOH A 436 -4.282 2.496 3.536 1.00 21.72 O HETATM 2297 O HOH A 437 3.834 17.040 22.736 1.00 42.55 O HETATM 2298 O HOH A 438 3.155 14.415 -4.137 1.00 30.80 O HETATM 2299 O HOH A 439 -3.805 15.016 5.037 1.00 23.08 O HETATM 2300 O HOH A 440 -5.445 -16.138 17.371 1.00 32.22 O HETATM 2301 O HOH A 441 -6.892 -3.307 12.400 1.00 24.95 O HETATM 2302 O HOH A 442 21.365 -3.394 27.373 1.00 49.64 O HETATM 2303 O HOH A 443 28.840 8.628 14.850 1.00 27.30 O HETATM 2304 O HOH A 444 7.508 19.803 24.873 1.00 39.90 O HETATM 2305 O HOH A 445 26.712 11.391 5.877 1.00 38.28 O HETATM 2306 O HOH A 446 16.174 -17.701 22.890 1.00 38.57 O HETATM 2307 O HOH A 447 -4.690 -20.748 16.068 1.00 58.66 O HETATM 2308 O HOH A 448 29.512 -0.195 18.774 1.00 29.15 O HETATM 2309 O HOH A 449 5.662 3.623 -7.345 1.00 38.65 O HETATM 2310 O HOH A 450 -3.066 7.260 15.567 1.00 32.93 O HETATM 2311 O HOH A 451 9.175 -7.955 -3.195 1.00 35.71 O HETATM 2312 O HOH A 452 2.674 15.142 15.989 1.00 28.74 O HETATM 2313 O HOH A 453 -0.649 23.895 14.408 1.00 45.82 O HETATM 2314 O HOH A 454 29.216 14.007 3.548 1.00 48.11 O HETATM 2315 O HOH A 455 20.891 13.115 -3.023 1.00 59.08 O HETATM 2316 O HOH A 456 5.175 4.747 13.223 1.00 32.07 O HETATM 2317 O HOH A 457 22.024 -9.928 0.982 1.00 53.44 O HETATM 2318 O HOH A 458 23.198 19.285 12.288 1.00 54.32 O HETATM 2319 O HOH A 459 26.989 9.931 3.581 1.00 45.49 O HETATM 2320 O HOH A 460 26.065 1.317 1.255 1.00 35.19 O HETATM 2321 O HOH A 461 0.003 14.847 22.617 1.00 31.94 O HETATM 2322 O HOH A 462 14.376 29.777 7.323 1.00 76.82 O HETATM 2323 O HOH A 463 -0.904 2.482 0.292 1.00 45.29 O HETATM 2324 O HOH A 464 6.716 -15.643 8.790 1.00 34.75 O HETATM 2325 O HOH A 465 2.043 0.153 17.603 1.00 49.37 O HETATM 2326 O HOH A 466 -5.023 1.891 17.280 1.00 32.55 O HETATM 2327 O HOH A 467 4.877 22.252 5.338 1.00 38.42 O HETATM 2328 O HOH A 468 6.176 22.567 27.473 1.00 55.20 O HETATM 2329 O HOH A 469 27.326 -8.097 7.091 1.00 26.48 O HETATM 2330 O HOH A 470 -2.077 20.176 9.404 1.00 30.17 O HETATM 2331 O HOH A 471 23.614 11.447 0.812 1.00 49.79 O HETATM 2332 O HOH A 472 -7.840 -8.286 -0.408 1.00 43.86 O HETATM 2333 O HOH A 473 9.942 -22.519 25.588 1.00 44.34 O HETATM 2334 O HOH A 474 11.225 -9.668 30.213 1.00 45.48 O HETATM 2335 O HOH A 475 4.806 26.275 4.228 1.00 45.32 O HETATM 2336 O HOH A 476 -10.368 1.130 14.953 1.00 67.79 O HETATM 2337 O HOH A 477 26.760 4.943 5.584 1.00 27.44 O HETATM 2338 O HOH A 478 1.583 -15.024 7.624 1.00 25.01 O HETATM 2339 O HOH A 479 8.847 18.375 14.114 1.00 34.41 O HETATM 2340 O HOH A 480 0.711 19.148 20.392 1.00 42.20 O HETATM 2341 O HOH A 481 20.127 3.843 -13.853 1.00 61.92 O HETATM 2342 O HOH A 482 23.778 7.054 -3.822 1.00 41.76 O HETATM 2343 O HOH A 483 -4.348 18.733 8.139 1.00 41.20 O HETATM 2344 O HOH A 484 30.116 19.604 12.840 1.00 55.12 O HETATM 2345 O HOH A 485 6.040 -5.584 26.681 1.00 34.82 O HETATM 2346 O HOH A 486 30.538 -2.481 5.064 1.00 51.61 O HETATM 2347 O HOH A 487 4.349 -7.868 -3.075 1.00 40.08 O HETATM 2348 O HOH A 488 7.090 13.870 4.502 1.00 25.85 O HETATM 2349 O HOH A 489 8.960 10.637 26.973 1.00 53.75 O HETATM 2350 O HOH A 490 21.565 19.142 16.158 1.00 32.52 O HETATM 2351 O HOH A 491 0.070 14.692 26.235 1.00 47.03 O HETATM 2352 O HOH A 492 13.587 8.455 27.425 1.00 62.67 O HETATM 2353 O HOH A 493 19.171 18.448 17.148 1.00 52.78 O HETATM 2354 O HOH A 494 6.748 -23.808 9.284 1.00 51.19 O HETATM 2355 O HOH A 495 17.261 25.259 18.115 1.00 76.69 O HETATM 2356 O HOH A 496 18.996 23.929 8.773 1.00 42.15 O HETATM 2357 O HOH A 497 3.754 12.710 25.090 1.00 39.62 O HETATM 2358 O HOH A 498 27.913 -2.118 0.996 1.00 49.73 O HETATM 2359 O HOH A 499 -4.137 -15.438 9.911 1.00 55.25 O HETATM 2360 O HOH A 500 11.325 -26.494 14.293 1.00 52.24 O HETATM 2361 O HOH A 501 4.439 -6.246 29.170 1.00 53.27 O HETATM 2362 O HOH A 502 13.116 4.082 -12.905 1.00 67.31 O HETATM 2363 O HOH A 503 4.345 18.167 29.122 1.00 55.13 O HETATM 2364 O HOH A 504 8.638 25.567 7.459 1.00 30.50 O HETATM 2365 O HOH A 505 17.541 -6.393 -3.200 1.00 44.89 O HETATM 2366 O HOH A 506 23.475 -0.834 -3.719 1.00 40.88 O HETATM 2367 O HOH A 507 -2.975 12.538 17.734 1.00 38.92 O HETATM 2368 O HOH A 508 6.724 26.660 11.013 1.00 51.52 O HETATM 2369 O HOH A 509 15.405 -13.982 -0.098 1.00 66.04 O HETATM 2370 O HOH A 510 18.437 21.513 15.801 1.00 44.26 O HETATM 2371 O HOH A 511 2.337 -3.256 -5.443 1.00 66.67 O HETATM 2372 O HOH A 512 -2.760 7.287 20.132 1.00 48.04 O HETATM 2373 O HOH A 513 -12.042 3.577 3.217 1.00 28.79 O HETATM 2374 O HOH A 514 13.952 14.067 -4.048 1.00 56.01 O HETATM 2375 O HOH A 515 13.437 -13.648 30.198 1.00 58.92 O HETATM 2376 O HOH A 516 0.260 30.748 18.259 1.00 64.71 O HETATM 2377 O HOH A 517 3.731 -19.329 22.649 1.00 60.07 O HETATM 2378 O HOH A 518 4.378 -2.742 17.449 1.00 51.23 O HETATM 2379 O HOH A 519 1.482 -4.043 -2.388 1.00 37.51 O HETATM 2380 O HOH A 520 28.968 8.143 24.351 1.00 96.54 O HETATM 2381 O HOH A 521 10.439 -12.081 -1.147 1.00 46.79 O HETATM 2382 O HOH A 522 12.302 -13.700 4.395 1.00 48.27 O HETATM 2383 O HOH A 523 -9.277 6.646 19.409 1.00 66.20 O HETATM 2384 O HOH A 524 4.554 12.859 27.794 1.00 48.42 O HETATM 2385 O HOH A 525 -10.135 13.994 5.047 1.00 48.82 O HETATM 2386 O HOH A 526 24.618 -2.749 29.584 1.00 48.81 O HETATM 2387 O HOH A 527 2.192 11.836 30.867 1.00 41.07 O HETATM 2388 O HOH A 528 -8.637 12.803 21.997 1.00 65.86 O HETATM 2389 O HOH A 529 -2.268 27.226 21.367 1.00 55.38 O HETATM 2390 O HOH A 530 12.576 23.150 3.553 1.00 43.65 O HETATM 2391 O HOH A 531 2.104 24.334 29.212 1.00 53.59 O HETATM 2392 O HOH A 532 23.142 -19.448 18.962 1.00 59.34 O HETATM 2393 O HOH A 533 2.197 -11.735 -0.199 1.00 25.42 O HETATM 2394 O HOH A 534 8.708 14.232 22.025 1.00 44.25 O HETATM 2395 O HOH A 535 -0.876 -16.139 7.628 1.00 36.18 O HETATM 2396 O HOH A 536 7.727 12.700 30.708 1.00 46.72 O HETATM 2397 O HOH A 537 4.487 -14.214 11.328 1.00 29.26 O HETATM 2398 O HOH A 538 -8.465 7.880 8.046 1.00 36.89 O HETATM 2399 O HOH A 539 -4.862 24.620 14.592 1.00 54.20 O HETATM 2400 O HOH A 540 4.732 1.320 -8.373 1.00 52.80 O HETATM 2401 O HOH A 541 10.489 5.083 -11.463 1.00 49.70 O HETATM 2402 O HOH A 542 12.803 11.337 31.394 1.00 67.15 O HETATM 2403 O HOH A 543 23.843 -20.845 15.630 1.00 61.28 O HETATM 2404 O HOH A 544 20.973 21.018 20.387 1.00 63.75 O HETATM 2405 O HOH A 545 10.788 -0.898 -13.142 1.00 64.91 O HETATM 2406 O HOH A 546 28.225 -4.711 2.703 1.00 44.87 O HETATM 2407 O HOH A 547 26.326 19.492 15.211 1.00 68.91 O HETATM 2408 O HOH A 548 4.410 29.028 11.463 1.00 59.38 O HETATM 2409 O HOH A 549 -12.912 16.593 7.414 1.00 53.82 O HETATM 2410 O HOH A 550 12.811 18.165 2.809 1.00 35.30 O HETATM 2411 O HOH A 551 14.308 13.128 24.478 1.00 52.19 O HETATM 2412 O HOH A 552 18.054 6.009 27.544 1.00 63.85 O HETATM 2413 O HOH A 553 30.738 6.175 6.842 1.00 36.78 O HETATM 2414 O HOH A 554 27.161 12.532 22.527 1.00 62.20 O HETATM 2415 O HOH A 555 18.927 -21.398 8.728 1.00 62.11 O HETATM 2416 O HOH A 556 16.554 -24.852 4.202 1.00 58.59 O HETATM 2417 O HOH A 557 11.026 -25.219 5.670 1.00 50.18 O HETATM 2418 O HOH A 558 20.649 -3.918 -13.518 1.00 68.17 O HETATM 2419 O HOH A 559 20.395 -24.617 4.622 1.00 67.12 O HETATM 2420 O HOH A 560 -0.353 24.651 27.621 1.00 63.41 O HETATM 2421 O HOH A 561 -7.764 -9.200 5.104 1.00 29.98 O HETATM 2422 O HOH A 562 16.471 -19.628 2.605 1.00 66.00 O HETATM 2423 O HOH A 563 19.271 27.559 4.256 1.00 50.89 O HETATM 2424 O HOH A 564 -8.575 -2.606 16.087 1.00 47.69 O HETATM 2425 O HOH A 565 34.552 17.142 11.965 1.00 62.04 O HETATM 2426 O HOH A 566 18.929 22.664 3.976 1.00 40.38 O HETATM 2427 O HOH A 567 21.727 -12.470 7.979 1.00 41.20 O HETATM 2428 O HOH A 568 -9.972 -14.602 17.372 1.00 43.89 O HETATM 2429 O HOH A 569 9.565 21.657 27.259 1.00 46.31 O HETATM 2430 O HOH A 570 15.552 -21.304 7.547 1.00 54.86 O HETATM 2431 O HOH A 571 0.693 8.128 -1.626 1.00 42.33 O HETATM 2432 O HOH A 572 -15.992 -13.312 21.993 1.00 72.89 O HETATM 2433 O HOH A 573 -9.894 15.191 21.716 1.00 52.41 O HETATM 2434 O HOH A 574 32.148 5.541 19.229 1.00 77.69 O HETATM 2435 O HOH A 575 30.171 0.640 -0.685 1.00 66.15 O HETATM 2436 O HOH A 576 13.551 -25.321 21.784 1.00 57.63 O HETATM 2437 O HOH A 577 17.922 -22.651 14.513 1.00 46.24 O HETATM 2438 O HOH A 578 21.330 19.634 8.005 1.00 42.78 O HETATM 2439 O HOH A 579 -16.830 -17.705 19.647 1.00 53.48 O HETATM 2440 O HOH A 580 -0.318 -20.313 10.332 1.00 61.95 O HETATM 2441 O HOH A 581 23.231 -24.061 17.151 1.00 65.87 O HETATM 2442 O HOH A 582 23.050 0.645 -11.769 1.00 58.17 O HETATM 2443 O HOH A 583 -10.407 -5.719 18.545 1.00 45.19 O HETATM 2444 O HOH A 584 7.279 -22.091 25.442 1.00 60.81 O HETATM 2445 O HOH A 585 5.347 -20.438 28.936 1.00 77.53 O HETATM 2446 O HOH A 586 31.424 -16.730 7.391 1.00 65.61 O HETATM 2447 O HOH A 587 28.577 -24.629 17.970 1.00 62.05 O HETATM 2448 O HOH A 588 23.772 2.886 28.561 1.00 45.43 O HETATM 2449 O HOH A 589 29.150 -29.921 17.456 1.00 61.04 O HETATM 2450 O HOH A 590 -9.106 -14.116 10.856 1.00 49.96 O HETATM 2451 O HOH A 591 -13.227 1.240 -1.267 1.00 58.75 O HETATM 2452 O HOH A 592 30.348 23.469 16.400 1.00 70.67 O HETATM 2453 O HOH A 593 15.321 -29.572 15.795 1.00 64.90 O HETATM 2454 O HOH A 594 4.736 -25.313 14.007 1.00 43.09 O HETATM 2455 O HOH A 595 25.159 -14.623 19.475 1.00 56.85 O HETATM 2456 O HOH A 596 -10.667 -1.648 18.446 1.00 59.34 O HETATM 2457 O HOH A 597 10.779 8.310 -5.363 1.00 47.14 O HETATM 2458 O HOH A 598 10.588 24.501 18.105 1.00 42.47 O HETATM 2459 O HOH A 599 -0.912 -6.991 26.213 1.00 53.64 O HETATM 2460 O HOH A 600 -1.928 32.493 19.271 1.00 61.80 O HETATM 2461 O HOH A 601 3.674 -5.617 22.912 1.00 72.64 O HETATM 2462 O HOH A 602 -10.563 -10.909 20.224 1.00 65.78 O HETATM 2463 O HOH A 603 -13.579 -9.515 19.208 1.00 48.14 O HETATM 2464 O HOH A 604 -13.597 -3.757 2.756 1.00 75.47 O HETATM 2465 O HOH A 605 -2.848 14.915 -0.289 1.00 20.88 O HETATM 2466 O HOH A 606 -3.945 -7.129 13.248 1.00 20.54 O HETATM 2467 O HOH A 607 -10.558 12.805 1.660 1.00 37.25 O HETATM 2468 O HOH A 608 1.819 17.775 -0.975 1.00 23.24 O HETATM 2469 O HOH A 609 5.030 20.233 27.054 1.00 35.93 O HETATM 2470 O HOH A 610 7.141 15.440 31.276 1.00 46.97 O HETATM 2471 O HOH A 611 -1.583 -5.793 21.701 1.00 38.13 O HETATM 2472 O HOH A 612 12.929 15.731 -0.182 1.00 30.73 O HETATM 2473 O HOH A 613 22.704 -3.873 -7.170 1.00 47.59 O HETATM 2474 O HOH A 614 0.403 13.085 28.583 1.00 55.51 O HETATM 2475 O HOH A 615 -2.768 4.035 2.148 1.00 33.31 O HETATM 2476 O HOH A 616 9.194 16.063 27.014 1.00 38.81 O HETATM 2477 O HOH A 617 13.411 3.200 22.318 1.00 26.74 O HETATM 2478 O HOH A 618 -18.207 0.983 3.721 1.00 49.68 O HETATM 2479 O HOH A 619 -0.654 8.793 20.214 1.00 34.41 O HETATM 2480 O HOH A 620 9.285 -23.266 8.823 1.00 47.30 O HETATM 2481 O HOH A 621 27.201 -5.576 6.511 1.00 32.82 O HETATM 2482 O HOH A 622 12.670 -27.234 12.119 1.00 52.84 O HETATM 2483 O HOH A 623 23.960 1.235 -5.279 1.00 45.10 O HETATM 2484 O HOH A 624 -4.290 -7.976 0.049 1.00 32.65 O HETATM 2485 O HOH A 625 12.660 -26.374 18.137 1.00116.85 O HETATM 2486 O HOH A 626 9.513 -26.924 11.623 1.00 60.86 O HETATM 2487 O HOH A 627 -6.681 1.577 20.024 1.00 53.84 O HETATM 2488 O HOH A 628 3.007 4.881 -7.406 1.00 60.87 O HETATM 2489 O HOH A 629 3.978 14.593 21.880 1.00 49.48 O HETATM 2490 O HOH A 630 3.761 4.832 15.504 1.00 38.82 O HETATM 2491 O HOH A 631 8.867 -8.319 32.638 1.00 67.15 O HETATM 2492 O HOH A 632 28.244 13.036 1.251 1.00 78.08 O HETATM 2493 O HOH A 633 -18.251 -15.599 20.597 1.00 67.34 O HETATM 2494 O HOH A 634 11.076 2.746 -14.089 1.00 67.72 O HETATM 2495 O HOH A 635 31.252 17.679 16.309 1.00 54.27 O HETATM 2496 O HOH A 636 -5.282 0.939 -3.850 1.00 64.42 O HETATM 2497 O HOH A 637 14.062 -17.697 -0.176 1.00 53.58 O HETATM 2498 O HOH A 638 3.866 24.641 11.270 1.00 38.04 O HETATM 2499 O HOH A 639 10.075 15.619 -3.576 1.00 46.99 O HETATM 2500 O HOH A 640 14.110 23.396 20.298 1.00 51.59 O HETATM 2501 O HOH A 641 15.583 -9.248 30.893 1.00 51.06 O HETATM 2502 O HOH A 642 24.910 5.302 1.113 1.00 46.60 O HETATM 2503 O HOH A 643 -4.536 12.075 26.312 1.00 58.67 O HETATM 2504 O HOH A 644 -11.207 22.903 10.556 1.00 73.34 O HETATM 2505 O HOH A 645 7.473 28.073 24.082 1.00 59.51 O HETATM 2506 O HOH A 646 31.280 7.501 15.067 1.00 53.47 O HETATM 2507 O HOH A 647 15.300 -6.091 -5.526 1.00 53.49 O HETATM 2508 O HOH A 648 -6.598 27.326 19.514 1.00 61.33 O HETATM 2509 O HOH A 649 4.459 -0.338 28.368 1.00 69.60 O HETATM 2510 O HOH A 650 29.385 -4.865 -0.507 1.00 65.47 O HETATM 2511 O HOH A 651 11.314 17.214 25.794 1.00 63.40 O HETATM 2512 O HOH A 652 10.012 26.528 3.451 1.00 46.33 O HETATM 2513 O HOH A 653 29.823 -6.492 15.358 1.00 33.50 O HETATM 2514 O HOH A 654 11.587 -24.130 10.918 1.00 57.64 O HETATM 2515 O HOH A 655 28.597 16.758 1.295 1.00 41.32 O HETATM 2516 O HOH A 656 20.585 -16.924 16.116 1.00 50.73 O HETATM 2517 O HOH A 657 27.809 -5.417 31.097 1.00 68.42 O HETATM 2518 O HOH A 658 11.233 6.275 -7.097 1.00 84.91 O HETATM 2519 O HOH A 659 13.385 25.339 6.072 1.00 36.78 O HETATM 2520 O HOH A 660 -1.537 7.212 22.513 1.00 47.60 O HETATM 2521 O HOH A 661 7.719 4.954 -15.002 1.00 63.67 O HETATM 2522 O HOH A 662 -11.918 3.819 18.765 1.00 58.43 O HETATM 2523 O HOH A 663 18.152 24.325 6.223 1.00 51.25 O HETATM 2524 O HOH A 664 25.771 21.930 8.110 1.00 54.85 O HETATM 2525 O HOH A 665 11.139 -8.757 -5.470 1.00 40.03 O HETATM 2526 O HOH A 666 29.854 11.600 2.859 1.00 50.33 O HETATM 2527 O HOH A 667 0.524 -0.462 28.199 1.00 51.54 O HETATM 2528 O HOH A 668 -11.845 6.504 20.040 1.00 67.96 O HETATM 2529 O HOH A 669 -9.441 5.589 12.117 1.00 45.88 O HETATM 2530 O HOH A 670 -15.871 -22.215 20.481 1.00 55.13 O HETATM 2531 O HOH A 671 10.263 -1.023 32.880 1.00 74.77 O HETATM 2532 O HOH A 672 26.130 28.472 14.126 1.00 60.94 O HETATM 2533 O HOH A 673 20.129 -21.497 21.611 1.00 61.62 O HETATM 2534 O HOH A 674 21.520 25.057 16.222 1.00 44.02 O HETATM 2535 O HOH A 675 -5.721 11.543 22.876 1.00 61.52 O HETATM 2536 O HOH A 676 2.000 12.108 18.170 1.00 40.63 O HETATM 2537 O HOH A 677 2.698 -13.596 26.245 1.00 82.47 O HETATM 2538 O HOH A 678 13.861 26.802 12.564 1.00 36.80 O HETATM 2539 O HOH A 679 3.134 24.997 13.826 1.00 44.91 O HETATM 2540 O HOH A 680 1.264 -7.417 -0.834 1.00 42.08 O HETATM 2541 O HOH A 681 11.425 9.868 28.313 1.00 45.84 O HETATM 2542 O HOH A 682 3.428 8.487 -8.152 1.00 62.72 O HETATM 2543 O HOH A 683 4.740 29.017 26.067 1.00 57.05 O HETATM 2544 O HOH A 684 4.805 -13.606 30.164 1.00 77.64 O HETATM 2545 O HOH A 685 -9.217 14.779 13.078 1.00 66.74 O HETATM 2546 O HOH A 686 15.549 15.951 -3.143 1.00 72.32 O HETATM 2547 O HOH A 687 12.690 -23.018 26.716 1.00 70.91 O HETATM 2548 O HOH A 688 26.328 -14.503 6.232 1.00 41.37 O HETATM 2549 O HOH A 689 20.014 30.822 10.365 1.00 69.30 O HETATM 2550 O HOH A 690 -6.556 12.262 18.261 1.00 57.31 O HETATM 2551 O HOH A 691 -5.009 8.288 19.512 1.00 43.34 O HETATM 2552 O HOH A 692 6.718 -8.707 -3.973 1.00 50.23 O HETATM 2553 O HOH A 693 7.550 -1.551 29.054 1.00 49.03 O HETATM 2554 O HOH A 694 12.910 -2.334 -14.098 1.00 62.99 O HETATM 2555 O HOH A 695 20.230 0.842 -9.207 1.00 61.95 O HETATM 2556 O HOH A 696 30.821 -9.749 25.716 1.00 61.70 O HETATM 2557 O HOH A 697 0.797 11.344 25.099 1.00 53.67 O HETATM 2558 O HOH A 698 12.462 21.170 15.978 1.00 36.87 O HETATM 2559 O HOH A 699 18.482 25.877 13.457 1.00 60.28 O HETATM 2560 O HOH A 700 21.976 29.942 17.099 1.00 62.10 O HETATM 2561 O HOH A 701 30.545 13.263 8.553 1.00 61.90 O HETATM 2562 O HOH A 702 -6.301 -0.585 25.121 1.00 64.31 O HETATM 2563 O HOH A 703 -0.298 17.221 18.855 1.00 40.32 O HETATM 2564 O HOH A 704 -0.754 -5.336 -5.113 1.00 51.65 O HETATM 2565 O HOH A 705 10.785 11.665 18.553 1.00 30.88 O HETATM 2566 O HOH A 706 10.998 3.817 23.304 1.00 57.08 O HETATM 2567 O HOH A 707 2.920 -2.526 25.775 1.00 54.72 O HETATM 2568 O HOH A 708 10.809 14.061 20.479 1.00 33.53 O HETATM 2569 O HOH A 709 14.899 14.081 20.791 1.00 39.28 O HETATM 2570 O HOH A 710 1.641 -0.559 9.614 1.00 18.86 O HETATM 2571 O HOH A 711 8.755 -9.418 -0.756 1.00 25.52 O HETATM 2572 O HOH A 712 14.206 -3.008 10.390 1.00 39.62 O HETATM 2573 O HOH A 713 1.923 13.313 14.085 1.00 24.64 O HETATM 2574 O HOH A 714 14.131 19.103 15.890 1.00 33.10 O HETATM 2575 O HOH A 715 18.769 4.337 21.832 1.00346.40 O HETATM 2576 O HOH A 716 26.188 4.482 23.165 1.00 25.94 O HETATM 2577 O HOH A 717 14.659 -5.252 26.584 1.00 40.75 O HETATM 2578 O HOH A 718 6.270 -8.191 25.529 1.00 44.55 O HETATM 2579 O HOH A 719 5.469 -4.190 21.420 1.00 46.72 O HETATM 2580 O HOH A 720 -7.851 -5.616 13.358 1.00 25.33 O HETATM 2581 O HOH A 721 -5.229 -10.058 4.145 1.00 26.04 O HETATM 2582 O HOH A 722 -3.141 -7.834 22.372 1.00 39.72 O HETATM 2583 O HOH A 723 2.734 6.677 -2.693 1.00 52.61 O HETATM 2584 O HOH A 724 -0.531 4.628 -1.044 1.00 39.57 O HETATM 2585 O HOH A 725 -2.612 6.563 -1.230 1.00 36.42 O HETATM 2586 O HOH A 726 2.395 -20.495 10.106 1.00 34.08 O HETATM 2587 O HOH A 727 2.701 -19.511 7.732 1.00 36.58 O HETATM 2588 O HOH A 728 4.253 -16.661 10.081 1.00 44.06 O HETATM 2589 O HOH A 729 8.468 -19.748 1.125 1.00 27.55 O HETATM 2590 O HOH A 730 11.567 22.740 19.840 1.00 47.23 O HETATM 2591 O HOH A 731 9.750 20.620 15.452 1.00 35.55 O HETATM 2592 O HOH A 732 7.211 19.025 16.016 1.00 96.34 O HETATM 2593 O HOH A 733 -9.765 6.173 0.735 1.00 29.01 O HETATM 2594 O HOH A 734 -10.413 -4.585 15.819 1.00 28.10 O HETATM 2595 O HOH A 735 25.800 -4.641 1.304 1.00 26.52 O HETATM 2596 O HOH A 736 29.247 -9.025 8.598 1.00 34.27 O HETATM 2597 O HOH A 737 28.584 11.062 7.957 1.00 30.70 O HETATM 2598 O HOH A 738 -0.186 -0.344 -2.366 1.00 36.22 O HETATM 2599 O HOH A 739 -6.549 -14.119 23.801 1.00 35.88 O HETATM 2600 O HOH A 740 24.036 7.333 3.192 1.00 35.80 O HETATM 2601 O HOH A 741 2.552 2.609 16.412 1.00 35.35 O HETATM 2602 O HOH A 742 26.206 8.927 21.406 1.00 39.62 O HETATM 2603 O HOH A 743 -6.847 -2.231 18.511 1.00 33.92 O HETATM 2604 O HOH A 744 18.805 3.384 28.780 1.00 38.12 O HETATM 2605 O HOH A 745 -14.027 -5.940 16.933 1.00 39.31 O HETATM 2606 O HOH A 746 19.510 -11.937 6.206 1.00 30.21 O HETATM 2607 O HOH A 747 9.169 16.305 23.843 1.00 48.80 O HETATM 2608 O HOH A 748 9.100 -16.137 0.873 1.00 37.04 O HETATM 2609 O HOH A 749 -0.078 18.813 0.315 1.00 34.72 O HETATM 2610 O HOH A 750 9.749 -0.101 29.795 1.00 55.27 O HETATM 2611 O HOH A 751 17.681 -17.694 15.934 1.00 46.41 O HETATM 2612 O HOH A 752 11.948 -0.721 -9.204 1.00 51.00 O HETATM 2613 O HOH A 753 -0.665 12.472 21.164 1.00 60.46 O HETATM 2614 O HOH A 754 0.254 8.854 -4.831 1.00 42.91 O HETATM 2615 O HOH A 755 -10.171 18.407 15.066 1.00 38.61 O HETATM 2616 O HOH A 756 5.076 -12.376 -1.915 1.00 37.36 O HETATM 2617 O HOH A 757 6.489 15.077 28.327 1.00 44.61 O HETATM 2618 O HOH A 758 13.096 -6.451 28.382 1.00 39.67 O HETATM 2619 O HOH A 759 -7.339 3.571 25.636 1.00 46.45 O HETATM 2620 O HOH A 760 15.959 25.468 5.172 1.00 44.23 O HETATM 2621 O HOH A 761 12.883 27.472 9.919 1.00 42.88 O HETATM 2622 O HOH A 762 13.139 -18.168 2.818 1.00 49.42 O HETATM 2623 O HOH A 763 30.960 -7.513 4.685 1.00 43.82 O HETATM 2624 O HOH A 764 -7.627 -9.724 2.218 1.00 38.12 O HETATM 2625 O HOH A 765 23.222 18.602 18.347 1.00 42.65 O HETATM 2626 O HOH A 766 30.292 2.694 22.542 1.00 49.11 O HETATM 2627 O HOH A 767 -5.766 -17.813 22.125 1.00 49.60 O HETATM 2628 O HOH A 768 18.090 -11.132 2.618 1.00 49.29 O HETATM 2629 O HOH A 769 32.958 5.299 9.380 1.00 36.55 O HETATM 2630 O HOH A 770 9.115 23.489 15.900 1.00 45.35 O HETATM 2631 O HOH A 771 16.063 -10.317 -3.343 1.00 48.04 O HETATM 2632 O HOH A 772 25.368 -2.764 -3.469 1.00 45.58 O HETATM 2633 O HOH A 773 29.953 -7.226 19.244 1.00 48.72 O HETATM 2634 O HOH A 774 -15.023 1.584 3.648 1.00 43.02 O HETATM 2635 O HOH A 775 31.203 -2.881 15.006 1.00 45.44 O HETATM 2636 O HOH A 776 27.816 20.522 6.988 1.00 54.28 O HETATM 2637 O HOH A 777 20.485 -8.107 31.060 1.00 56.36 O HETATM 2638 O HOH A 778 -8.824 1.400 -2.552 1.00 52.15 O HETATM 2639 O HOH A 779 4.000 23.660 1.084 1.00 46.37 O HETATM 2640 O HOH A 780 5.919 23.915 7.277 1.00 40.96 O HETATM 2641 O HOH A 781 8.654 -7.384 -7.327 1.00 48.82 O HETATM 2642 O HOH A 782 1.226 2.964 32.025 1.00 57.20 O HETATM 2643 O HOH A 783 25.417 -12.109 25.212 1.00 40.06 O HETATM 2644 O HOH A 784 22.969 14.710 24.041 1.00 43.25 O HETATM 2645 O HOH A 785 -12.195 -7.049 0.077 1.00 48.85 O HETATM 2646 O HOH A 786 5.479 23.285 30.132 1.00 61.72 O HETATM 2647 O HOH A 787 3.393 -16.983 7.389 1.00 35.41 O HETATM 2648 O HOH A 788 0.889 -5.859 22.815 1.00 52.28 O HETATM 2649 O HOH A 789 -1.116 26.861 25.592 1.00 52.34 O HETATM 2650 O HOH A 790 18.491 -23.911 17.600 1.00 46.48 O HETATM 2651 O HOH A 791 7.838 25.429 13.945 1.00 47.13 O HETATM 2652 O HOH A 792 3.749 29.811 22.359 1.00 57.89 O HETATM 2653 O HOH A 793 -1.599 6.072 29.942 1.00 59.28 O HETATM 2654 O HOH A 794 22.973 -18.579 23.319 1.00 54.80 O HETATM 2655 O HOH A 795 9.761 13.864 29.445 1.00 55.44 O HETATM 2656 O HOH A 796 25.995 16.474 17.584 1.00 47.15 O HETATM 2657 O HOH A 797 15.489 21.514 26.188 1.00 49.13 O HETATM 2658 O HOH A 798 7.255 -25.656 17.325 1.00 45.29 O HETATM 2659 O HOH A 799 22.727 22.178 16.207 1.00 50.53 O HETATM 2660 O HOH A 800 4.734 11.522 -6.630 1.00 46.39 O HETATM 2661 O HOH A 801 -4.677 19.827 21.004 1.00 56.27 O HETATM 2662 O HOH A 802 21.460 0.662 29.405 1.00 62.94 O HETATM 2663 O HOH A 803 29.098 20.724 19.023 1.00 52.88 O HETATM 2664 O HOH A 804 -2.835 -21.161 21.120 1.00 55.95 O HETATM 2665 O HOH A 805 17.702 -27.814 19.246 1.00 45.29 O HETATM 2666 O HOH A 806 23.287 17.113 21.243 1.00 48.46 O HETATM 2667 O HOH A 807 9.314 -21.086 18.302 1.00 38.54 O HETATM 2668 O HOH A 808 6.534 10.608 29.035 1.00 50.30 O HETATM 2669 O HOH A 809 6.532 5.777 28.980 1.00 49.48 O HETATM 2670 O HOH A 810 30.003 8.879 5.848 1.00 56.22 O HETATM 2671 O HOH A 811 -0.915 23.209 24.366 1.00 46.56 O HETATM 2672 O HOH A 812 26.978 -16.776 7.495 1.00 54.23 O HETATM 2673 O HOH A 813 12.511 -8.757 32.396 1.00 49.03 O HETATM 2674 O HOH A 814 14.305 -15.930 28.984 1.00 46.64 O HETATM 2675 O HOH A 815 13.092 19.876 26.932 1.00 56.29 O HETATM 2676 O HOH A 816 11.638 -14.153 27.308 1.00 44.26 O HETATM 2677 O HOH A 817 10.324 -24.918 17.739 1.00 50.57 O HETATM 2678 O HOH A 818 1.042 8.629 27.466 1.00 52.54 O HETATM 2679 O HOH A 819 -2.440 -9.285 25.753 1.00 52.39 O HETATM 2680 O HOH A 820 19.044 -20.249 17.185 1.00 53.41 O HETATM 2681 O HOH A 821 -6.103 -12.554 26.377 1.00 41.49 O HETATM 2682 O HOH A 822 -4.828 30.477 22.123 1.00 55.87 O HETATM 2683 O HOH A 823 14.167 2.655 -8.120 1.00 51.32 O HETATM 2684 O HOH A 824 -2.010 -22.880 11.855 1.00 60.31 O HETATM 2685 O HOH A 825 17.071 -20.373 21.724 1.00 54.40 O HETATM 2686 O HOH A 826 -8.267 19.210 10.824 1.00 51.99 O HETATM 2687 O HOH A 827 24.930 32.423 12.397 1.00 50.47 O HETATM 2688 O HOH A 828 21.657 5.120 28.424 1.00 49.04 O HETATM 2689 O HOH A 829 20.510 18.193 25.415 1.00 65.84 O HETATM 2690 O HOH A 830 30.896 4.878 4.047 1.00 43.42 O HETATM 2691 O HOH A 831 6.022 30.063 28.995 1.00 47.39 O HETATM 2692 O HOH A 832 7.747 10.335 -5.633 1.00 42.60 O HETATM 2693 O HOH A 833 6.350 3.697 11.440 1.00 56.09 O HETATM 2694 O HOH A 834 -3.407 7.993 8.054 1.00 25.74 O HETATM 2695 O HOH A 835 -6.167 9.003 8.479 1.00 35.00 O HETATM 2696 O HOH A 836 -12.387 0.775 2.611 1.00 35.55 O HETATM 2697 O HOH A 837 -8.546 -0.869 -1.225 1.00 30.14 O CONECT 1279 2223 CONECT 1318 2223 CONECT 1619 2223 CONECT 1620 2223 CONECT 2223 1279 1318 1619 1620 CONECT 2223 2262 2264 CONECT 2224 2225 CONECT 2225 2224 2226 2227 CONECT 2226 2225 CONECT 2227 2225 2228 2229 CONECT 2228 2227 CONECT 2229 2227 2230 CONECT 2230 2229 2231 2233 CONECT 2231 2230 2232 CONECT 2232 2231 2235 CONECT 2233 2230 2234 CONECT 2234 2233 2235 CONECT 2235 2232 2234 2236 CONECT 2236 2235 2237 2238 CONECT 2237 2236 2242 CONECT 2238 2236 2239 CONECT 2239 2238 2240 2241 CONECT 2240 2239 CONECT 2241 2239 2242 CONECT 2242 2237 2241 2243 CONECT 2243 2242 2244 CONECT 2244 2243 2245 2249 CONECT 2245 2244 2246 2247 2248 CONECT 2246 2245 CONECT 2247 2245 CONECT 2248 2245 CONECT 2249 2244 2250 2252 CONECT 2250 2249 2251 CONECT 2251 2250 2254 CONECT 2252 2249 2253 CONECT 2253 2252 2254 CONECT 2254 2251 2253 2255 CONECT 2255 2254 2256 2257 CONECT 2256 2255 2261 CONECT 2257 2255 2258 CONECT 2258 2257 2259 2260 CONECT 2259 2258 CONECT 2260 2258 2261 CONECT 2261 2256 2260 CONECT 2262 2223 CONECT 2264 2223 END