USER MOD reduce.3.24.130724 H: found=0, std=0, add=2032, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER PROTEIN BINDING 21-JAN-10 3LH5 TITLE CRYSTAL STRUCTURE OF THE SH3-GUANYLATE KINASE CORE DOMAIN OF ZO-1 COMPND MOL_ID: 1; COMPND 2 MOLECULE: TIGHT JUNCTION PROTEIN ZO-1; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: UNP RESIDUES 516-588, 626-803; COMPND 5 SYNONYM: ZONULA OCCLUDENS PROTEIN 1, ZONA OCCLUDENS PROTEIN 1, TIGHT COMPND 6 JUNCTION PROTEIN 1; COMPND 7 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_TAXID: 9606; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 6 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3) KEYWDS ZO-1, SH3-GUANYLATE KINASE, INTRAMOLECULAR FOLD, CELL JUNCTION, CELL KEYWDS 2 MEMBRANE, MEMBRANE, PHOSPHOPROTEIN, SH3 DOMAIN, TIGHT JUNCTION, KEYWDS 3 PROTEIN BINDING EXPDTA X-RAY DIFFRACTION AUTHOR M.F.LYE,A.LAVIE REVDAT 2 12-JAN-11 3LH5 1 JRNL REVDAT 1 02-MAR-10 3LH5 0 JRNL AUTH M.F.LYE,A.S.FANNING,Y.SU,J.M.ANDERSON,A.LAVIE JRNL TITL INSIGHTS INTO REGULATED LIGAND BINDING SITES FROM THE JRNL TITL 2 STRUCTURE OF ZO-1 SRC HOMOLOGY 3-GUANYLATE KINASE MODULE. JRNL REF J.BIOL.CHEM. V. 285 13907 2010 JRNL REFN ISSN 0021-9258 JRNL PMID 20200156 JRNL DOI 10.1074/JBC.M109.093674 REMARK 2 REMARK 2 RESOLUTION. 2.60 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0019 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) : 2.60 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 27.24 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 99.6 REMARK 3 NUMBER OF REFLECTIONS : 9187 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) : 0.213 REMARK 3 R VALUE (WORKING SET) : 0.205 REMARK 3 FREE R VALUE : 0.285 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 9.900 REMARK 3 FREE R VALUE TEST SET COUNT : 1010 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.60 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.67 REMARK 3 REFLECTION IN BIN (WORKING SET) : 694 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 100.00 REMARK 3 BIN R VALUE (WORKING SET) : 0.2710 REMARK 3 BIN FREE R VALUE SET COUNT : 71 REMARK 3 BIN FREE R VALUE : 0.3920 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2026 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 73 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 58.39 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.30000 REMARK 3 B22 (A**2) : -0.30000 REMARK 3 B33 (A**2) : 0.45000 REMARK 3 B12 (A**2) : -0.15000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.901 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.368 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.252 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 23.036 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.946 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.907 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2070 ; 0.011 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 2795 ; 1.279 ; 1.946 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 246 ; 6.320 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 107 ;40.140 ;23.551 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 372 ;19.943 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 19 ;22.112 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 298 ; 0.081 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1584 ; 0.004 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 892 ; 0.209 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 1375 ; 0.307 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 95 ; 0.160 ; 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): 40 ; 0.173 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 10 ; 0.119 ; 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): 1273 ; 0.543 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 1995 ; 0.879 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 909 ; 1.371 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 800 ; 2.242 ; 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 : 2 REMARK 3 REMARK 3 TLS GROUP : 1 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 1 A 89 REMARK 3 ORIGIN FOR THE GROUP (A): 17.0530 48.7770 15.5900 REMARK 3 T TENSOR REMARK 3 T11: 0.0081 T22: 0.0446 REMARK 3 T33: -0.0186 T12: -0.2946 REMARK 3 T13: -0.1350 T23: 0.1523 REMARK 3 L TENSOR REMARK 3 L11: 10.0987 L22: 4.3760 REMARK 3 L33: 4.1607 L12: 2.7294 REMARK 3 L13: -1.5055 L23: 0.1602 REMARK 3 S TENSOR REMARK 3 S11: -0.3676 S12: 0.5429 S13: 0.3308 REMARK 3 S21: -0.3538 S22: 0.3996 S23: 0.2470 REMARK 3 S31: -0.0318 S32: -0.4065 S33: -0.0320 REMARK 3 REMARK 3 TLS GROUP : 2 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 90 A 251 REMARK 3 ORIGIN FOR THE GROUP (A): -5.5080 33.2980 16.3920 REMARK 3 T TENSOR REMARK 3 T11: -0.2507 T22: -0.1298 REMARK 3 T33: -0.1186 T12: -0.0156 REMARK 3 T13: -0.0403 T23: 0.0903 REMARK 3 L TENSOR REMARK 3 L11: 2.9481 L22: 2.7049 REMARK 3 L33: 4.0514 L12: 0.6606 REMARK 3 L13: 0.4609 L23: -0.1567 REMARK 3 S TENSOR REMARK 3 S11: 0.0063 S12: 0.0174 S13: 0.1992 REMARK 3 S21: -0.0927 S22: -0.0796 S23: 0.0316 REMARK 3 S31: -0.1650 S32: 0.0629 S33: 0.0733 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 3LH5 COMPLIES WITH FORMAT V. 3.20, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 29-JAN-10. REMARK 100 THE RCSB ID CODE IS RCSB057272. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 25-JUL-08 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 22-ID REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : NULL REMARK 200 WAVELENGTH OR RANGE (A) : 0.9794 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARRESEARCH REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : XSCALE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 10199 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.600 REMARK 200 RESOLUTION RANGE LOW (A) : 30.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.7 REMARK 200 DATA REDUNDANCY : 8.500 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.08500 REMARK 200 FOR THE DATA SET : 15.5000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.60 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.65 REMARK 200 COMPLETENESS FOR SHELL (%) : 58.8 REMARK 200 DATA REDUNDANCY IN SHELL : 4.00 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : 0.08500 REMARK 200 FOR SHELL : 1.900 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: MIRAS REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MIRAS REMARK 200 SOFTWARE USED: SOLVE REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 56.06 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.80 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.1 M HEPES PH 7.5, 7% ISOPROPANOL, REMARK 280 15-20% PEG3350, 1-5 MM DTT, VAPOR DIFFUSION, HANGING DROP, REMARK 280 TEMPERATURE 295K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 64 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+1/3 REMARK 290 3555 -X+Y,-X,Z+2/3 REMARK 290 4555 -X,-Y,Z REMARK 290 5555 Y,-X+Y,Z+1/3 REMARK 290 6555 X-Y,X,Z+2/3 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 11.86667 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 23.73333 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 5 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 5 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 11.86667 REMARK 290 SMTRY1 6 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 23.73333 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 ARG A 684 REMARK 465 SER A 685 REMARK 465 SER A 686 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 ARG A 740 NE - CZ - NH2 ANGL. DEV. = -3.5 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 LEU A 549 79.48 45.70 REMARK 500 TYR A 588 9.91 -67.36 REMARK 500 VAL A 626 98.45 -42.50 REMARK 500 GLN A 627 94.56 -69.74 REMARK 500 TYR A 722 75.32 26.24 REMARK 500 CYS A 744 66.89 -153.30 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 35 DISTANCE = 6.01 ANGSTROMS DBREF 3LH5 A 516 588 UNP Q07157 ZO1_HUMAN 516 588 DBREF 3LH5 A 626 803 UNP Q07157 ZO1_HUMAN 626 803 SEQRES 1 A 251 GLY ASP SER PHE TYR ILE ARG THR HIS PHE GLU TYR GLU SEQRES 2 A 251 LYS GLU SER PRO TYR GLY LEU SER PHE ASN LYS GLY GLU SEQRES 3 A 251 VAL PHE ARG VAL VAL ASP THR LEU TYR ASN GLY LYS LEU SEQRES 4 A 251 GLY SER TRP LEU ALA ILE ARG ILE GLY LYS ASN HIS LYS SEQRES 5 A 251 GLU VAL GLU ARG GLY ILE ILE PRO ASN LYS ASN ARG ALA SEQRES 6 A 251 GLU GLN LEU ALA SER VAL GLN TYR VAL GLN THR LYS PHE SEQRES 7 A 251 PRO ALA TYR GLU ARG VAL VAL LEU ARG GLU ALA GLY PHE SEQRES 8 A 251 LEU ARG PRO VAL THR ILE PHE GLY PRO ILE ALA ASP VAL SEQRES 9 A 251 ALA ARG GLU LYS LEU ALA ARG GLU GLU PRO ASP ILE TYR SEQRES 10 A 251 GLN ILE ALA LYS SER GLU PRO ARG ASP ALA GLY THR ASP SEQRES 11 A 251 GLN ARG SER SER GLY ILE ILE ARG LEU HIS THR ILE LYS SEQRES 12 A 251 GLN ILE ILE ASP GLN ASP LYS HIS ALA LEU LEU ASP VAL SEQRES 13 A 251 THR PRO ASN ALA VAL ASP ARG LEU ASN TYR ALA GLN TRP SEQRES 14 A 251 TYR PRO ILE VAL VAL PHE LEU ASN PRO ASP SER LYS GLN SEQRES 15 A 251 GLY VAL LYS THR MET ARG MET ARG LEU CYS PRO GLU SER SEQRES 16 A 251 ARG LYS SER ALA ARG LYS LEU TYR GLU ARG SER HIS LYS SEQRES 17 A 251 LEU ARG LYS ASN ASN HIS HIS LEU PHE THR THR THR ILE SEQRES 18 A 251 ASN LEU ASN SER MET ASN ASP GLY TRP TYR GLY ALA LEU SEQRES 19 A 251 LYS GLU ALA ILE GLN GLN GLN GLN ASN GLN LEU VAL TRP SEQRES 20 A 251 VAL SER GLU GLY FORMUL 2 HOH *73(H2 O) HELIX 1 1 LYS A 564 HIS A 566 5 3 HELIX 2 2 ASN A 576 ALA A 584 1 9 HELIX 3 3 ILE A 653 GLU A 665 1 13 HELIX 4 4 ARG A 690 ASP A 699 1 10 HELIX 5 5 THR A 709 ALA A 719 1 11 HELIX 6 6 SER A 732 CYS A 744 1 13 HELIX 7 7 SER A 750 HIS A 766 1 17 HELIX 8 8 HIS A 767 PHE A 769 5 3 HELIX 9 9 ASP A 780 ASN A 795 1 16 SHEET 1 A 6 GLU A 568 PRO A 575 0 SHEET 2 A 6 SER A 556 ILE A 562 -1 N ALA A 559 O GLY A 572 SHEET 3 A 6 VAL A 542 ASP A 547 -1 N ASP A 547 O LEU A 558 SHEET 4 A 6 PHE A 519 THR A 523 -1 N PHE A 519 O VAL A 545 SHEET 5 A 6 TYR A 633 ARG A 639 -1 O GLU A 634 N ARG A 522 SHEET 6 A 6 VAL A 798 SER A 801 -1 O VAL A 800 N VAL A 637 SHEET 1 B 5 TYR A 669 ILE A 671 0 SHEET 2 B 5 HIS A 703 LEU A 706 1 O LEU A 705 N GLN A 670 SHEET 3 B 5 VAL A 647 PHE A 650 1 N VAL A 647 O ALA A 704 SHEET 4 B 5 ILE A 724 ASN A 729 1 O ILE A 724 N THR A 648 SHEET 5 B 5 THR A 771 ASN A 774 1 O ILE A 773 N ASN A 729 CRYST1 125.800 125.800 35.600 90.00 90.00 120.00 P 64 6 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.007949 0.004589 0.000000 0.00000 SCALE2 0.000000 0.009179 0.000000 0.00000 SCALE3 0.000000 0.000000 0.028090 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 Set 1.1: A 791 GLN : amide:sc= -0.143 K(o=0.92,f=-1.2) USER MOD Set 1.2: A 795 ASN : amide:sc= 1.07 K(o=0.92,f=-0.31) USER MOD Set 2.1: A 538 ASN : amide:sc= 0 X(o=-0.066,f=-0.25) USER MOD Set 2.2: A 766 HIS : no HE2:sc= -0.0659 K(o=-0.066,f=-1) USER MOD Set 3.1: A 760 LYS NZ :NH3+ -125:sc= -0.312 (180deg=-2.13!) USER MOD Set 3.2: A 765 ASN : amide:sc= 0.111 K(o=-0.2,f=-1.7) USER MOD Set 4.1: A 729 ASN : amide:sc= -2.17! K(o=-7.6!,f=-1.6) USER MOD Set 4.2: A 774 ASN : amide:sc= -5.4! K(o=-7.6!,f=0.2) USER MOD Set 5.1: A 720 GLN : amide:sc= -0.149 X(o=1.1,f=1.4) USER MOD Set 5.2: A 722 TYR OH : rot 180:sc= -0.135 USER MOD Set 5.3: A 801 SER OG : rot -38:sc= 1.43 USER MOD Set 6.1: A 703 HIS : no HE2:sc= 1.18 K(o=1.7,f=-3.7!) USER MOD Set 6.2: A 794 GLN : amide:sc= 0.489 K(o=1.7,f=-2.1!) USER MOD Single : A 518 SER OG : rot 180:sc= 0 USER MOD Single : A 520 TYR OH : rot 180:sc= 0 USER MOD Single : A 523 THR OG1 : rot 153:sc= 0.578 USER MOD Single : A 524 HIS : no HD1:sc= -1.52 K(o=-1.5,f=-2.8!) USER MOD Single : A 527 TYR OH : rot -0:sc= 0.705 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 SER OG : rot 180:sc= 0.15 USER MOD Single : A 533 TYR OH : rot 180:sc= 0 USER MOD Single : A 536 SER OG : rot 180:sc= -0.279 USER MOD Single : A 539 LYS NZ :NH3+ -111:sc= 0 (180deg=-0.637) USER MOD Single : A 548 THR OG1 : rot 180:sc= 0.00566 USER MOD Single : A 550 TYR OH : rot 180:sc= 0 USER MOD Single : A 551 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 553 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 556 SER OG : rot 140:sc= -0.213 USER MOD Single : A 564 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 565 ASN : amide:sc= 0.0179 X(o=0.018,f=-0.077) USER MOD Single : A 566 HIS : no HD1:sc= 0.0932 K(o=0.093,f=-1.4) USER MOD Single : A 567 LYS NZ :NH3+ -161:sc= -0.21 (180deg=-0.787) USER MOD Single : A 576 ASN : amide:sc= -2.06! C(o=-2.1!,f=-1.5!) USER MOD Single : A 577 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 578 ASN : amide:sc= -1.33! K(o=-1.3!,f=-0.019) USER MOD Single : A 582 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 585 SER OG : rot 57:sc= 0.0694 USER MOD Single : A 587 GLN : amide:sc= -0.488 X(o=-0.49,f=0) USER MOD Single : A 588 TYR OH : rot 180:sc= 0 USER MOD Single : A 627 GLN : amide:sc= -0.672 X(o=-0.67,f=-0.71) USER MOD Single : A 628 THR OG1 : rot 160:sc= -0.864 USER MOD Single : A 629 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 633 TYR OH : rot 174:sc= 0.514 USER MOD Single : A 648 THR OG1 : rot 180:sc= 0 USER MOD Single : A 660 LYS NZ :NH3+ 148:sc= 1.37 (180deg=1.21) USER MOD Single : A 669 TYR OH : rot 180:sc= 0 USER MOD Single : A 670 GLN : amide:sc= -0.296 X(o=-0.3,f=0) USER MOD Single : A 673 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 674 SER OG : rot 180:sc= 0 USER MOD Single : A 681 THR OG1 : rot -75:sc= 0.852 USER MOD Single : A 683 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 692 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 693 THR OG1 : rot 180:sc= 0 USER MOD Single : A 695 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 696 GLN : amide:sc= -0.0174 X(o=-0.017,f=-0.057) USER MOD Single : A 700 GLN : amide:sc= -1.03 K(o=-1,f=-0.012) USER MOD Single : A 702 LYS NZ :NH3+ 163:sc= 0.0606 (180deg=-0.192) USER MOD Single : A 709 THR OG1 : rot 180:sc= 0 USER MOD Single : A 711 ASN : amide:sc= -2.18! K(o=-2.2!,f=-0.18) USER MOD Single : A 717 ASN : amide:sc= 0.208 K(o=0.21,f=-2!) USER MOD Single : A 718 TYR OH : rot 180:sc= 0 USER MOD Single : A 732 SER OG : rot 180:sc= 0.0126 USER MOD Single : A 733 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 734 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 737 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 738 THR OG1 : rot 79:sc= 0.0464 USER MOD Single : A 739 MET CE :methyl 155:sc= -0.0423 (180deg=-0.188) USER MOD Single : A 741 MET CE :methyl -142:sc= -0.529 (180deg=-0.776) USER MOD Single : A 744 CYS SG : rot 180:sc= 0 USER MOD Single : A 747 SER OG : rot -110:sc= 0 USER MOD Single : A 749 LYS NZ :NH3+ -110:sc= -1.81! (180deg=-3.18!) USER MOD Single : A 750 SER OG : rot 180:sc= 0.0822 USER MOD Single : A 753 LYS NZ :NH3+ 165:sc= -0.0613 (180deg=-0.209) USER MOD Single : A 755 TYR OH : rot 180:sc= 0 USER MOD Single : A 758 SER OG : rot 78:sc= -1.15 USER MOD Single : A 759 HIS : no HD1:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 763 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 764 ASN : amide:sc= -0.0869 K(o=-0.087,f=-1.4) USER MOD Single : A 767 HIS : no HD1:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 770 THR OG1 : rot 180:sc= 0 USER MOD Single : A 771 THR OG1 : rot 180:sc= 0 USER MOD Single : A 772 THR OG1 : rot 180:sc= 0 USER MOD Single : A 776 ASN : amide:sc= -0.715 K(o=-0.72,f=-13!) USER MOD Single : A 777 SER OG : rot -91:sc= 0.452 USER MOD Single : A 778 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 779 ASN : amide:sc= -8.46! C(o=-8.5!,f=-0.51!) USER MOD Single : A 783 TYR OH : rot 180:sc= 0 USER MOD Single : A 787 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 792 GLN : amide:sc= -0.743! K(o=-0.74!,f=-2.1) USER MOD Single : A 793 GLN : amide:sc= -1.88 K(o=-1.9,f=-3.2!) USER MOD Single : A 796 GLN : amide:sc= -0.0277 K(o=-0.028,f=-0.91) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 516 22.978 52.406 32.075 1.00 66.73 N ATOM 2 CA GLY A 516 24.053 53.303 31.550 1.00 66.78 C ATOM 3 C GLY A 516 23.555 54.073 30.341 1.00 66.77 C ATOM 4 O GLY A 516 22.487 54.701 30.400 1.00 67.01 O ATOM 0 HA2 GLY A 516 24.333 53.922 32.242 1.00 66.78 H new ATOM 0 HA3 GLY A 516 24.832 52.777 31.308 1.00 66.78 H new ATOM 5 N ASP A 517 24.319 54.017 29.246 1.00 66.23 N ATOM 6 CA ASP A 517 23.965 54.703 27.992 1.00 65.80 C ATOM 7 C ASP A 517 22.680 54.151 27.320 1.00 65.05 C ATOM 8 O ASP A 517 21.887 54.912 26.744 1.00 65.15 O ATOM 9 CB ASP A 517 25.132 54.628 26.979 1.00 66.13 C ATOM 10 CG ASP A 517 26.398 55.400 27.428 1.00 67.31 C ATOM 11 OD1 ASP A 517 26.831 56.305 26.674 1.00 67.72 O ATOM 12 OD2 ASP A 517 26.984 55.090 28.498 1.00 67.67 O ATOM 0 H ASP A 517 25.059 53.580 29.207 1.00 66.23 H new ATOM 0 HA ASP A 517 23.789 55.624 28.242 1.00 65.80 H new ATOM 0 HB2 ASP A 517 25.365 53.698 26.834 1.00 66.13 H new ATOM 0 HB3 ASP A 517 24.833 54.981 26.127 1.00 66.13 H new ATOM 13 N SER A 518 22.479 52.835 27.407 1.00 63.79 N ATOM 14 CA SER A 518 21.576 52.120 26.493 1.00 62.49 C ATOM 15 C SER A 518 20.081 52.428 26.607 1.00 61.22 C ATOM 16 O SER A 518 19.586 52.805 27.663 1.00 60.97 O ATOM 17 CB SER A 518 21.776 50.620 26.632 1.00 62.40 C ATOM 18 OG SER A 518 21.297 50.195 27.891 1.00 63.84 O ATOM 0 H SER A 518 22.858 52.332 27.993 1.00 63.79 H new ATOM 0 HA SER A 518 21.832 52.453 25.619 1.00 62.49 H new ATOM 0 HB2 SER A 518 21.306 50.154 25.923 1.00 62.40 H new ATOM 0 HB3 SER A 518 22.716 50.400 26.542 1.00 62.40 H new ATOM 0 HG SER A 518 21.406 49.366 27.967 1.00 63.84 H new ATOM 19 N PHE A 519 19.387 52.256 25.486 1.00 59.76 N ATOM 20 CA PHE A 519 17.933 52.261 25.424 1.00 58.62 C ATOM 21 C PHE A 519 17.523 51.214 24.402 1.00 58.20 C ATOM 22 O PHE A 519 18.346 50.790 23.586 1.00 58.19 O ATOM 23 CB PHE A 519 17.388 53.644 25.039 1.00 58.20 C ATOM 24 CG PHE A 519 17.882 54.156 23.714 1.00 57.00 C ATOM 25 CD1 PHE A 519 17.145 53.942 22.551 1.00 57.38 C ATOM 26 CD2 PHE A 519 19.066 54.875 23.628 1.00 55.23 C ATOM 27 CE1 PHE A 519 17.600 54.425 21.317 1.00 57.20 C ATOM 28 CE2 PHE A 519 19.530 55.357 22.409 1.00 55.09 C ATOM 29 CZ PHE A 519 18.801 55.137 21.251 1.00 56.48 C ATOM 0 H PHE A 519 19.760 52.130 24.722 1.00 59.76 H new ATOM 0 HA PHE A 519 17.562 52.055 26.296 1.00 58.62 H new ATOM 0 HB2 PHE A 519 16.419 53.604 25.018 1.00 58.20 H new ATOM 0 HB3 PHE A 519 17.630 54.280 25.730 1.00 58.20 H new ATOM 0 HD1 PHE A 519 16.343 53.474 22.594 1.00 57.38 H new ATOM 0 HD2 PHE A 519 19.558 55.037 24.400 1.00 55.23 H new ATOM 0 HE1 PHE A 519 17.105 54.272 20.545 1.00 57.20 H new ATOM 0 HE2 PHE A 519 20.331 55.828 22.371 1.00 55.09 H new ATOM 0 HZ PHE A 519 19.109 55.461 20.435 1.00 56.48 H new ATOM 30 N TYR A 520 16.262 50.801 24.448 1.00 57.57 N ATOM 31 CA TYR A 520 15.748 49.791 23.519 1.00 57.25 C ATOM 32 C TYR A 520 14.791 50.340 22.462 1.00 57.28 C ATOM 33 O TYR A 520 14.003 51.257 22.722 1.00 56.80 O ATOM 34 CB TYR A 520 15.046 48.660 24.269 1.00 56.45 C ATOM 35 CG TYR A 520 15.885 47.988 25.317 1.00 55.96 C ATOM 36 CD1 TYR A 520 16.094 48.592 26.564 1.00 55.09 C ATOM 37 CD2 TYR A 520 16.444 46.733 25.083 1.00 54.95 C ATOM 38 CE1 TYR A 520 16.846 47.976 27.532 1.00 54.16 C ATOM 39 CE2 TYR A 520 17.200 46.104 26.051 1.00 54.17 C ATOM 40 CZ TYR A 520 17.408 46.739 27.270 1.00 54.42 C ATOM 41 OH TYR A 520 18.161 46.125 28.235 1.00 54.59 O ATOM 0 H TYR A 520 15.682 51.093 25.012 1.00 57.57 H new ATOM 0 HA TYR A 520 16.534 49.461 23.056 1.00 57.25 H new ATOM 0 HB2 TYR A 520 14.247 49.014 24.690 1.00 56.45 H new ATOM 0 HB3 TYR A 520 14.757 47.993 23.627 1.00 56.45 H new ATOM 0 HD1 TYR A 520 15.717 49.424 26.738 1.00 55.09 H new ATOM 0 HD2 TYR A 520 16.306 46.314 24.264 1.00 54.95 H new ATOM 0 HE1 TYR A 520 16.977 48.386 28.356 1.00 54.16 H new ATOM 0 HE2 TYR A 520 17.566 45.265 25.890 1.00 54.17 H new ATOM 0 HH TYR A 520 18.438 45.386 27.947 1.00 54.59 H new ATOM 42 N ILE A 521 14.853 49.737 21.279 1.00 57.54 N ATOM 43 CA ILE A 521 13.960 50.086 20.186 1.00 58.15 C ATOM 44 C ILE A 521 13.299 48.855 19.572 1.00 58.07 C ATOM 45 O ILE A 521 13.787 47.737 19.739 1.00 58.36 O ATOM 46 CB ILE A 521 14.682 50.904 19.070 1.00 58.46 C ATOM 47 CG1 ILE A 521 15.943 50.169 18.561 1.00 59.31 C ATOM 48 CG2 ILE A 521 14.964 52.357 19.544 1.00 58.04 C ATOM 49 CD1 ILE A 521 16.619 50.832 17.302 1.00 58.75 C ATOM 0 H ILE A 521 15.415 49.114 21.090 1.00 57.54 H new ATOM 0 HA ILE A 521 13.271 50.645 20.577 1.00 58.15 H new ATOM 0 HB ILE A 521 14.090 50.976 18.305 1.00 58.46 H new ATOM 0 HG12 ILE A 521 16.593 50.129 19.280 1.00 59.31 H new ATOM 0 HG13 ILE A 521 15.705 49.254 18.343 1.00 59.31 H new ATOM 0 HG21 ILE A 521 15.412 52.847 18.837 1.00 58.04 H new ATOM 0 HG22 ILE A 521 14.126 52.796 19.760 1.00 58.04 H new ATOM 0 HG23 ILE A 521 15.530 52.337 20.332 1.00 58.04 H new ATOM 0 HD11 ILE A 521 17.399 50.316 17.044 1.00 58.75 H new ATOM 0 HD12 ILE A 521 15.986 50.850 16.567 1.00 58.75 H new ATOM 0 HD13 ILE A 521 16.888 51.738 17.519 1.00 58.75 H new ATOM 50 N ARG A 522 12.179 49.075 18.880 1.00 57.81 N ATOM 51 CA ARG A 522 11.553 48.061 18.029 1.00 57.00 C ATOM 52 C ARG A 522 11.541 48.567 16.588 1.00 56.78 C ATOM 53 O ARG A 522 11.172 49.707 16.325 1.00 56.47 O ATOM 54 CB ARG A 522 10.128 47.761 18.498 1.00 56.74 C ATOM 55 CG ARG A 522 9.573 46.455 17.961 1.00 56.39 C ATOM 56 CD ARG A 522 8.075 46.349 18.151 1.00 55.59 C ATOM 57 NE ARG A 522 7.697 45.696 19.401 1.00 54.99 N ATOM 58 CZ ARG A 522 6.981 46.262 20.376 1.00 54.09 C ATOM 59 NH1 ARG A 522 6.554 47.514 20.273 1.00 54.68 N ATOM 60 NH2 ARG A 522 6.684 45.571 21.462 1.00 52.29 N ATOM 0 H ARG A 522 11.758 49.825 18.892 1.00 57.81 H new ATOM 0 HA ARG A 522 12.062 47.237 18.085 1.00 57.00 H new ATOM 0 HB2 ARG A 522 10.114 47.735 19.468 1.00 56.74 H new ATOM 0 HB3 ARG A 522 9.546 48.487 18.225 1.00 56.74 H new ATOM 0 HG2 ARG A 522 9.784 46.380 17.017 1.00 56.39 H new ATOM 0 HG3 ARG A 522 10.008 45.712 18.409 1.00 56.39 H new ATOM 0 HD2 ARG A 522 7.689 47.238 18.128 1.00 55.59 H new ATOM 0 HD3 ARG A 522 7.695 45.855 17.408 1.00 55.59 H new ATOM 0 HE ARG A 522 7.955 44.884 19.519 1.00 54.99 H new ATOM 0 HH11 ARG A 522 6.737 47.974 19.570 1.00 54.68 H new ATOM 0 HH12 ARG A 522 6.094 47.865 20.909 1.00 54.68 H new ATOM 0 HH21 ARG A 522 6.952 44.758 21.541 1.00 52.29 H new ATOM 0 HH22 ARG A 522 6.223 45.935 22.090 1.00 52.29 H new ATOM 61 N THR A 523 11.966 47.720 15.663 1.00 56.78 N ATOM 62 CA THR A 523 11.980 48.069 14.247 1.00 57.06 C ATOM 63 C THR A 523 10.597 47.871 13.629 1.00 56.78 C ATOM 64 O THR A 523 9.862 46.963 14.014 1.00 56.83 O ATOM 65 CB THR A 523 12.951 47.171 13.455 1.00 57.43 C ATOM 66 OG1 THR A 523 12.430 45.826 13.413 1.00 58.88 O ATOM 67 CG2 THR A 523 14.331 47.177 14.084 1.00 56.51 C ATOM 0 H THR A 523 12.254 46.928 15.835 1.00 56.78 H new ATOM 0 HA THR A 523 12.258 48.997 14.196 1.00 57.06 H new ATOM 0 HB THR A 523 13.032 47.518 12.553 1.00 57.43 H new ATOM 0 HG1 THR A 523 12.716 45.436 12.726 1.00 58.88 H new ATOM 0 HG21 THR A 523 14.924 46.606 13.570 1.00 56.51 H new ATOM 0 HG22 THR A 523 14.680 48.082 14.091 1.00 56.51 H new ATOM 0 HG23 THR A 523 14.273 46.846 14.994 1.00 56.51 H new ATOM 68 N HIS A 524 10.263 48.715 12.656 1.00 56.52 N ATOM 69 CA HIS A 524 9.014 48.600 11.902 1.00 56.02 C ATOM 70 C HIS A 524 9.296 48.702 10.409 1.00 55.77 C ATOM 71 O HIS A 524 8.448 49.124 9.612 1.00 55.82 O ATOM 72 CB HIS A 524 7.994 49.636 12.378 1.00 55.94 C ATOM 73 CG HIS A 524 7.511 49.389 13.774 1.00 56.42 C ATOM 74 ND1 HIS A 524 6.380 48.647 14.052 1.00 56.38 N ATOM 75 CD2 HIS A 524 8.030 49.749 14.971 1.00 56.21 C ATOM 76 CE1 HIS A 524 6.219 48.573 15.361 1.00 56.64 C ATOM 77 NE2 HIS A 524 7.204 49.236 15.941 1.00 56.46 N ATOM 0 H HIS A 524 10.757 49.375 12.412 1.00 56.52 H new ATOM 0 HA HIS A 524 8.620 47.729 12.065 1.00 56.02 H new ATOM 0 HB2 HIS A 524 8.393 50.519 12.331 1.00 55.94 H new ATOM 0 HB3 HIS A 524 7.235 49.635 11.774 1.00 55.94 H new ATOM 0 HD2 HIS A 524 8.801 50.250 15.111 1.00 56.21 H new ATOM 0 HE1 HIS A 524 5.529 48.130 15.800 1.00 56.64 H new ATOM 0 HE2 HIS A 524 7.311 49.331 16.789 1.00 56.46 H new ATOM 78 N PHE A 525 10.513 48.309 10.050 1.00 55.30 N ATOM 79 CA PHE A 525 10.904 48.137 8.660 1.00 55.10 C ATOM 80 C PHE A 525 11.873 46.964 8.528 1.00 54.81 C ATOM 81 O PHE A 525 12.540 46.589 9.478 1.00 54.90 O ATOM 82 CB PHE A 525 11.485 49.439 8.079 1.00 55.14 C ATOM 83 CG PHE A 525 12.810 49.851 8.677 1.00 55.02 C ATOM 84 CD1 PHE A 525 14.003 49.550 8.028 1.00 55.18 C ATOM 85 CD2 PHE A 525 12.861 50.567 9.866 1.00 55.13 C ATOM 86 CE1 PHE A 525 15.216 49.931 8.568 1.00 56.39 C ATOM 87 CE2 PHE A 525 14.068 50.949 10.418 1.00 55.18 C ATOM 88 CZ PHE A 525 15.250 50.634 9.769 1.00 56.32 C ATOM 0 H PHE A 525 11.139 48.134 10.613 1.00 55.30 H new ATOM 0 HA PHE A 525 10.114 47.929 8.137 1.00 55.10 H new ATOM 0 HB2 PHE A 525 11.594 49.333 7.121 1.00 55.14 H new ATOM 0 HB3 PHE A 525 10.845 50.155 8.214 1.00 55.14 H new ATOM 0 HD1 PHE A 525 13.984 49.087 7.222 1.00 55.18 H new ATOM 0 HD2 PHE A 525 12.069 50.793 10.298 1.00 55.13 H new ATOM 0 HE1 PHE A 525 16.008 49.718 8.130 1.00 56.39 H new ATOM 0 HE2 PHE A 525 14.087 51.416 11.222 1.00 55.18 H new ATOM 0 HZ PHE A 525 16.065 50.892 10.135 1.00 56.32 H new ATOM 89 N GLU A 526 11.920 46.370 7.350 1.00 55.02 N ATOM 90 CA GLU A 526 12.867 45.303 7.068 1.00 55.52 C ATOM 91 C GLU A 526 14.176 45.936 6.588 1.00 55.21 C ATOM 92 O GLU A 526 14.163 46.950 5.904 1.00 55.42 O ATOM 93 CB GLU A 526 12.283 44.355 6.000 1.00 55.44 C ATOM 94 CG GLU A 526 12.829 42.933 6.058 1.00 55.86 C ATOM 95 CD GLU A 526 12.315 42.057 4.932 1.00 56.31 C ATOM 96 OE1 GLU A 526 11.168 41.553 5.012 1.00 56.51 O ATOM 97 OE2 GLU A 526 13.076 41.859 3.962 1.00 57.93 O ATOM 0 H GLU A 526 11.406 46.571 6.691 1.00 55.02 H new ATOM 0 HA GLU A 526 13.039 44.779 7.866 1.00 55.52 H new ATOM 0 HB2 GLU A 526 11.319 44.325 6.102 1.00 55.44 H new ATOM 0 HB3 GLU A 526 12.464 44.724 5.121 1.00 55.44 H new ATOM 0 HG2 GLU A 526 13.798 42.962 6.023 1.00 55.86 H new ATOM 0 HG3 GLU A 526 12.588 42.533 6.908 1.00 55.86 H new ATOM 98 N TYR A 527 15.304 45.346 6.952 1.00 55.31 N ATOM 99 CA TYR A 527 16.600 45.898 6.586 1.00 55.32 C ATOM 100 C TYR A 527 17.632 44.816 6.364 1.00 55.68 C ATOM 101 O TYR A 527 17.740 43.859 7.140 1.00 55.63 O ATOM 102 CB TYR A 527 17.109 46.864 7.659 1.00 55.45 C ATOM 103 CG TYR A 527 18.569 47.228 7.509 1.00 55.29 C ATOM 104 CD1 TYR A 527 18.998 48.024 6.441 1.00 55.19 C ATOM 105 CD2 TYR A 527 19.524 46.773 8.423 1.00 55.36 C ATOM 106 CE1 TYR A 527 20.336 48.366 6.281 1.00 55.87 C ATOM 107 CE2 TYR A 527 20.881 47.120 8.284 1.00 56.15 C ATOM 108 CZ TYR A 527 21.278 47.917 7.201 1.00 56.72 C ATOM 109 OH TYR A 527 22.605 48.271 7.021 1.00 56.77 O ATOM 0 H TYR A 527 15.342 44.621 7.414 1.00 55.31 H new ATOM 0 HA TYR A 527 16.471 46.378 5.753 1.00 55.32 H new ATOM 0 HB2 TYR A 527 16.578 47.675 7.631 1.00 55.45 H new ATOM 0 HB3 TYR A 527 16.972 46.465 8.533 1.00 55.45 H new ATOM 0 HD1 TYR A 527 18.374 48.331 5.824 1.00 55.19 H new ATOM 0 HD2 TYR A 527 19.259 46.234 9.133 1.00 55.36 H new ATOM 0 HE1 TYR A 527 20.600 48.893 5.562 1.00 55.87 H new ATOM 0 HE2 TYR A 527 21.508 46.824 8.904 1.00 56.15 H new ATOM 0 HH TYR A 527 22.678 48.741 6.329 1.00 56.77 H new ATOM 110 N GLU A 528 18.411 44.983 5.308 1.00 56.06 N ATOM 111 CA GLU A 528 19.478 44.057 5.032 1.00 56.87 C ATOM 112 C GLU A 528 20.812 44.768 5.232 1.00 56.96 C ATOM 113 O GLU A 528 21.013 45.866 4.718 1.00 57.24 O ATOM 114 CB GLU A 528 19.336 43.533 3.613 1.00 56.97 C ATOM 115 CG GLU A 528 19.274 42.019 3.538 1.00 59.17 C ATOM 116 CD GLU A 528 20.604 41.377 3.165 1.00 61.42 C ATOM 117 OE1 GLU A 528 21.643 42.085 3.131 1.00 60.63 O ATOM 118 OE2 GLU A 528 20.591 40.151 2.891 1.00 62.67 O ATOM 0 H GLU A 528 18.334 45.627 4.743 1.00 56.06 H new ATOM 0 HA GLU A 528 19.438 43.300 5.637 1.00 56.87 H new ATOM 0 HB2 GLU A 528 18.532 43.904 3.217 1.00 56.97 H new ATOM 0 HB3 GLU A 528 20.085 43.847 3.082 1.00 56.97 H new ATOM 0 HG2 GLU A 528 18.984 41.671 4.396 1.00 59.17 H new ATOM 0 HG3 GLU A 528 18.604 41.761 2.886 1.00 59.17 H new ATOM 119 N LYS A 529 21.715 44.149 5.988 1.00 56.83 N ATOM 120 CA LYS A 529 23.048 44.710 6.212 1.00 56.75 C ATOM 121 C LYS A 529 23.829 44.891 4.913 1.00 56.58 C ATOM 122 O LYS A 529 23.773 44.031 4.034 1.00 56.22 O ATOM 123 CB LYS A 529 23.842 43.821 7.168 1.00 56.81 C ATOM 124 CG LYS A 529 24.010 42.386 6.707 1.00 56.56 C ATOM 125 CD LYS A 529 24.857 41.623 7.682 1.00 56.81 C ATOM 126 CE LYS A 529 24.859 40.156 7.370 1.00 57.48 C ATOM 127 NZ LYS A 529 25.953 39.511 8.130 1.00 58.97 N ATOM 0 H LYS A 529 21.576 43.398 6.383 1.00 56.83 H new ATOM 0 HA LYS A 529 22.923 45.588 6.605 1.00 56.75 H new ATOM 0 HB2 LYS A 529 24.721 44.211 7.298 1.00 56.81 H new ATOM 0 HB3 LYS A 529 23.401 43.821 8.032 1.00 56.81 H new ATOM 0 HG2 LYS A 529 23.141 41.963 6.623 1.00 56.56 H new ATOM 0 HG3 LYS A 529 24.421 42.368 5.828 1.00 56.56 H new ATOM 0 HD2 LYS A 529 25.766 41.962 7.659 1.00 56.81 H new ATOM 0 HD3 LYS A 529 24.524 41.764 8.582 1.00 56.81 H new ATOM 0 HE2 LYS A 529 24.006 39.760 7.608 1.00 57.48 H new ATOM 0 HE3 LYS A 529 24.982 40.015 6.418 1.00 57.48 H new ATOM 0 HZ1 LYS A 529 25.964 38.639 7.953 1.00 58.97 H new ATOM 0 HZ2 LYS A 529 26.732 39.871 7.893 1.00 58.97 H new ATOM 0 HZ3 LYS A 529 25.822 39.634 9.002 1.00 58.97 H new ATOM 128 N GLU A 530 24.541 46.011 4.789 1.00 56.50 N ATOM 129 CA GLU A 530 25.524 46.147 3.704 1.00 56.59 C ATOM 130 C GLU A 530 26.959 46.191 4.223 1.00 56.05 C ATOM 131 O GLU A 530 27.896 46.424 3.466 1.00 56.22 O ATOM 132 CB GLU A 530 25.226 47.331 2.771 1.00 57.07 C ATOM 133 CG GLU A 530 25.381 48.697 3.409 1.00 58.04 C ATOM 134 CD GLU A 530 24.166 49.067 4.212 1.00 59.21 C ATOM 135 OE1 GLU A 530 24.322 49.328 5.419 1.00 60.74 O ATOM 136 OE2 GLU A 530 23.054 49.073 3.640 1.00 58.44 O ATOM 0 H GLU A 530 24.475 46.693 5.309 1.00 56.50 H new ATOM 0 HA GLU A 530 25.436 45.343 3.169 1.00 56.59 H new ATOM 0 HB2 GLU A 530 25.816 47.278 2.003 1.00 57.07 H new ATOM 0 HB3 GLU A 530 24.319 47.244 2.438 1.00 57.07 H new ATOM 0 HG2 GLU A 530 26.163 48.701 3.982 1.00 58.04 H new ATOM 0 HG3 GLU A 530 25.531 49.363 2.720 1.00 58.04 H new ATOM 137 N SER A 531 27.115 45.967 5.520 1.00 55.47 N ATOM 138 CA SER A 531 28.422 45.752 6.119 1.00 55.00 C ATOM 139 C SER A 531 28.407 44.426 6.871 1.00 55.09 C ATOM 140 O SER A 531 27.410 44.102 7.521 1.00 55.18 O ATOM 141 CB SER A 531 28.760 46.879 7.090 1.00 54.81 C ATOM 142 OG SER A 531 29.619 46.398 8.103 1.00 53.58 O ATOM 0 H SER A 531 26.463 45.935 6.080 1.00 55.47 H new ATOM 0 HA SER A 531 29.093 45.736 5.419 1.00 55.00 H new ATOM 0 HB2 SER A 531 29.185 47.610 6.615 1.00 54.81 H new ATOM 0 HB3 SER A 531 27.947 47.232 7.485 1.00 54.81 H new ATOM 0 HG SER A 531 29.803 47.022 8.634 1.00 53.58 H new ATOM 143 N PRO A 532 29.516 43.665 6.807 1.00 55.00 N ATOM 144 CA PRO A 532 29.593 42.383 7.530 1.00 54.81 C ATOM 145 C PRO A 532 29.563 42.504 9.065 1.00 54.84 C ATOM 146 O PRO A 532 29.394 41.498 9.758 1.00 55.20 O ATOM 147 CB PRO A 532 30.928 41.791 7.060 1.00 54.85 C ATOM 148 CG PRO A 532 31.739 42.976 6.582 1.00 54.33 C ATOM 149 CD PRO A 532 30.750 43.961 6.049 1.00 54.75 C ATOM 0 HA PRO A 532 28.816 41.836 7.336 1.00 54.81 H new ATOM 0 HB2 PRO A 532 31.379 41.326 7.782 1.00 54.85 H new ATOM 0 HB3 PRO A 532 30.794 41.147 6.347 1.00 54.85 H new ATOM 0 HG2 PRO A 532 32.255 43.360 7.308 1.00 54.33 H new ATOM 0 HG3 PRO A 532 32.370 42.711 5.895 1.00 54.33 H new ATOM 0 HD2 PRO A 532 31.045 44.874 6.191 1.00 54.75 H new ATOM 0 HD3 PRO A 532 30.617 43.851 5.095 1.00 54.75 H new ATOM 150 N TYR A 533 29.722 43.714 9.593 1.00 54.76 N ATOM 151 CA TYR A 533 29.662 43.925 11.040 1.00 54.54 C ATOM 152 C TYR A 533 28.286 44.428 11.444 1.00 54.58 C ATOM 153 O TYR A 533 28.036 44.743 12.619 1.00 54.28 O ATOM 154 CB TYR A 533 30.752 44.898 11.491 1.00 54.58 C ATOM 155 CG TYR A 533 32.115 44.520 10.967 1.00 54.96 C ATOM 156 CD1 TYR A 533 32.677 43.277 11.273 1.00 55.62 C ATOM 157 CD2 TYR A 533 32.836 45.386 10.143 1.00 54.93 C ATOM 158 CE1 TYR A 533 33.918 42.909 10.779 1.00 55.39 C ATOM 159 CE2 TYR A 533 34.092 45.029 9.650 1.00 54.59 C ATOM 160 CZ TYR A 533 34.620 43.790 9.975 1.00 54.67 C ATOM 161 OH TYR A 533 35.850 43.419 9.504 1.00 54.71 O ATOM 0 H TYR A 533 29.866 44.426 9.133 1.00 54.76 H new ATOM 0 HA TYR A 533 29.818 43.076 11.482 1.00 54.54 H new ATOM 0 HB2 TYR A 533 30.529 45.792 11.188 1.00 54.58 H new ATOM 0 HB3 TYR A 533 30.777 44.925 12.460 1.00 54.58 H new ATOM 0 HD1 TYR A 533 32.209 42.686 11.818 1.00 55.62 H new ATOM 0 HD2 TYR A 533 32.474 46.213 9.919 1.00 54.93 H new ATOM 0 HE1 TYR A 533 34.277 42.076 10.986 1.00 55.39 H new ATOM 0 HE2 TYR A 533 34.569 45.616 9.109 1.00 54.59 H new ATOM 0 HH TYR A 533 36.167 44.037 9.032 1.00 54.71 H new ATOM 162 N GLY A 534 27.397 44.504 10.453 1.00 54.41 N ATOM 163 CA GLY A 534 26.029 44.949 10.676 1.00 54.16 C ATOM 164 C GLY A 534 25.121 43.802 11.069 1.00 54.01 C ATOM 165 O GLY A 534 25.540 42.643 11.095 1.00 54.06 O ATOM 0 H GLY A 534 27.573 44.299 9.637 1.00 54.41 H new ATOM 0 HA2 GLY A 534 26.018 45.624 11.373 1.00 54.16 H new ATOM 0 HA3 GLY A 534 25.690 45.368 9.870 1.00 54.16 H new ATOM 166 N LEU A 535 23.873 44.131 11.387 1.00 53.94 N ATOM 167 CA LEU A 535 22.845 43.123 11.672 1.00 53.42 C ATOM 168 C LEU A 535 21.617 43.414 10.828 1.00 52.81 C ATOM 169 O LEU A 535 21.064 44.518 10.890 1.00 52.46 O ATOM 170 CB LEU A 535 22.451 43.119 13.158 1.00 53.37 C ATOM 171 CG LEU A 535 23.491 43.142 14.297 1.00 54.48 C ATOM 172 CD1 LEU A 535 22.815 43.427 15.649 1.00 55.15 C ATOM 173 CD2 LEU A 535 24.270 41.840 14.375 1.00 53.67 C ATOM 0 H LEU A 535 23.595 44.943 11.445 1.00 53.94 H new ATOM 0 HA LEU A 535 23.209 42.250 11.456 1.00 53.42 H new ATOM 0 HB2 LEU A 535 21.876 43.888 13.293 1.00 53.37 H new ATOM 0 HB3 LEU A 535 21.906 42.329 13.297 1.00 53.37 H new ATOM 0 HG LEU A 535 24.116 43.856 14.097 1.00 54.48 H new ATOM 0 HD11 LEU A 535 23.485 43.437 16.350 1.00 55.15 H new ATOM 0 HD12 LEU A 535 22.371 44.289 15.614 1.00 55.15 H new ATOM 0 HD13 LEU A 535 22.162 42.735 15.837 1.00 55.15 H new ATOM 0 HD21 LEU A 535 24.913 41.890 15.100 1.00 53.67 H new ATOM 0 HD22 LEU A 535 23.658 41.105 14.537 1.00 53.67 H new ATOM 0 HD23 LEU A 535 24.738 41.692 13.538 1.00 53.67 H new ATOM 174 N SER A 536 21.211 42.431 10.030 1.00 52.41 N ATOM 175 CA SER A 536 19.935 42.486 9.323 1.00 52.20 C ATOM 176 C SER A 536 18.823 42.325 10.343 1.00 52.31 C ATOM 177 O SER A 536 19.031 41.758 11.420 1.00 52.31 O ATOM 178 CB SER A 536 19.828 41.361 8.288 1.00 51.81 C ATOM 179 OG SER A 536 21.047 41.159 7.600 1.00 51.85 O ATOM 0 H SER A 536 21.665 41.716 9.883 1.00 52.41 H new ATOM 0 HA SER A 536 19.866 43.335 8.858 1.00 52.20 H new ATOM 0 HB2 SER A 536 19.567 40.538 8.731 1.00 51.81 H new ATOM 0 HB3 SER A 536 19.129 41.574 7.650 1.00 51.81 H new ATOM 0 HG SER A 536 20.955 40.537 7.043 1.00 51.85 H new ATOM 180 N PHE A 537 17.647 42.832 10.016 1.00 52.48 N ATOM 181 CA PHE A 537 16.484 42.561 10.828 1.00 52.89 C ATOM 182 C PHE A 537 15.193 42.551 10.029 1.00 53.28 C ATOM 183 O PHE A 537 15.084 43.178 8.963 1.00 53.12 O ATOM 184 CB PHE A 537 16.381 43.542 12.016 1.00 53.08 C ATOM 185 CG PHE A 537 16.540 44.992 11.639 1.00 52.75 C ATOM 186 CD1 PHE A 537 15.520 45.677 10.972 1.00 51.39 C ATOM 187 CD2 PHE A 537 17.704 45.681 11.974 1.00 53.37 C ATOM 188 CE1 PHE A 537 15.661 47.007 10.631 1.00 51.53 C ATOM 189 CE2 PHE A 537 17.869 47.043 11.630 1.00 52.15 C ATOM 190 CZ PHE A 537 16.846 47.702 10.965 1.00 52.63 C ATOM 0 H PHE A 537 17.504 43.332 9.331 1.00 52.48 H new ATOM 0 HA PHE A 537 16.607 41.665 11.178 1.00 52.89 H new ATOM 0 HB2 PHE A 537 15.520 43.423 12.446 1.00 53.08 H new ATOM 0 HB3 PHE A 537 17.059 43.313 12.671 1.00 53.08 H new ATOM 0 HD1 PHE A 537 14.734 45.230 10.755 1.00 51.39 H new ATOM 0 HD2 PHE A 537 18.383 45.239 12.431 1.00 53.37 H new ATOM 0 HE1 PHE A 537 14.976 47.446 10.181 1.00 51.53 H new ATOM 0 HE2 PHE A 537 18.654 47.491 11.847 1.00 52.15 H new ATOM 0 HZ PHE A 537 16.939 48.599 10.739 1.00 52.63 H new ATOM 191 N ASN A 538 14.227 41.805 10.564 1.00 53.85 N ATOM 192 CA ASN A 538 12.830 41.851 10.151 1.00 54.05 C ATOM 193 C ASN A 538 12.107 42.978 10.891 1.00 54.32 C ATOM 194 O ASN A 538 12.692 43.635 11.765 1.00 54.26 O ATOM 195 CB ASN A 538 12.168 40.515 10.473 1.00 54.14 C ATOM 196 CG ASN A 538 12.717 39.359 9.632 1.00 55.15 C ATOM 197 OD1 ASN A 538 12.952 39.491 8.425 1.00 55.69 O ATOM 198 ND2 ASN A 538 12.898 38.210 10.269 1.00 55.74 N ATOM 0 H ASN A 538 14.374 41.241 11.197 1.00 53.85 H new ATOM 0 HA ASN A 538 12.779 42.018 9.197 1.00 54.05 H new ATOM 0 HB2 ASN A 538 12.296 40.314 11.413 1.00 54.14 H new ATOM 0 HB3 ASN A 538 11.212 40.590 10.327 1.00 54.14 H new ATOM 0 HD21 ASN A 538 13.189 37.523 9.842 1.00 55.74 H new ATOM 0 HD22 ASN A 538 12.725 38.152 11.109 1.00 55.74 H new ATOM 199 N LYS A 539 10.846 43.216 10.542 1.00 54.61 N ATOM 200 CA LYS A 539 9.989 44.086 11.345 1.00 55.14 C ATOM 201 C LYS A 539 9.689 43.423 12.687 1.00 55.46 C ATOM 202 O LYS A 539 9.679 42.191 12.792 1.00 55.29 O ATOM 203 CB LYS A 539 8.675 44.358 10.632 1.00 55.30 C ATOM 204 CG LYS A 539 8.785 45.257 9.433 1.00 55.80 C ATOM 205 CD LYS A 539 7.410 45.760 9.035 1.00 56.80 C ATOM 206 CE LYS A 539 6.667 44.739 8.209 1.00 56.92 C ATOM 207 NZ LYS A 539 7.102 44.842 6.799 1.00 57.43 N ATOM 0 H LYS A 539 10.467 42.884 9.845 1.00 54.61 H new ATOM 0 HA LYS A 539 10.457 44.924 11.483 1.00 55.14 H new ATOM 0 HB2 LYS A 539 8.292 43.512 10.352 1.00 55.30 H new ATOM 0 HB3 LYS A 539 8.055 44.756 11.263 1.00 55.30 H new ATOM 0 HG2 LYS A 539 9.367 46.007 9.634 1.00 55.80 H new ATOM 0 HG3 LYS A 539 9.188 44.775 8.694 1.00 55.80 H new ATOM 0 HD2 LYS A 539 6.897 45.969 9.831 1.00 56.80 H new ATOM 0 HD3 LYS A 539 7.499 46.584 8.531 1.00 56.80 H new ATOM 0 HE2 LYS A 539 6.839 43.846 8.547 1.00 56.92 H new ATOM 0 HE3 LYS A 539 5.711 44.888 8.275 1.00 56.92 H new ATOM 0 HZ1 LYS A 539 6.435 45.163 6.305 1.00 57.43 H new ATOM 0 HZ2 LYS A 539 7.802 45.389 6.743 1.00 57.43 H new ATOM 0 HZ3 LYS A 539 7.331 44.036 6.499 1.00 57.43 H new ATOM 208 N GLY A 540 9.459 44.247 13.708 1.00 55.91 N ATOM 209 CA GLY A 540 9.085 43.765 15.040 1.00 56.05 C ATOM 210 C GLY A 540 10.222 43.331 15.948 1.00 56.28 C ATOM 211 O GLY A 540 9.988 43.017 17.112 1.00 56.75 O ATOM 0 H GLY A 540 9.515 45.103 13.649 1.00 55.91 H new ATOM 0 HA2 GLY A 540 8.589 44.468 15.489 1.00 56.05 H new ATOM 0 HA3 GLY A 540 8.479 43.015 14.932 1.00 56.05 H new ATOM 212 N GLU A 541 11.451 43.303 15.440 1.00 56.32 N ATOM 213 CA GLU A 541 12.606 42.936 16.278 1.00 56.48 C ATOM 214 C GLU A 541 13.034 44.039 17.260 1.00 55.55 C ATOM 215 O GLU A 541 12.986 45.230 16.946 1.00 55.88 O ATOM 216 CB GLU A 541 13.792 42.449 15.433 1.00 56.34 C ATOM 217 CG GLU A 541 13.471 41.186 14.587 1.00 57.77 C ATOM 218 CD GLU A 541 14.718 40.568 13.953 1.00 58.18 C ATOM 219 OE1 GLU A 541 15.603 40.106 14.707 1.00 61.14 O ATOM 220 OE2 GLU A 541 14.814 40.541 12.705 1.00 58.82 O ATOM 0 H GLU A 541 11.643 43.490 14.623 1.00 56.32 H new ATOM 0 HA GLU A 541 12.302 42.196 16.826 1.00 56.48 H new ATOM 0 HB2 GLU A 541 14.073 43.164 14.841 1.00 56.34 H new ATOM 0 HB3 GLU A 541 14.540 42.256 16.019 1.00 56.34 H new ATOM 0 HG2 GLU A 541 13.038 40.526 15.150 1.00 57.77 H new ATOM 0 HG3 GLU A 541 12.840 41.421 13.889 1.00 57.77 H new ATOM 221 N VAL A 542 13.431 43.619 18.454 1.00 54.80 N ATOM 222 CA VAL A 542 13.875 44.514 19.504 1.00 53.85 C ATOM 223 C VAL A 542 15.395 44.558 19.537 1.00 53.70 C ATOM 224 O VAL A 542 16.071 43.571 19.229 1.00 52.83 O ATOM 225 CB VAL A 542 13.305 44.106 20.880 1.00 53.89 C ATOM 226 CG1 VAL A 542 13.732 45.083 21.970 1.00 53.65 C ATOM 227 CG2 VAL A 542 11.793 44.045 20.818 1.00 53.63 C ATOM 0 H VAL A 542 13.449 42.789 18.678 1.00 54.80 H new ATOM 0 HA VAL A 542 13.538 45.402 19.308 1.00 53.85 H new ATOM 0 HB VAL A 542 13.659 43.230 21.100 1.00 53.89 H new ATOM 0 HG11 VAL A 542 13.360 44.802 22.821 1.00 53.65 H new ATOM 0 HG12 VAL A 542 14.700 45.098 22.030 1.00 53.65 H new ATOM 0 HG13 VAL A 542 13.408 45.971 21.754 1.00 53.65 H new ATOM 0 HG21 VAL A 542 11.443 43.788 21.686 1.00 53.63 H new ATOM 0 HG22 VAL A 542 11.444 44.916 20.574 1.00 53.63 H new ATOM 0 HG23 VAL A 542 11.522 43.391 20.155 1.00 53.63 H new ATOM 228 N PHE A 543 15.912 45.732 19.889 1.00 53.76 N ATOM 229 CA PHE A 543 17.337 45.978 19.967 1.00 54.34 C ATOM 230 C PHE A 543 17.663 46.845 21.166 1.00 54.53 C ATOM 231 O PHE A 543 17.004 47.863 21.405 1.00 54.53 O ATOM 232 CB PHE A 543 17.825 46.713 18.719 1.00 54.52 C ATOM 233 CG PHE A 543 17.958 45.844 17.527 1.00 55.81 C ATOM 234 CD1 PHE A 543 16.875 45.665 16.655 1.00 55.29 C ATOM 235 CD2 PHE A 543 19.156 45.187 17.268 1.00 56.43 C ATOM 236 CE1 PHE A 543 16.984 44.855 15.551 1.00 54.99 C ATOM 237 CE2 PHE A 543 19.280 44.365 16.150 1.00 57.46 C ATOM 238 CZ PHE A 543 18.182 44.198 15.290 1.00 56.59 C ATOM 0 H PHE A 543 15.432 46.416 20.092 1.00 53.76 H new ATOM 0 HA PHE A 543 17.776 45.116 20.044 1.00 54.34 H new ATOM 0 HB2 PHE A 543 17.208 47.434 18.516 1.00 54.52 H new ATOM 0 HB3 PHE A 543 18.684 47.121 18.909 1.00 54.52 H new ATOM 0 HD1 PHE A 543 16.071 46.101 16.826 1.00 55.29 H new ATOM 0 HD2 PHE A 543 19.878 45.297 17.844 1.00 56.43 H new ATOM 0 HE1 PHE A 543 16.259 44.746 14.979 1.00 54.99 H new ATOM 0 HE2 PHE A 543 20.083 43.930 15.975 1.00 57.46 H new ATOM 0 HZ PHE A 543 18.256 43.647 14.544 1.00 56.59 H new ATOM 239 N ARG A 544 18.696 46.449 21.899 1.00 54.64 N ATOM 240 CA ARG A 544 19.321 47.327 22.860 1.00 55.14 C ATOM 241 C ARG A 544 20.337 48.212 22.111 1.00 55.27 C ATOM 242 O ARG A 544 21.353 47.717 21.612 1.00 55.56 O ATOM 243 CB ARG A 544 20.027 46.491 23.901 1.00 55.09 C ATOM 244 CG ARG A 544 20.320 47.220 25.188 1.00 56.71 C ATOM 245 CD ARG A 544 21.435 46.505 25.928 1.00 58.48 C ATOM 246 NE ARG A 544 21.273 46.597 27.368 1.00 60.45 N ATOM 247 CZ ARG A 544 22.265 46.484 28.244 1.00 62.27 C ATOM 248 NH1 ARG A 544 23.511 46.287 27.822 1.00 62.57 N ATOM 249 NH2 ARG A 544 22.007 46.573 29.547 1.00 63.32 N ATOM 0 H ARG A 544 19.049 45.666 21.850 1.00 54.64 H new ATOM 0 HA ARG A 544 18.661 47.886 23.300 1.00 55.14 H new ATOM 0 HB2 ARG A 544 19.483 45.713 24.099 1.00 55.09 H new ATOM 0 HB3 ARG A 544 20.862 46.166 23.528 1.00 55.09 H new ATOM 0 HG2 ARG A 544 20.578 48.136 25.001 1.00 56.71 H new ATOM 0 HG3 ARG A 544 19.523 47.256 25.740 1.00 56.71 H new ATOM 0 HD2 ARG A 544 21.452 45.572 25.664 1.00 58.48 H new ATOM 0 HD3 ARG A 544 22.289 46.888 25.674 1.00 58.48 H new ATOM 0 HE ARG A 544 20.481 46.734 27.674 1.00 60.45 H new ATOM 0 HH11 ARG A 544 23.676 46.232 26.980 1.00 62.57 H new ATOM 0 HH12 ARG A 544 24.151 46.214 28.391 1.00 62.57 H new ATOM 0 HH21 ARG A 544 21.201 46.703 29.818 1.00 63.32 H new ATOM 0 HH22 ARG A 544 22.646 46.500 30.118 1.00 63.32 H new ATOM 250 N VAL A 545 20.068 49.505 22.003 1.00 54.79 N ATOM 251 CA VAL A 545 21.050 50.376 21.384 1.00 55.01 C ATOM 252 C VAL A 545 22.120 50.733 22.406 1.00 54.92 C ATOM 253 O VAL A 545 21.867 51.473 23.341 1.00 55.04 O ATOM 254 CB VAL A 545 20.427 51.629 20.782 1.00 55.17 C ATOM 255 CG1 VAL A 545 21.521 52.519 20.200 1.00 54.90 C ATOM 256 CG2 VAL A 545 19.416 51.234 19.707 1.00 54.58 C ATOM 0 H VAL A 545 19.347 49.888 22.272 1.00 54.79 H new ATOM 0 HA VAL A 545 21.453 49.895 20.644 1.00 55.01 H new ATOM 0 HB VAL A 545 19.962 52.127 21.473 1.00 55.17 H new ATOM 0 HG11 VAL A 545 21.121 53.316 19.818 1.00 54.90 H new ATOM 0 HG12 VAL A 545 22.139 52.774 20.903 1.00 54.90 H new ATOM 0 HG13 VAL A 545 21.999 52.034 19.509 1.00 54.90 H new ATOM 0 HG21 VAL A 545 19.021 52.033 19.325 1.00 54.58 H new ATOM 0 HG22 VAL A 545 19.865 50.731 19.010 1.00 54.58 H new ATOM 0 HG23 VAL A 545 18.720 50.687 20.103 1.00 54.58 H new ATOM 257 N VAL A 546 23.314 50.190 22.208 1.00 54.94 N ATOM 258 CA VAL A 546 24.377 50.222 23.208 1.00 54.96 C ATOM 259 C VAL A 546 25.329 51.407 23.069 1.00 54.62 C ATOM 260 O VAL A 546 25.959 51.816 24.041 1.00 54.57 O ATOM 261 CB VAL A 546 25.148 48.867 23.218 1.00 55.19 C ATOM 262 CG1 VAL A 546 26.644 49.075 23.354 1.00 56.20 C ATOM 263 CG2 VAL A 546 24.602 47.933 24.342 1.00 55.34 C ATOM 0 H VAL A 546 23.534 49.787 21.481 1.00 54.94 H new ATOM 0 HA VAL A 546 23.942 50.350 24.066 1.00 54.96 H new ATOM 0 HB VAL A 546 24.997 48.434 22.363 1.00 55.19 H new ATOM 0 HG11 VAL A 546 27.092 48.214 23.357 1.00 56.20 H new ATOM 0 HG12 VAL A 546 26.966 49.604 22.608 1.00 56.20 H new ATOM 0 HG13 VAL A 546 26.832 49.539 24.185 1.00 56.20 H new ATOM 0 HG21 VAL A 546 25.092 47.096 24.334 1.00 55.34 H new ATOM 0 HG22 VAL A 546 24.713 48.364 25.204 1.00 55.34 H new ATOM 0 HG23 VAL A 546 23.661 47.757 24.188 1.00 55.34 H new ATOM 264 N ASP A 547 25.416 51.960 21.863 1.00 54.45 N ATOM 265 CA ASP A 547 26.335 53.054 21.575 1.00 54.40 C ATOM 266 C ASP A 547 25.933 53.730 20.267 1.00 54.36 C ATOM 267 O ASP A 547 25.859 53.087 19.218 1.00 54.76 O ATOM 268 CB ASP A 547 27.790 52.549 21.537 1.00 54.23 C ATOM 269 CG ASP A 547 28.811 53.673 21.420 1.00 54.08 C ATOM 270 OD1 ASP A 547 28.834 54.341 20.387 1.00 54.77 O ATOM 271 OD2 ASP A 547 29.634 53.878 22.333 1.00 55.82 O ATOM 0 H ASP A 547 24.943 51.711 21.189 1.00 54.45 H new ATOM 0 HA ASP A 547 26.283 53.713 22.285 1.00 54.40 H new ATOM 0 HB2 ASP A 547 27.970 52.038 22.342 1.00 54.23 H new ATOM 0 HB3 ASP A 547 27.897 51.943 20.787 1.00 54.23 H new ATOM 272 N THR A 548 25.682 55.035 20.345 1.00 54.11 N ATOM 273 CA THR A 548 25.275 55.838 19.195 1.00 53.79 C ATOM 274 C THR A 548 26.437 56.117 18.233 1.00 53.27 C ATOM 275 O THR A 548 26.243 56.738 17.181 1.00 53.85 O ATOM 276 CB THR A 548 24.613 57.180 19.637 1.00 53.90 C ATOM 277 OG1 THR A 548 25.439 57.829 20.609 1.00 54.13 O ATOM 278 CG2 THR A 548 23.249 56.929 20.244 1.00 53.79 C ATOM 0 H THR A 548 25.744 55.484 21.076 1.00 54.11 H new ATOM 0 HA THR A 548 24.617 55.309 18.718 1.00 53.79 H new ATOM 0 HB THR A 548 24.514 57.743 18.853 1.00 53.90 H new ATOM 0 HG1 THR A 548 25.081 58.552 20.844 1.00 54.13 H new ATOM 0 HG21 THR A 548 22.854 57.773 20.512 1.00 53.79 H new ATOM 0 HG22 THR A 548 22.677 56.498 19.589 1.00 53.79 H new ATOM 0 HG23 THR A 548 23.341 56.354 21.020 1.00 53.79 H new ATOM 279 N LEU A 549 27.627 55.645 18.591 1.00 52.17 N ATOM 280 CA LEU A 549 28.842 55.806 17.785 1.00 51.74 C ATOM 281 C LEU A 549 29.016 57.230 17.257 1.00 51.38 C ATOM 282 O LEU A 549 28.702 57.523 16.106 1.00 52.01 O ATOM 283 CB LEU A 549 28.894 54.769 16.657 1.00 51.73 C ATOM 284 CG LEU A 549 28.964 53.300 17.103 1.00 52.31 C ATOM 285 CD1 LEU A 549 28.496 52.369 16.003 1.00 51.30 C ATOM 286 CD2 LEU A 549 30.367 52.910 17.604 1.00 51.48 C ATOM 0 H LEU A 549 27.757 55.213 19.323 1.00 52.17 H new ATOM 0 HA LEU A 549 29.596 55.645 18.374 1.00 51.74 H new ATOM 0 HB2 LEU A 549 28.109 54.883 16.099 1.00 51.73 H new ATOM 0 HB3 LEU A 549 29.667 54.958 16.102 1.00 51.73 H new ATOM 0 HG LEU A 549 28.358 53.204 17.855 1.00 52.31 H new ATOM 0 HD11 LEU A 549 28.551 51.451 16.311 1.00 51.30 H new ATOM 0 HD12 LEU A 549 27.578 52.578 15.771 1.00 51.30 H new ATOM 0 HD13 LEU A 549 29.060 52.482 15.222 1.00 51.30 H new ATOM 0 HD21 LEU A 549 30.367 51.978 17.875 1.00 51.48 H new ATOM 0 HD22 LEU A 549 31.013 53.039 16.892 1.00 51.48 H new ATOM 0 HD23 LEU A 549 30.606 53.466 18.362 1.00 51.48 H new ATOM 287 N TYR A 550 29.500 58.104 18.129 1.00 50.73 N ATOM 288 CA TYR A 550 29.677 59.523 17.839 1.00 50.44 C ATOM 289 C TYR A 550 28.361 60.157 17.370 1.00 50.51 C ATOM 290 O TYR A 550 28.297 60.826 16.328 1.00 50.06 O ATOM 291 CB TYR A 550 30.848 59.746 16.861 1.00 49.88 C ATOM 292 CG TYR A 550 31.376 61.166 16.751 1.00 48.93 C ATOM 293 CD1 TYR A 550 31.838 61.653 15.525 1.00 48.91 C ATOM 294 CD2 TYR A 550 31.431 62.020 17.859 1.00 48.05 C ATOM 295 CE1 TYR A 550 32.344 62.939 15.396 1.00 47.68 C ATOM 296 CE2 TYR A 550 31.934 63.320 17.738 1.00 47.64 C ATOM 297 CZ TYR A 550 32.390 63.774 16.499 1.00 48.33 C ATOM 298 OH TYR A 550 32.881 65.065 16.341 1.00 47.79 O ATOM 0 H TYR A 550 29.741 57.885 18.925 1.00 50.73 H new ATOM 0 HA TYR A 550 29.920 59.981 18.659 1.00 50.44 H new ATOM 0 HB2 TYR A 550 31.581 59.169 17.128 1.00 49.88 H new ATOM 0 HB3 TYR A 550 30.566 59.457 15.979 1.00 49.88 H new ATOM 0 HD1 TYR A 550 31.806 61.101 14.777 1.00 48.91 H new ATOM 0 HD2 TYR A 550 31.129 61.719 18.686 1.00 48.05 H new ATOM 0 HE1 TYR A 550 32.651 63.239 14.571 1.00 47.68 H new ATOM 0 HE2 TYR A 550 31.964 63.880 18.480 1.00 47.64 H new ATOM 0 HH TYR A 550 32.856 65.467 17.078 1.00 47.79 H new ATOM 299 N ASN A 551 27.308 59.903 18.148 1.00 50.67 N ATOM 300 CA ASN A 551 26.015 60.570 17.973 1.00 50.72 C ATOM 301 C ASN A 551 25.364 60.346 16.615 1.00 50.54 C ATOM 302 O ASN A 551 24.705 61.231 16.082 1.00 50.37 O ATOM 303 CB ASN A 551 26.173 62.067 18.255 1.00 50.70 C ATOM 304 CG ASN A 551 26.661 62.331 19.653 1.00 50.96 C ATOM 305 OD1 ASN A 551 26.135 61.762 20.607 1.00 52.15 O ATOM 306 ND2 ASN A 551 27.675 63.176 19.790 1.00 50.22 N ATOM 0 H ASN A 551 27.323 59.337 18.795 1.00 50.67 H new ATOM 0 HA ASN A 551 25.409 60.163 18.612 1.00 50.72 H new ATOM 0 HB2 ASN A 551 26.796 62.451 17.618 1.00 50.70 H new ATOM 0 HB3 ASN A 551 25.321 62.512 18.122 1.00 50.70 H new ATOM 0 HD21 ASN A 551 27.991 63.345 20.572 1.00 50.22 H new ATOM 0 HD22 ASN A 551 28.016 63.554 19.097 1.00 50.22 H new ATOM 307 N GLY A 552 25.559 59.159 16.061 1.00 50.66 N ATOM 308 CA GLY A 552 25.025 58.837 14.749 1.00 51.20 C ATOM 309 C GLY A 552 25.768 59.469 13.581 1.00 51.75 C ATOM 310 O GLY A 552 25.372 59.262 12.432 1.00 51.48 O ATOM 0 H GLY A 552 26.001 58.522 16.432 1.00 50.66 H new ATOM 0 HA2 GLY A 552 25.035 57.873 14.638 1.00 51.20 H new ATOM 0 HA3 GLY A 552 24.097 59.117 14.714 1.00 51.20 H new ATOM 311 N LYS A 553 26.848 60.211 13.859 1.00 52.26 N ATOM 312 CA LYS A 553 27.559 60.988 12.817 1.00 53.09 C ATOM 313 C LYS A 553 28.231 60.136 11.740 1.00 53.97 C ATOM 314 O LYS A 553 28.615 60.651 10.695 1.00 54.28 O ATOM 315 CB LYS A 553 28.575 61.975 13.411 1.00 52.81 C ATOM 316 CG LYS A 553 27.953 63.165 14.123 1.00 52.58 C ATOM 317 CD LYS A 553 29.008 64.163 14.580 1.00 52.62 C ATOM 318 CE LYS A 553 28.405 65.169 15.539 1.00 52.68 C ATOM 319 NZ LYS A 553 29.063 66.506 15.505 1.00 52.23 N ATOM 0 H LYS A 553 27.189 60.281 14.645 1.00 52.26 H new ATOM 0 HA LYS A 553 26.853 61.487 12.378 1.00 53.09 H new ATOM 0 HB2 LYS A 553 29.144 61.499 14.036 1.00 52.81 H new ATOM 0 HB3 LYS A 553 29.147 62.301 12.699 1.00 52.81 H new ATOM 0 HG2 LYS A 553 27.326 63.606 13.529 1.00 52.58 H new ATOM 0 HG3 LYS A 553 27.447 62.855 14.890 1.00 52.58 H new ATOM 0 HD2 LYS A 553 29.739 63.694 15.012 1.00 52.62 H new ATOM 0 HD3 LYS A 553 29.380 64.623 13.812 1.00 52.62 H new ATOM 0 HE2 LYS A 553 27.464 65.276 15.331 1.00 52.68 H new ATOM 0 HE3 LYS A 553 28.458 64.815 16.441 1.00 52.68 H new ATOM 0 HZ1 LYS A 553 28.665 67.048 16.088 1.00 52.23 H new ATOM 0 HZ2 LYS A 553 29.922 66.420 15.720 1.00 52.23 H new ATOM 0 HZ3 LYS A 553 28.996 66.850 14.687 1.00 52.23 H new ATOM 320 N LEU A 554 28.373 58.844 11.996 1.00 54.94 N ATOM 321 CA LEU A 554 28.867 57.916 10.987 1.00 56.28 C ATOM 322 C LEU A 554 27.708 57.146 10.322 1.00 56.46 C ATOM 323 O LEU A 554 27.945 56.180 9.606 1.00 57.01 O ATOM 324 CB LEU A 554 29.885 56.929 11.598 1.00 56.36 C ATOM 325 CG LEU A 554 31.263 57.419 12.087 1.00 58.06 C ATOM 326 CD1 LEU A 554 31.165 58.197 13.400 1.00 58.82 C ATOM 327 CD2 LEU A 554 32.241 56.243 12.256 1.00 57.33 C ATOM 0 H LEU A 554 28.188 58.481 12.753 1.00 54.94 H new ATOM 0 HA LEU A 554 29.316 58.438 10.303 1.00 56.28 H new ATOM 0 HB2 LEU A 554 29.450 56.502 12.352 1.00 56.36 H new ATOM 0 HB3 LEU A 554 30.046 56.239 10.935 1.00 56.36 H new ATOM 0 HG LEU A 554 31.601 58.020 11.404 1.00 58.06 H new ATOM 0 HD11 LEU A 554 32.050 58.486 13.672 1.00 58.82 H new ATOM 0 HD12 LEU A 554 30.596 58.973 13.275 1.00 58.82 H new ATOM 0 HD13 LEU A 554 30.787 57.626 14.087 1.00 58.82 H new ATOM 0 HD21 LEU A 554 33.098 56.577 12.564 1.00 57.33 H new ATOM 0 HD22 LEU A 554 31.886 55.617 12.907 1.00 57.33 H new ATOM 0 HD23 LEU A 554 32.356 55.793 11.405 1.00 57.33 H new ATOM 328 N GLY A 555 26.462 57.555 10.570 1.00 56.58 N ATOM 329 CA GLY A 555 25.288 56.907 9.956 1.00 56.25 C ATOM 330 C GLY A 555 24.761 55.682 10.681 1.00 56.51 C ATOM 331 O GLY A 555 23.676 55.199 10.368 1.00 56.78 O ATOM 0 H GLY A 555 26.270 58.210 11.094 1.00 56.58 H new ATOM 0 HA2 GLY A 555 24.573 57.560 9.896 1.00 56.25 H new ATOM 0 HA3 GLY A 555 25.517 56.652 9.048 1.00 56.25 H new ATOM 332 N SER A 556 25.505 55.200 11.677 1.00 56.25 N ATOM 333 CA SER A 556 25.215 53.919 12.322 1.00 55.97 C ATOM 334 C SER A 556 25.010 53.991 13.849 1.00 55.48 C ATOM 335 O SER A 556 25.424 54.952 14.485 1.00 55.39 O ATOM 336 CB SER A 556 26.354 52.938 12.013 1.00 56.10 C ATOM 337 OG SER A 556 26.163 52.308 10.762 1.00 56.74 O ATOM 0 H SER A 556 26.192 55.607 11.997 1.00 56.25 H new ATOM 0 HA SER A 556 24.367 53.622 11.957 1.00 55.97 H new ATOM 0 HB2 SER A 556 27.201 53.411 12.013 1.00 56.10 H new ATOM 0 HB3 SER A 556 26.404 52.267 12.711 1.00 56.10 H new ATOM 0 HG SER A 556 26.900 52.247 10.363 1.00 56.74 H new ATOM 338 N TRP A 557 24.357 52.973 14.419 1.00 54.70 N ATOM 339 CA TRP A 557 24.357 52.757 15.870 1.00 54.02 C ATOM 340 C TRP A 557 24.841 51.349 16.179 1.00 53.50 C ATOM 341 O TRP A 557 24.717 50.447 15.357 1.00 53.49 O ATOM 342 CB TRP A 557 22.960 52.927 16.478 1.00 54.05 C ATOM 343 CG TRP A 557 22.380 54.311 16.438 1.00 53.89 C ATOM 344 CD1 TRP A 557 23.051 55.482 16.234 1.00 54.27 C ATOM 345 CD2 TRP A 557 21.011 54.673 16.687 1.00 54.18 C ATOM 346 NE1 TRP A 557 22.179 56.550 16.297 1.00 55.05 N ATOM 347 CE2 TRP A 557 20.922 56.082 16.577 1.00 54.49 C ATOM 348 CE3 TRP A 557 19.850 53.943 16.988 1.00 53.06 C ATOM 349 CZ2 TRP A 557 19.717 56.776 16.749 1.00 53.50 C ATOM 350 CZ3 TRP A 557 18.655 54.630 17.155 1.00 53.28 C ATOM 351 CH2 TRP A 557 18.600 56.036 17.036 1.00 54.28 C ATOM 0 H TRP A 557 23.904 52.391 13.977 1.00 54.70 H new ATOM 0 HA TRP A 557 24.947 53.422 16.258 1.00 54.02 H new ATOM 0 HB2 TRP A 557 22.352 52.329 16.016 1.00 54.05 H new ATOM 0 HB3 TRP A 557 22.994 52.638 17.403 1.00 54.05 H new ATOM 0 HD1 TRP A 557 23.965 55.550 16.075 1.00 54.27 H new ATOM 0 HE1 TRP A 557 22.390 57.375 16.180 1.00 55.05 H new ATOM 0 HE3 TRP A 557 19.881 53.017 17.074 1.00 53.06 H new ATOM 0 HZ2 TRP A 557 19.677 57.702 16.671 1.00 53.50 H new ATOM 0 HZ3 TRP A 557 17.878 54.157 17.348 1.00 53.28 H new ATOM 0 HH2 TRP A 557 17.786 56.470 17.155 1.00 54.28 H new ATOM 352 N LEU A 558 25.385 51.168 17.374 1.00 53.21 N ATOM 353 CA LEU A 558 25.739 49.832 17.872 1.00 52.74 C ATOM 354 C LEU A 558 24.552 49.266 18.628 1.00 52.43 C ATOM 355 O LEU A 558 24.081 49.850 19.603 1.00 51.78 O ATOM 356 CB LEU A 558 26.941 49.888 18.812 1.00 52.30 C ATOM 357 CG LEU A 558 28.101 48.890 18.710 1.00 52.23 C ATOM 358 CD1 LEU A 558 28.786 48.820 20.080 1.00 52.87 C ATOM 359 CD2 LEU A 558 27.754 47.499 18.215 1.00 48.58 C ATOM 0 H LEU A 558 25.561 51.808 17.921 1.00 53.21 H new ATOM 0 HA LEU A 558 25.970 49.272 17.114 1.00 52.74 H new ATOM 0 HB2 LEU A 558 27.326 50.774 18.721 1.00 52.30 H new ATOM 0 HB3 LEU A 558 26.593 49.821 19.715 1.00 52.30 H new ATOM 0 HG LEU A 558 28.689 49.231 18.018 1.00 52.23 H new ATOM 0 HD11 LEU A 558 29.525 48.193 20.041 1.00 52.87 H new ATOM 0 HD12 LEU A 558 29.120 49.698 20.320 1.00 52.87 H new ATOM 0 HD13 LEU A 558 28.147 48.524 20.747 1.00 52.87 H new ATOM 0 HD21 LEU A 558 28.557 46.955 18.190 1.00 48.58 H new ATOM 0 HD22 LEU A 558 27.108 47.094 18.814 1.00 48.58 H new ATOM 0 HD23 LEU A 558 27.376 47.558 17.324 1.00 48.58 H new ATOM 360 N ALA A 559 24.066 48.127 18.162 1.00 52.89 N ATOM 361 CA ALA A 559 22.866 47.526 18.735 1.00 53.14 C ATOM 362 C ALA A 559 23.121 46.079 19.050 1.00 52.97 C ATOM 363 O ALA A 559 24.028 45.470 18.486 1.00 53.46 O ATOM 364 CB ALA A 559 21.688 47.657 17.786 1.00 53.04 C ATOM 0 H ALA A 559 24.414 47.683 17.513 1.00 52.89 H new ATOM 0 HA ALA A 559 22.647 47.997 19.554 1.00 53.14 H new ATOM 0 HB1 ALA A 559 20.903 47.252 18.186 1.00 53.04 H new ATOM 0 HB2 ALA A 559 21.514 48.596 17.613 1.00 53.04 H new ATOM 0 HB3 ALA A 559 21.893 47.208 16.951 1.00 53.04 H new ATOM 365 N ILE A 560 22.337 45.555 19.984 1.00 52.88 N ATOM 366 CA ILE A 560 22.314 44.134 20.286 1.00 52.28 C ATOM 367 C ILE A 560 20.913 43.604 20.027 1.00 51.93 C ATOM 368 O ILE A 560 19.942 44.166 20.521 1.00 51.83 O ATOM 369 CB ILE A 560 22.757 43.866 21.738 1.00 52.45 C ATOM 370 CG1 ILE A 560 24.220 44.294 21.912 1.00 51.80 C ATOM 371 CG2 ILE A 560 22.560 42.378 22.086 1.00 52.76 C ATOM 372 CD1 ILE A 560 24.751 44.283 23.341 1.00 51.85 C ATOM 0 H ILE A 560 21.798 46.022 20.465 1.00 52.88 H new ATOM 0 HA ILE A 560 22.944 43.670 19.712 1.00 52.28 H new ATOM 0 HB ILE A 560 22.211 44.386 22.349 1.00 52.45 H new ATOM 0 HG12 ILE A 560 24.776 43.709 21.374 1.00 51.80 H new ATOM 0 HG13 ILE A 560 24.322 45.190 21.554 1.00 51.80 H new ATOM 0 HG21 ILE A 560 22.841 42.219 23.001 1.00 52.76 H new ATOM 0 HG22 ILE A 560 21.623 42.145 21.991 1.00 52.76 H new ATOM 0 HG23 ILE A 560 23.091 41.832 21.486 1.00 52.76 H new ATOM 0 HD11 ILE A 560 25.678 44.567 23.344 1.00 51.85 H new ATOM 0 HD12 ILE A 560 24.226 44.889 23.886 1.00 51.85 H new ATOM 0 HD13 ILE A 560 24.687 43.385 23.703 1.00 51.85 H new ATOM 373 N ARG A 561 20.814 42.545 19.230 1.00 52.12 N ATOM 374 CA ARG A 561 19.526 41.889 18.969 1.00 52.93 C ATOM 375 C ARG A 561 19.038 41.159 20.221 1.00 53.55 C ATOM 376 O ARG A 561 19.796 40.424 20.850 1.00 53.75 O ATOM 377 CB ARG A 561 19.619 40.907 17.792 1.00 52.64 C ATOM 378 CG ARG A 561 18.248 40.418 17.275 1.00 52.57 C ATOM 379 CD ARG A 561 18.324 39.177 16.322 1.00 52.19 C ATOM 380 NE ARG A 561 19.342 39.304 15.269 1.00 50.89 N ATOM 381 CZ ARG A 561 19.240 40.064 14.177 1.00 49.87 C ATOM 382 NH1 ARG A 561 18.153 40.797 13.942 1.00 49.18 N ATOM 383 NH2 ARG A 561 20.242 40.090 13.309 1.00 49.02 N ATOM 0 H ARG A 561 21.483 42.185 18.826 1.00 52.12 H new ATOM 0 HA ARG A 561 18.888 42.580 18.732 1.00 52.93 H new ATOM 0 HB2 ARG A 561 20.096 41.334 17.063 1.00 52.64 H new ATOM 0 HB3 ARG A 561 20.145 40.139 18.064 1.00 52.64 H new ATOM 0 HG2 ARG A 561 17.688 40.195 18.035 1.00 52.57 H new ATOM 0 HG3 ARG A 561 17.812 41.147 16.806 1.00 52.57 H new ATOM 0 HD2 ARG A 561 18.512 38.385 16.849 1.00 52.19 H new ATOM 0 HD3 ARG A 561 17.457 39.043 15.908 1.00 52.19 H new ATOM 0 HE ARG A 561 20.066 38.849 15.365 1.00 50.89 H new ATOM 0 HH11 ARG A 561 17.499 40.787 14.500 1.00 49.18 H new ATOM 0 HH12 ARG A 561 18.106 41.281 13.232 1.00 49.18 H new ATOM 0 HH21 ARG A 561 20.948 39.620 13.453 1.00 49.02 H new ATOM 0 HH22 ARG A 561 20.186 40.577 12.602 1.00 49.02 H new ATOM 384 N ILE A 562 17.782 41.381 20.587 1.00 54.56 N ATOM 385 CA ILE A 562 17.172 40.674 21.724 1.00 55.64 C ATOM 386 C ILE A 562 16.426 39.445 21.219 1.00 56.28 C ATOM 387 O ILE A 562 15.644 39.527 20.277 1.00 56.64 O ATOM 388 CB ILE A 562 16.241 41.608 22.556 1.00 55.67 C ATOM 389 CG1 ILE A 562 17.014 42.837 23.093 1.00 55.37 C ATOM 390 CG2 ILE A 562 15.569 40.856 23.681 1.00 55.91 C ATOM 391 CD1 ILE A 562 18.338 42.536 23.802 1.00 53.93 C ATOM 0 H ILE A 562 17.258 41.938 20.193 1.00 54.56 H new ATOM 0 HA ILE A 562 17.878 40.387 22.324 1.00 55.64 H new ATOM 0 HB ILE A 562 15.546 41.931 21.961 1.00 55.67 H new ATOM 0 HG12 ILE A 562 17.193 43.435 22.350 1.00 55.37 H new ATOM 0 HG13 ILE A 562 16.438 43.316 23.710 1.00 55.37 H new ATOM 0 HG21 ILE A 562 14.998 41.461 24.179 1.00 55.91 H new ATOM 0 HG22 ILE A 562 15.033 40.135 23.314 1.00 55.91 H new ATOM 0 HG23 ILE A 562 16.244 40.488 24.273 1.00 55.91 H new ATOM 0 HD11 ILE A 562 18.742 43.366 24.099 1.00 53.93 H new ATOM 0 HD12 ILE A 562 18.172 41.965 24.568 1.00 53.93 H new ATOM 0 HD13 ILE A 562 18.939 42.086 23.188 1.00 53.93 H new ATOM 392 N GLY A 563 16.691 38.299 21.824 1.00 57.21 N ATOM 393 CA GLY A 563 16.094 37.054 21.359 1.00 58.38 C ATOM 394 C GLY A 563 14.819 36.736 22.095 1.00 59.14 C ATOM 395 O GLY A 563 14.371 37.518 22.941 1.00 59.25 O ATOM 0 H GLY A 563 17.212 38.218 22.504 1.00 57.21 H new ATOM 0 HA2 GLY A 563 15.911 37.118 20.408 1.00 58.38 H new ATOM 0 HA3 GLY A 563 16.726 36.328 21.478 1.00 58.38 H new ATOM 396 N LYS A 564 14.230 35.583 21.780 1.00 59.96 N ATOM 397 CA LYS A 564 13.064 35.124 22.515 1.00 60.65 C ATOM 398 C LYS A 564 13.511 34.850 23.951 1.00 61.41 C ATOM 399 O LYS A 564 14.677 34.517 24.200 1.00 61.36 O ATOM 400 CB LYS A 564 12.390 33.919 21.837 1.00 60.67 C ATOM 401 CG LYS A 564 12.596 32.561 22.497 1.00 60.48 C ATOM 402 CD LYS A 564 11.869 31.464 21.720 1.00 60.13 C ATOM 403 CE LYS A 564 11.502 30.298 22.624 1.00 59.42 C ATOM 404 NZ LYS A 564 10.567 29.342 21.953 1.00 58.76 N ATOM 0 H LYS A 564 14.490 35.059 21.149 1.00 59.96 H new ATOM 0 HA LYS A 564 12.373 35.805 22.523 1.00 60.65 H new ATOM 0 HB2 LYS A 564 11.437 34.092 21.790 1.00 60.67 H new ATOM 0 HB3 LYS A 564 12.714 33.865 20.924 1.00 60.67 H new ATOM 0 HG2 LYS A 564 13.544 32.358 22.541 1.00 60.48 H new ATOM 0 HG3 LYS A 564 12.269 32.587 23.410 1.00 60.48 H new ATOM 0 HD2 LYS A 564 11.066 31.829 21.317 1.00 60.13 H new ATOM 0 HD3 LYS A 564 12.433 31.150 20.996 1.00 60.13 H new ATOM 0 HE2 LYS A 564 12.309 29.829 22.889 1.00 59.42 H new ATOM 0 HE3 LYS A 564 11.091 30.635 23.435 1.00 59.42 H new ATOM 0 HZ1 LYS A 564 10.375 28.675 22.510 1.00 58.76 H new ATOM 0 HZ2 LYS A 564 9.818 29.767 21.729 1.00 58.76 H new ATOM 0 HZ3 LYS A 564 10.952 29.015 21.220 1.00 58.76 H new ATOM 405 N ASN A 565 12.584 35.040 24.886 1.00 62.40 N ATOM 406 CA ASN A 565 12.898 35.116 26.311 1.00 63.30 C ATOM 407 C ASN A 565 13.965 36.187 26.579 1.00 63.59 C ATOM 408 O ASN A 565 14.807 36.049 27.472 1.00 63.80 O ATOM 409 CB ASN A 565 13.303 33.748 26.869 1.00 63.52 C ATOM 410 CG ASN A 565 12.648 33.447 28.204 1.00 64.61 C ATOM 411 OD1 ASN A 565 11.852 32.512 28.318 1.00 65.80 O ATOM 412 ND2 ASN A 565 12.974 34.239 29.224 1.00 65.31 N ATOM 0 H ASN A 565 11.747 35.129 24.710 1.00 62.40 H new ATOM 0 HA ASN A 565 12.094 35.383 26.783 1.00 63.30 H new ATOM 0 HB2 ASN A 565 13.062 33.058 26.231 1.00 63.52 H new ATOM 0 HB3 ASN A 565 14.267 33.716 26.971 1.00 63.52 H new ATOM 0 HD21 ASN A 565 12.625 34.107 29.999 1.00 65.31 H new ATOM 0 HD22 ASN A 565 13.533 34.882 29.108 1.00 65.31 H new ATOM 413 N HIS A 566 13.923 37.234 25.753 1.00 63.86 N ATOM 414 CA HIS A 566 14.647 38.501 25.959 1.00 63.84 C ATOM 415 C HIS A 566 16.160 38.401 26.201 1.00 63.50 C ATOM 416 O HIS A 566 16.752 39.266 26.857 1.00 63.62 O ATOM 417 CB HIS A 566 13.963 39.329 27.060 1.00 64.02 C ATOM 418 CG HIS A 566 12.468 39.267 27.013 1.00 64.57 C ATOM 419 ND1 HIS A 566 11.733 39.768 25.959 1.00 65.19 N ATOM 420 CD2 HIS A 566 11.572 38.742 27.882 1.00 64.99 C ATOM 421 CE1 HIS A 566 10.448 39.562 26.186 1.00 65.29 C ATOM 422 NE2 HIS A 566 10.323 38.944 27.347 1.00 65.36 N ATOM 0 H HIS A 566 13.457 37.230 25.030 1.00 63.86 H new ATOM 0 HA HIS A 566 14.589 38.952 25.102 1.00 63.84 H new ATOM 0 HB2 HIS A 566 14.265 39.014 27.926 1.00 64.02 H new ATOM 0 HB3 HIS A 566 14.244 40.254 26.980 1.00 64.02 H new ATOM 0 HD2 HIS A 566 11.766 38.323 28.689 1.00 64.99 H new ATOM 0 HE1 HIS A 566 9.750 39.810 25.624 1.00 65.29 H new ATOM 0 HE2 HIS A 566 9.580 38.707 27.709 1.00 65.36 H new ATOM 423 N LYS A 567 16.789 37.369 25.647 1.00 63.05 N ATOM 424 CA LYS A 567 18.231 37.198 25.818 1.00 62.65 C ATOM 425 C LYS A 567 19.007 37.878 24.683 1.00 61.96 C ATOM 426 O LYS A 567 18.499 38.013 23.570 1.00 62.08 O ATOM 427 CB LYS A 567 18.589 35.709 26.037 1.00 62.81 C ATOM 428 CG LYS A 567 18.994 34.906 24.804 1.00 63.29 C ATOM 429 CD LYS A 567 20.458 34.467 24.897 1.00 63.07 C ATOM 430 CE LYS A 567 20.745 33.231 24.051 1.00 62.13 C ATOM 431 NZ LYS A 567 19.810 32.107 24.346 1.00 60.04 N ATOM 0 H LYS A 567 16.406 36.762 25.173 1.00 63.05 H new ATOM 0 HA LYS A 567 18.513 37.653 26.627 1.00 62.65 H new ATOM 0 HB2 LYS A 567 19.316 35.665 26.678 1.00 62.81 H new ATOM 0 HB3 LYS A 567 17.825 35.272 26.444 1.00 62.81 H new ATOM 0 HG2 LYS A 567 18.423 34.126 24.719 1.00 63.29 H new ATOM 0 HG3 LYS A 567 18.863 35.442 24.006 1.00 63.29 H new ATOM 0 HD2 LYS A 567 21.031 35.195 24.608 1.00 63.07 H new ATOM 0 HD3 LYS A 567 20.680 34.282 25.823 1.00 63.07 H new ATOM 0 HE2 LYS A 567 20.680 33.464 23.112 1.00 62.13 H new ATOM 0 HE3 LYS A 567 21.657 32.939 24.209 1.00 62.13 H new ATOM 0 HZ1 LYS A 567 20.163 31.343 24.056 1.00 60.04 H new ATOM 0 HZ2 LYS A 567 19.675 32.056 25.224 1.00 60.04 H new ATOM 0 HZ3 LYS A 567 19.034 32.250 23.935 1.00 60.04 H new ATOM 432 N GLU A 568 20.217 38.339 24.990 1.00 61.12 N ATOM 433 CA GLU A 568 21.033 39.123 24.056 1.00 60.15 C ATOM 434 C GLU A 568 21.788 38.234 23.065 1.00 59.71 C ATOM 435 O GLU A 568 22.767 37.586 23.422 1.00 59.37 O ATOM 436 CB GLU A 568 22.021 40.002 24.825 1.00 59.84 C ATOM 437 CG GLU A 568 21.411 41.118 25.684 1.00 60.03 C ATOM 438 CD GLU A 568 22.475 42.020 26.330 1.00 61.02 C ATOM 439 OE1 GLU A 568 23.529 41.512 26.779 1.00 61.86 O ATOM 440 OE2 GLU A 568 22.268 43.252 26.381 1.00 63.60 O ATOM 0 H GLU A 568 20.593 38.206 25.752 1.00 61.12 H new ATOM 0 HA GLU A 568 20.428 39.684 23.546 1.00 60.15 H new ATOM 0 HB2 GLU A 568 22.553 39.431 25.401 1.00 59.84 H new ATOM 0 HB3 GLU A 568 22.629 40.407 24.187 1.00 59.84 H new ATOM 0 HG2 GLU A 568 20.824 41.660 25.134 1.00 60.03 H new ATOM 0 HG3 GLU A 568 20.863 40.722 26.379 1.00 60.03 H new ATOM 441 N VAL A 569 21.350 38.223 21.811 1.00 59.52 N ATOM 442 CA VAL A 569 21.834 37.228 20.854 1.00 59.74 C ATOM 443 C VAL A 569 23.037 37.654 20.022 1.00 59.94 C ATOM 444 O VAL A 569 24.087 37.016 20.051 1.00 59.81 O ATOM 445 CB VAL A 569 20.702 36.760 19.916 1.00 59.78 C ATOM 446 CG1 VAL A 569 21.260 35.876 18.802 1.00 59.73 C ATOM 447 CG2 VAL A 569 19.630 36.012 20.714 1.00 59.54 C ATOM 0 H VAL A 569 20.776 38.779 21.493 1.00 59.52 H new ATOM 0 HA VAL A 569 22.141 36.496 21.412 1.00 59.74 H new ATOM 0 HB VAL A 569 20.295 37.540 19.508 1.00 59.78 H new ATOM 0 HG11 VAL A 569 20.537 35.591 18.222 1.00 59.73 H new ATOM 0 HG12 VAL A 569 21.910 36.378 18.285 1.00 59.73 H new ATOM 0 HG13 VAL A 569 21.689 35.097 19.191 1.00 59.73 H new ATOM 0 HG21 VAL A 569 18.924 35.722 20.115 1.00 59.54 H new ATOM 0 HG22 VAL A 569 20.027 35.238 21.143 1.00 59.54 H new ATOM 0 HG23 VAL A 569 19.259 36.601 21.390 1.00 59.54 H new ATOM 448 N GLU A 570 22.865 38.732 19.270 1.00 60.40 N ATOM 449 CA GLU A 570 23.842 39.156 18.303 1.00 60.79 C ATOM 450 C GLU A 570 24.148 40.636 18.503 1.00 60.63 C ATOM 451 O GLU A 570 23.252 41.411 18.849 1.00 61.03 O ATOM 452 CB GLU A 570 23.306 38.896 16.899 1.00 60.45 C ATOM 453 CG GLU A 570 24.410 38.758 15.868 1.00 62.25 C ATOM 454 CD GLU A 570 23.915 38.393 14.473 1.00 62.22 C ATOM 455 OE1 GLU A 570 24.759 38.433 13.541 1.00 63.86 O ATOM 456 OE2 GLU A 570 22.709 38.073 14.309 1.00 62.66 O ATOM 0 H GLU A 570 22.170 39.237 19.313 1.00 60.40 H new ATOM 0 HA GLU A 570 24.664 38.655 18.419 1.00 60.79 H new ATOM 0 HB2 GLU A 570 22.772 38.087 16.906 1.00 60.45 H new ATOM 0 HB3 GLU A 570 22.717 39.623 16.642 1.00 60.45 H new ATOM 0 HG2 GLU A 570 24.900 39.594 15.819 1.00 62.25 H new ATOM 0 HG3 GLU A 570 25.036 38.080 16.167 1.00 62.25 H new ATOM 457 N ARG A 571 25.410 41.018 18.304 1.00 60.27 N ATOM 458 CA ARG A 571 25.829 42.418 18.392 1.00 59.75 C ATOM 459 C ARG A 571 26.403 42.902 17.059 1.00 59.65 C ATOM 460 O ARG A 571 27.200 42.207 16.424 1.00 59.39 O ATOM 461 CB ARG A 571 26.864 42.632 19.513 1.00 59.94 C ATOM 462 CG ARG A 571 27.091 44.117 19.881 1.00 58.69 C ATOM 463 CD ARG A 571 28.453 44.391 20.449 1.00 57.45 C ATOM 464 NE ARG A 571 28.568 44.061 21.865 1.00 58.83 N ATOM 465 CZ ARG A 571 29.404 43.156 22.375 1.00 59.56 C ATOM 466 NH1 ARG A 571 30.217 42.461 21.591 1.00 59.28 N ATOM 467 NH2 ARG A 571 29.428 42.942 23.684 1.00 59.51 N ATOM 0 H ARG A 571 26.047 40.473 18.114 1.00 60.27 H new ATOM 0 HA ARG A 571 25.038 42.939 18.604 1.00 59.75 H new ATOM 0 HB2 ARG A 571 26.574 42.152 20.305 1.00 59.94 H new ATOM 0 HB3 ARG A 571 27.709 42.243 19.239 1.00 59.94 H new ATOM 0 HG2 ARG A 571 26.963 44.662 19.089 1.00 58.69 H new ATOM 0 HG3 ARG A 571 26.419 44.390 20.525 1.00 58.69 H new ATOM 0 HD2 ARG A 571 29.112 43.883 19.951 1.00 57.45 H new ATOM 0 HD3 ARG A 571 28.665 45.329 20.324 1.00 57.45 H new ATOM 0 HE ARG A 571 28.057 44.483 22.413 1.00 58.83 H new ATOM 0 HH11 ARG A 571 30.210 42.591 20.741 1.00 59.28 H new ATOM 0 HH12 ARG A 571 30.751 41.880 21.933 1.00 59.28 H new ATOM 0 HH21 ARG A 571 28.905 43.387 24.202 1.00 59.51 H new ATOM 0 HH22 ARG A 571 29.967 42.359 24.015 1.00 59.51 H new ATOM 468 N GLY A 572 25.991 44.101 16.652 1.00 59.49 N ATOM 469 CA GLY A 572 26.450 44.700 15.414 1.00 59.58 C ATOM 470 C GLY A 572 25.913 46.102 15.227 1.00 59.82 C ATOM 471 O GLY A 572 25.171 46.611 16.086 1.00 59.69 O ATOM 0 H GLY A 572 25.435 44.588 17.092 1.00 59.49 H new ATOM 0 HA2 GLY A 572 27.420 44.723 15.407 1.00 59.58 H new ATOM 0 HA3 GLY A 572 26.174 44.147 14.667 1.00 59.58 H new ATOM 472 N ILE A 573 26.302 46.726 14.110 1.00 59.47 N ATOM 473 CA ILE A 573 25.809 48.057 13.762 1.00 59.40 C ATOM 474 C ILE A 573 24.522 48.018 12.939 1.00 59.69 C ATOM 475 O ILE A 573 24.344 47.164 12.074 1.00 59.85 O ATOM 476 CB ILE A 573 26.871 48.928 13.037 1.00 59.27 C ATOM 477 CG1 ILE A 573 27.262 48.329 11.680 1.00 58.98 C ATOM 478 CG2 ILE A 573 28.096 49.126 13.921 1.00 58.76 C ATOM 479 CD1 ILE A 573 27.589 49.380 10.595 1.00 58.20 C ATOM 0 H ILE A 573 26.853 46.392 13.541 1.00 59.47 H new ATOM 0 HA ILE A 573 25.610 48.474 14.615 1.00 59.40 H new ATOM 0 HB ILE A 573 26.474 49.796 12.865 1.00 59.27 H new ATOM 0 HG12 ILE A 573 28.033 47.754 11.802 1.00 58.98 H new ATOM 0 HG13 ILE A 573 26.537 47.768 11.364 1.00 58.98 H new ATOM 0 HG21 ILE A 573 28.748 49.671 13.453 1.00 58.76 H new ATOM 0 HG22 ILE A 573 27.834 49.570 14.743 1.00 58.76 H new ATOM 0 HG23 ILE A 573 28.487 48.263 14.130 1.00 58.76 H new ATOM 0 HD11 ILE A 573 27.826 48.930 9.769 1.00 58.20 H new ATOM 0 HD12 ILE A 573 26.813 49.943 10.445 1.00 58.20 H new ATOM 0 HD13 ILE A 573 28.333 49.928 10.889 1.00 58.20 H new ATOM 480 N ILE A 574 23.625 48.947 13.234 1.00 60.04 N ATOM 481 CA ILE A 574 22.394 49.131 12.476 1.00 60.66 C ATOM 482 C ILE A 574 22.344 50.590 11.989 1.00 61.30 C ATOM 483 O ILE A 574 23.209 51.399 12.386 1.00 62.07 O ATOM 484 CB ILE A 574 21.168 48.811 13.346 1.00 60.77 C ATOM 485 CG1 ILE A 574 21.261 49.540 14.692 1.00 61.16 C ATOM 486 CG2 ILE A 574 21.047 47.313 13.549 1.00 60.68 C ATOM 487 CD1 ILE A 574 19.931 49.850 15.309 1.00 62.29 C ATOM 0 H ILE A 574 23.714 49.497 13.889 1.00 60.04 H new ATOM 0 HA ILE A 574 22.380 48.526 11.718 1.00 60.66 H new ATOM 0 HB ILE A 574 20.371 49.123 12.890 1.00 60.77 H new ATOM 0 HG12 ILE A 574 21.775 48.996 15.309 1.00 61.16 H new ATOM 0 HG13 ILE A 574 21.751 50.368 14.568 1.00 61.16 H new ATOM 0 HG21 ILE A 574 20.271 47.122 14.099 1.00 60.68 H new ATOM 0 HG22 ILE A 574 20.948 46.877 12.688 1.00 60.68 H new ATOM 0 HG23 ILE A 574 21.844 46.981 13.990 1.00 60.68 H new ATOM 0 HD11 ILE A 574 20.065 50.309 16.153 1.00 62.29 H new ATOM 0 HD12 ILE A 574 19.421 50.418 14.710 1.00 62.29 H new ATOM 0 HD13 ILE A 574 19.445 49.025 15.463 1.00 62.29 H new ATOM 488 N PRO A 575 21.365 50.945 11.125 1.00 61.29 N ATOM 489 CA PRO A 575 21.280 52.355 10.708 1.00 61.49 C ATOM 490 C PRO A 575 20.903 53.271 11.867 1.00 61.74 C ATOM 491 O PRO A 575 20.278 52.816 12.818 1.00 62.11 O ATOM 492 CB PRO A 575 20.162 52.343 9.655 1.00 61.55 C ATOM 493 CG PRO A 575 20.064 50.898 9.207 1.00 61.29 C ATOM 494 CD PRO A 575 20.338 50.123 10.458 1.00 61.18 C ATOM 0 HA PRO A 575 22.128 52.692 10.378 1.00 61.49 H new ATOM 0 HB2 PRO A 575 19.323 52.653 10.030 1.00 61.55 H new ATOM 0 HB3 PRO A 575 20.373 52.928 8.911 1.00 61.55 H new ATOM 0 HG2 PRO A 575 19.187 50.695 8.846 1.00 61.29 H new ATOM 0 HG3 PRO A 575 20.710 50.695 8.513 1.00 61.29 H new ATOM 0 HD2 PRO A 575 19.542 50.026 11.004 1.00 61.18 H new ATOM 0 HD3 PRO A 575 20.660 49.229 10.265 1.00 61.18 H new ATOM 495 N ASN A 576 21.297 54.540 11.810 1.00 62.00 N ATOM 496 CA ASN A 576 20.877 55.502 12.831 1.00 62.30 C ATOM 497 C ASN A 576 19.435 55.929 12.551 1.00 62.25 C ATOM 498 O ASN A 576 18.840 55.452 11.584 1.00 62.30 O ATOM 499 CB ASN A 576 21.843 56.703 12.917 1.00 62.28 C ATOM 500 CG ASN A 576 21.300 57.957 12.237 1.00 63.00 C ATOM 501 OD1 ASN A 576 21.138 59.002 12.875 1.00 62.64 O ATOM 502 ND2 ASN A 576 21.003 57.851 10.943 1.00 63.77 N ATOM 0 H ASN A 576 21.803 54.864 11.195 1.00 62.00 H new ATOM 0 HA ASN A 576 20.909 55.079 13.703 1.00 62.30 H new ATOM 0 HB2 ASN A 576 22.024 56.900 13.849 1.00 62.28 H new ATOM 0 HB3 ASN A 576 22.689 56.461 12.509 1.00 62.28 H new ATOM 0 HD21 ASN A 576 20.685 58.527 10.518 1.00 63.77 H new ATOM 0 HD22 ASN A 576 21.130 57.106 10.532 1.00 63.77 H new ATOM 503 N LYS A 577 18.884 56.817 13.382 1.00 62.16 N ATOM 504 CA LYS A 577 17.490 57.245 13.262 1.00 62.19 C ATOM 505 C LYS A 577 17.155 57.891 11.908 1.00 62.18 C ATOM 506 O LYS A 577 16.127 57.575 11.301 1.00 62.20 O ATOM 507 CB LYS A 577 17.118 58.186 14.411 1.00 62.46 C ATOM 508 CG LYS A 577 15.618 58.424 14.559 1.00 63.12 C ATOM 509 CD LYS A 577 15.290 59.119 15.872 1.00 65.24 C ATOM 510 CE LYS A 577 13.849 58.847 16.304 1.00 66.23 C ATOM 511 NZ LYS A 577 13.482 59.640 17.515 1.00 66.80 N ATOM 0 H LYS A 577 19.309 57.188 14.031 1.00 62.16 H new ATOM 0 HA LYS A 577 16.955 56.438 13.315 1.00 62.19 H new ATOM 0 HB2 LYS A 577 17.461 57.819 15.241 1.00 62.46 H new ATOM 0 HB3 LYS A 577 17.559 59.039 14.274 1.00 62.46 H new ATOM 0 HG2 LYS A 577 15.300 58.963 13.818 1.00 63.12 H new ATOM 0 HG3 LYS A 577 15.149 57.576 14.514 1.00 63.12 H new ATOM 0 HD2 LYS A 577 15.899 58.814 16.562 1.00 65.24 H new ATOM 0 HD3 LYS A 577 15.426 60.075 15.776 1.00 65.24 H new ATOM 0 HE2 LYS A 577 13.245 59.066 15.577 1.00 66.23 H new ATOM 0 HE3 LYS A 577 13.739 57.901 16.489 1.00 66.23 H new ATOM 0 HZ1 LYS A 577 12.640 59.462 17.743 1.00 66.80 H new ATOM 0 HZ2 LYS A 577 14.023 59.423 18.187 1.00 66.80 H new ATOM 0 HZ3 LYS A 577 13.563 60.508 17.337 1.00 66.80 H new ATOM 512 N ASN A 578 18.020 58.787 11.443 1.00 61.69 N ATOM 513 CA ASN A 578 17.809 59.462 10.173 1.00 61.69 C ATOM 514 C ASN A 578 17.744 58.487 9.003 1.00 61.66 C ATOM 515 O ASN A 578 16.781 58.488 8.225 1.00 61.34 O ATOM 516 CB ASN A 578 18.900 60.515 9.924 1.00 61.72 C ATOM 517 CG ASN A 578 18.655 61.811 10.677 1.00 61.46 C ATOM 518 OD1 ASN A 578 19.314 62.815 10.415 1.00 62.55 O ATOM 519 ND2 ASN A 578 17.711 61.800 11.611 1.00 61.26 N ATOM 0 H ASN A 578 18.740 59.018 11.853 1.00 61.69 H new ATOM 0 HA ASN A 578 16.948 59.905 10.232 1.00 61.69 H new ATOM 0 HB2 ASN A 578 19.760 60.151 10.187 1.00 61.72 H new ATOM 0 HB3 ASN A 578 18.950 60.703 8.974 1.00 61.72 H new ATOM 0 HD21 ASN A 578 17.541 62.514 12.059 1.00 61.26 H new ATOM 0 HD22 ASN A 578 17.269 61.079 11.768 1.00 61.26 H new ATOM 520 N ARG A 579 18.769 57.650 8.889 1.00 61.73 N ATOM 521 CA ARG A 579 18.809 56.650 7.833 1.00 62.00 C ATOM 522 C ARG A 579 17.689 55.610 7.982 1.00 62.13 C ATOM 523 O ARG A 579 17.135 55.161 6.979 1.00 62.09 O ATOM 524 CB ARG A 579 20.193 56.008 7.734 1.00 61.74 C ATOM 525 CG ARG A 579 21.292 57.000 7.313 1.00 63.03 C ATOM 526 CD ARG A 579 22.398 56.360 6.459 1.00 63.53 C ATOM 527 NE ARG A 579 23.018 55.231 7.149 1.00 63.83 N ATOM 528 CZ ARG A 579 22.739 53.949 6.925 1.00 62.61 C ATOM 529 NH1 ARG A 579 23.362 53.022 7.636 1.00 62.80 N ATOM 530 NH2 ARG A 579 21.853 53.590 6.003 1.00 61.19 N ATOM 0 H ARG A 579 19.451 57.646 9.413 1.00 61.73 H new ATOM 0 HA ARG A 579 18.644 57.105 6.992 1.00 62.00 H new ATOM 0 HB2 ARG A 579 20.426 55.621 8.593 1.00 61.74 H new ATOM 0 HB3 ARG A 579 20.160 55.280 7.094 1.00 61.74 H new ATOM 0 HG2 ARG A 579 20.888 57.727 6.815 1.00 63.03 H new ATOM 0 HG3 ARG A 579 21.690 57.388 8.108 1.00 63.03 H new ATOM 0 HD2 ARG A 579 22.025 56.060 5.615 1.00 63.53 H new ATOM 0 HD3 ARG A 579 23.073 57.024 6.251 1.00 63.53 H new ATOM 0 HE ARG A 579 23.610 55.409 7.747 1.00 63.83 H new ATOM 0 HH11 ARG A 579 23.937 53.252 8.232 1.00 62.80 H new ATOM 0 HH12 ARG A 579 23.191 52.190 7.502 1.00 62.80 H new ATOM 0 HH21 ARG A 579 21.448 54.190 5.539 1.00 61.19 H new ATOM 0 HH22 ARG A 579 21.684 52.757 5.870 1.00 61.19 H new ATOM 531 N ALA A 580 17.341 55.250 9.221 1.00 62.19 N ATOM 532 CA ALA A 580 16.200 54.362 9.457 1.00 62.76 C ATOM 533 C ALA A 580 14.910 54.953 8.881 1.00 62.97 C ATOM 534 O ALA A 580 14.261 54.319 8.051 1.00 62.96 O ATOM 535 CB ALA A 580 16.037 54.047 10.935 1.00 62.53 C ATOM 0 H ALA A 580 17.750 55.507 9.933 1.00 62.19 H new ATOM 0 HA ALA A 580 16.381 53.529 8.995 1.00 62.76 H new ATOM 0 HB1 ALA A 580 15.276 53.459 11.059 1.00 62.53 H new ATOM 0 HB2 ALA A 580 16.839 53.611 11.263 1.00 62.53 H new ATOM 0 HB3 ALA A 580 15.893 54.870 11.427 1.00 62.53 H new ATOM 536 N GLU A 581 14.566 56.170 9.312 1.00 63.41 N ATOM 537 CA GLU A 581 13.384 56.896 8.825 1.00 63.73 C ATOM 538 C GLU A 581 13.372 57.001 7.314 1.00 63.45 C ATOM 539 O GLU A 581 12.316 56.910 6.684 1.00 63.63 O ATOM 540 CB GLU A 581 13.311 58.299 9.435 1.00 63.89 C ATOM 541 CG GLU A 581 12.511 58.358 10.736 1.00 65.44 C ATOM 542 CD GLU A 581 12.916 59.510 11.660 1.00 66.95 C ATOM 543 OE1 GLU A 581 13.616 60.449 11.212 1.00 66.03 O ATOM 544 OE2 GLU A 581 12.527 59.463 12.852 1.00 68.13 O ATOM 0 H GLU A 581 15.017 56.603 9.902 1.00 63.41 H new ATOM 0 HA GLU A 581 12.607 56.386 9.103 1.00 63.73 H new ATOM 0 HB2 GLU A 581 14.212 58.618 9.603 1.00 63.89 H new ATOM 0 HB3 GLU A 581 12.911 58.904 8.790 1.00 63.89 H new ATOM 0 HG2 GLU A 581 11.569 58.442 10.523 1.00 65.44 H new ATOM 0 HG3 GLU A 581 12.621 57.520 11.211 1.00 65.44 H new ATOM 545 N GLN A 582 14.556 57.171 6.742 1.00 63.22 N ATOM 546 CA GLN A 582 14.721 57.281 5.294 1.00 63.12 C ATOM 547 C GLN A 582 14.516 55.920 4.584 1.00 62.78 C ATOM 548 O GLN A 582 13.823 55.852 3.566 1.00 62.86 O ATOM 549 CB GLN A 582 16.068 57.977 4.988 1.00 62.95 C ATOM 550 CG GLN A 582 16.832 57.545 3.749 1.00 63.20 C ATOM 551 CD GLN A 582 18.303 57.964 3.806 1.00 63.46 C ATOM 552 OE1 GLN A 582 18.641 59.129 3.592 1.00 63.42 O ATOM 553 NE2 GLN A 582 19.180 57.005 4.095 1.00 63.93 N ATOM 0 H GLN A 582 15.292 57.226 7.183 1.00 63.22 H new ATOM 0 HA GLN A 582 14.024 57.843 4.921 1.00 63.12 H new ATOM 0 HB2 GLN A 582 15.900 58.930 4.916 1.00 62.95 H new ATOM 0 HB3 GLN A 582 16.649 57.849 5.754 1.00 62.95 H new ATOM 0 HG2 GLN A 582 16.775 56.581 3.655 1.00 63.20 H new ATOM 0 HG3 GLN A 582 16.417 57.932 2.963 1.00 63.20 H new ATOM 0 HE21 GLN A 582 18.907 56.202 4.239 1.00 63.93 H new ATOM 0 HE22 GLN A 582 20.019 57.188 4.138 1.00 63.93 H new ATOM 554 N LEU A 583 15.075 54.845 5.148 1.00 62.40 N ATOM 555 CA LEU A 583 14.956 53.489 4.581 1.00 61.97 C ATOM 556 C LEU A 583 13.536 52.948 4.616 1.00 62.04 C ATOM 557 O LEU A 583 13.162 52.086 3.811 1.00 61.70 O ATOM 558 CB LEU A 583 15.860 52.517 5.331 1.00 61.77 C ATOM 559 CG LEU A 583 17.345 52.497 4.985 1.00 61.23 C ATOM 560 CD1 LEU A 583 18.164 52.133 6.206 1.00 60.79 C ATOM 561 CD2 LEU A 583 17.616 51.532 3.843 1.00 60.66 C ATOM 0 H LEU A 583 15.536 54.879 5.873 1.00 62.40 H new ATOM 0 HA LEU A 583 15.225 53.565 3.652 1.00 61.97 H new ATOM 0 HB2 LEU A 583 15.780 52.709 6.278 1.00 61.77 H new ATOM 0 HB3 LEU A 583 15.512 51.622 5.192 1.00 61.77 H new ATOM 0 HG LEU A 583 17.607 53.385 4.695 1.00 61.23 H new ATOM 0 HD11 LEU A 583 19.106 52.124 5.973 1.00 60.79 H new ATOM 0 HD12 LEU A 583 18.011 52.787 6.906 1.00 60.79 H new ATOM 0 HD13 LEU A 583 17.901 51.255 6.522 1.00 60.79 H new ATOM 0 HD21 LEU A 583 18.564 51.532 3.637 1.00 60.66 H new ATOM 0 HD22 LEU A 583 17.342 50.638 4.102 1.00 60.66 H new ATOM 0 HD23 LEU A 583 17.115 51.808 3.060 1.00 60.66 H new ATOM 562 N ALA A 584 12.761 53.457 5.567 1.00 62.24 N ATOM 563 CA ALA A 584 11.392 53.026 5.781 1.00 62.68 C ATOM 564 C ALA A 584 10.410 53.729 4.838 1.00 62.87 C ATOM 565 O ALA A 584 9.251 53.336 4.739 1.00 62.72 O ATOM 566 CB ALA A 584 11.005 53.256 7.238 1.00 62.60 C ATOM 0 H ALA A 584 13.022 54.070 6.111 1.00 62.24 H new ATOM 0 HA ALA A 584 11.341 52.078 5.580 1.00 62.68 H new ATOM 0 HB1 ALA A 584 10.090 52.967 7.379 1.00 62.60 H new ATOM 0 HB2 ALA A 584 11.597 52.747 7.814 1.00 62.60 H new ATOM 0 HB3 ALA A 584 11.082 54.200 7.448 1.00 62.60 H new ATOM 567 N SER A 585 10.886 54.762 4.149 1.00 63.36 N ATOM 568 CA SER A 585 10.052 55.551 3.244 1.00 63.93 C ATOM 569 C SER A 585 9.716 54.820 1.953 1.00 64.45 C ATOM 570 O SER A 585 8.738 55.154 1.296 1.00 64.29 O ATOM 571 CB SER A 585 10.744 56.866 2.891 1.00 63.73 C ATOM 572 OG SER A 585 11.045 57.613 4.050 1.00 63.61 O ATOM 0 H SER A 585 11.703 55.026 4.193 1.00 63.36 H new ATOM 0 HA SER A 585 9.223 55.716 3.720 1.00 63.93 H new ATOM 0 HB2 SER A 585 11.560 56.683 2.400 1.00 63.73 H new ATOM 0 HB3 SER A 585 10.173 57.388 2.306 1.00 63.73 H new ATOM 0 HG SER A 585 11.523 57.152 4.564 1.00 63.61 H new ATOM 573 N VAL A 586 10.521 53.819 1.605 1.00 65.35 N ATOM 574 CA VAL A 586 10.494 53.225 0.263 1.00 66.21 C ATOM 575 C VAL A 586 9.579 52.004 0.109 1.00 66.77 C ATOM 576 O VAL A 586 8.997 51.809 -0.957 1.00 67.19 O ATOM 577 CB VAL A 586 11.923 52.911 -0.255 1.00 66.18 C ATOM 578 CG1 VAL A 586 11.991 53.058 -1.774 1.00 66.37 C ATOM 579 CG2 VAL A 586 12.938 53.845 0.388 1.00 66.43 C ATOM 0 H VAL A 586 11.097 53.464 2.136 1.00 65.35 H new ATOM 0 HA VAL A 586 10.097 53.913 -0.293 1.00 66.21 H new ATOM 0 HB VAL A 586 12.133 51.995 -0.016 1.00 66.18 H new ATOM 0 HG11 VAL A 586 12.890 52.858 -2.079 1.00 66.37 H new ATOM 0 HG12 VAL A 586 11.366 52.442 -2.187 1.00 66.37 H new ATOM 0 HG13 VAL A 586 11.761 53.967 -2.022 1.00 66.37 H new ATOM 0 HG21 VAL A 586 13.825 53.637 0.055 1.00 66.43 H new ATOM 0 HG22 VAL A 586 12.717 54.764 0.168 1.00 66.43 H new ATOM 0 HG23 VAL A 586 12.919 53.730 1.351 1.00 66.43 H new ATOM 580 N GLN A 587 9.458 51.184 1.151 1.00 67.51 N ATOM 581 CA GLN A 587 8.504 50.068 1.137 1.00 68.12 C ATOM 582 C GLN A 587 7.145 50.512 1.664 1.00 68.70 C ATOM 583 O GLN A 587 7.051 51.223 2.664 1.00 68.55 O ATOM 584 CB GLN A 587 9.018 48.834 1.902 1.00 68.04 C ATOM 585 CG GLN A 587 9.669 49.105 3.262 1.00 67.83 C ATOM 586 CD GLN A 587 11.176 48.897 3.258 1.00 67.32 C ATOM 587 OE1 GLN A 587 11.725 48.200 4.122 1.00 66.17 O ATOM 588 NE2 GLN A 587 11.852 49.497 2.285 1.00 67.05 N ATOM 0 H GLN A 587 9.916 51.254 1.875 1.00 67.51 H new ATOM 0 HA GLN A 587 8.404 49.796 0.211 1.00 68.12 H new ATOM 0 HB2 GLN A 587 8.274 48.226 2.036 1.00 68.04 H new ATOM 0 HB3 GLN A 587 9.663 48.374 1.342 1.00 68.04 H new ATOM 0 HG2 GLN A 587 9.475 50.017 3.531 1.00 67.83 H new ATOM 0 HG3 GLN A 587 9.270 48.522 3.927 1.00 67.83 H new ATOM 0 HE21 GLN A 587 11.436 49.973 1.703 1.00 67.05 H new ATOM 0 HE22 GLN A 587 12.706 49.409 2.237 1.00 67.05 H new ATOM 589 N TYR A 588 6.092 50.080 0.978 1.00 69.59 N ATOM 590 CA TYR A 588 4.739 50.551 1.255 1.00 70.38 C ATOM 591 C TYR A 588 4.193 50.109 2.614 1.00 70.62 C ATOM 592 O TYR A 588 3.005 50.289 2.888 1.00 70.80 O ATOM 593 CB TYR A 588 3.790 50.129 0.120 1.00 70.67 C ATOM 594 CG TYR A 588 3.242 48.708 0.197 1.00 71.21 C ATOM 595 CD1 TYR A 588 1.875 48.464 0.037 1.00 72.17 C ATOM 596 CD2 TYR A 588 4.083 47.611 0.416 1.00 71.41 C ATOM 597 CE1 TYR A 588 1.357 47.167 0.097 1.00 72.19 C ATOM 598 CE2 TYR A 588 3.575 46.312 0.483 1.00 71.43 C ATOM 599 CZ TYR A 588 2.214 46.099 0.323 1.00 71.70 C ATOM 600 OH TYR A 588 1.705 44.821 0.379 1.00 71.51 O ATOM 0 H TYR A 588 6.141 49.506 0.339 1.00 69.59 H new ATOM 0 HA TYR A 588 4.790 51.519 1.298 1.00 70.38 H new ATOM 0 HB2 TYR A 588 3.041 50.745 0.104 1.00 70.67 H new ATOM 0 HB3 TYR A 588 4.259 50.230 -0.723 1.00 70.67 H new ATOM 0 HD1 TYR A 588 1.299 49.179 -0.112 1.00 72.17 H new ATOM 0 HD2 TYR A 588 4.997 47.750 0.519 1.00 71.41 H new ATOM 0 HE1 TYR A 588 0.445 47.021 -0.014 1.00 72.19 H new ATOM 0 HE2 TYR A 588 4.146 45.594 0.634 1.00 71.43 H new ATOM 0 HH TYR A 588 2.329 44.277 0.519 1.00 71.51 H new ATOM 601 N VAL A 626 5.059 49.540 3.453 1.00 70.98 N ATOM 602 CA VAL A 626 4.653 49.000 4.761 1.00 71.41 C ATOM 603 C VAL A 626 3.672 49.936 5.481 1.00 71.69 C ATOM 604 O VAL A 626 4.070 50.933 6.092 1.00 71.78 O ATOM 605 CB VAL A 626 5.870 48.664 5.671 1.00 71.30 C ATOM 606 CG1 VAL A 626 5.404 48.107 7.003 1.00 71.30 C ATOM 607 CG2 VAL A 626 6.793 47.668 4.988 1.00 71.42 C ATOM 0 H VAL A 626 5.898 49.454 3.284 1.00 70.98 H new ATOM 0 HA VAL A 626 4.193 48.165 4.580 1.00 71.41 H new ATOM 0 HB VAL A 626 6.361 49.485 5.830 1.00 71.30 H new ATOM 0 HG11 VAL A 626 6.174 47.904 7.556 1.00 71.30 H new ATOM 0 HG12 VAL A 626 4.848 48.763 7.452 1.00 71.30 H new ATOM 0 HG13 VAL A 626 4.891 47.297 6.854 1.00 71.30 H new ATOM 0 HG21 VAL A 626 7.544 47.471 5.569 1.00 71.42 H new ATOM 0 HG22 VAL A 626 6.306 46.850 4.802 1.00 71.42 H new ATOM 0 HG23 VAL A 626 7.119 48.046 4.156 1.00 71.42 H new ATOM 608 N GLN A 627 2.386 49.605 5.366 1.00 72.08 N ATOM 609 CA GLN A 627 1.293 50.374 5.969 1.00 72.42 C ATOM 610 C GLN A 627 1.316 50.230 7.497 1.00 72.42 C ATOM 611 O GLN A 627 0.778 49.275 8.067 1.00 72.74 O ATOM 612 CB GLN A 627 -0.062 49.990 5.319 1.00 72.53 C ATOM 613 CG GLN A 627 -1.315 49.924 6.226 1.00 72.97 C ATOM 614 CD GLN A 627 -1.601 51.211 6.990 1.00 73.41 C ATOM 615 OE1 GLN A 627 -1.410 52.315 6.475 1.00 73.69 O ATOM 616 NE2 GLN A 627 -2.064 51.068 8.229 1.00 73.20 N ATOM 0 H GLN A 627 2.118 48.915 4.928 1.00 72.08 H new ATOM 0 HA GLN A 627 1.416 51.319 5.789 1.00 72.42 H new ATOM 0 HB2 GLN A 627 -0.242 50.628 4.611 1.00 72.53 H new ATOM 0 HB3 GLN A 627 0.046 49.122 4.899 1.00 72.53 H new ATOM 0 HG2 GLN A 627 -2.086 49.706 5.680 1.00 72.97 H new ATOM 0 HG3 GLN A 627 -1.204 49.200 6.862 1.00 72.97 H new ATOM 0 HE21 GLN A 627 -2.185 50.281 8.555 1.00 73.20 H new ATOM 0 HE22 GLN A 627 -2.243 51.762 8.704 1.00 73.20 H new ATOM 617 N THR A 628 1.968 51.196 8.141 1.00 72.31 N ATOM 618 CA THR A 628 2.184 51.198 9.585 1.00 71.90 C ATOM 619 C THR A 628 2.150 52.646 10.091 1.00 71.64 C ATOM 620 O THR A 628 2.796 53.528 9.508 1.00 71.57 O ATOM 621 CB THR A 628 3.540 50.498 9.955 1.00 72.10 C ATOM 622 OG1 THR A 628 3.684 50.404 11.379 1.00 72.27 O ATOM 623 CG2 THR A 628 4.754 51.238 9.359 1.00 71.64 C ATOM 0 H THR A 628 2.303 51.881 7.743 1.00 72.31 H new ATOM 0 HA THR A 628 1.478 50.692 10.016 1.00 71.90 H new ATOM 0 HB THR A 628 3.515 49.607 9.571 1.00 72.10 H new ATOM 0 HG1 THR A 628 4.246 49.808 11.565 1.00 72.27 H new ATOM 0 HG21 THR A 628 5.569 50.776 9.609 1.00 71.64 H new ATOM 0 HG22 THR A 628 4.678 51.258 8.392 1.00 71.64 H new ATOM 0 HG23 THR A 628 4.779 52.146 9.700 1.00 71.64 H new ATOM 624 N LYS A 629 1.379 52.898 11.148 1.00 71.09 N ATOM 625 CA LYS A 629 1.403 54.215 11.798 1.00 70.64 C ATOM 626 C LYS A 629 2.590 54.364 12.766 1.00 70.22 C ATOM 627 O LYS A 629 2.811 55.435 13.337 1.00 70.21 O ATOM 628 CB LYS A 629 0.058 54.547 12.472 1.00 70.59 C ATOM 629 CG LYS A 629 -0.712 55.692 11.785 1.00 70.56 C ATOM 630 CD LYS A 629 -0.226 57.070 12.274 1.00 70.28 C ATOM 631 CE LYS A 629 0.061 58.050 11.131 1.00 69.50 C ATOM 632 NZ LYS A 629 -1.150 58.506 10.402 1.00 68.66 N ATOM 0 H LYS A 629 0.840 52.330 11.503 1.00 71.09 H new ATOM 0 HA LYS A 629 1.536 54.872 11.097 1.00 70.64 H new ATOM 0 HB2 LYS A 629 -0.497 53.752 12.477 1.00 70.59 H new ATOM 0 HB3 LYS A 629 0.219 54.786 13.398 1.00 70.59 H new ATOM 0 HG2 LYS A 629 -0.598 55.629 10.824 1.00 70.56 H new ATOM 0 HG3 LYS A 629 -1.661 55.599 11.965 1.00 70.56 H new ATOM 0 HD2 LYS A 629 -0.897 57.454 12.860 1.00 70.28 H new ATOM 0 HD3 LYS A 629 0.579 56.954 12.802 1.00 70.28 H new ATOM 0 HE2 LYS A 629 0.521 58.825 11.490 1.00 69.50 H new ATOM 0 HE3 LYS A 629 0.666 57.628 10.501 1.00 69.50 H new ATOM 0 HZ1 LYS A 629 -0.913 59.070 9.755 1.00 68.66 H new ATOM 0 HZ2 LYS A 629 -1.564 57.804 10.046 1.00 68.66 H new ATOM 0 HZ3 LYS A 629 -1.700 58.919 10.968 1.00 68.66 H new ATOM 633 N PHE A 630 3.354 53.282 12.921 1.00 69.61 N ATOM 634 CA PHE A 630 4.517 53.236 13.805 1.00 69.02 C ATOM 635 C PHE A 630 5.682 54.085 13.289 1.00 68.61 C ATOM 636 O PHE A 630 5.806 54.301 12.079 1.00 68.69 O ATOM 637 CB PHE A 630 5.017 51.798 13.941 1.00 68.86 C ATOM 638 CG PHE A 630 4.256 50.960 14.936 1.00 69.20 C ATOM 639 CD1 PHE A 630 3.373 49.967 14.500 1.00 69.15 C ATOM 640 CD2 PHE A 630 4.456 51.122 16.304 1.00 68.67 C ATOM 641 CE1 PHE A 630 2.690 49.172 15.411 1.00 68.46 C ATOM 642 CE2 PHE A 630 3.774 50.329 17.219 1.00 68.35 C ATOM 643 CZ PHE A 630 2.894 49.353 16.773 1.00 68.55 C ATOM 0 H PHE A 630 3.207 52.542 12.508 1.00 69.61 H new ATOM 0 HA PHE A 630 4.224 53.591 14.659 1.00 69.02 H new ATOM 0 HB2 PHE A 630 4.971 51.369 13.072 1.00 68.86 H new ATOM 0 HB3 PHE A 630 5.952 51.816 14.199 1.00 68.86 H new ATOM 0 HD1 PHE A 630 3.242 49.837 13.588 1.00 69.15 H new ATOM 0 HD2 PHE A 630 5.052 51.768 16.609 1.00 68.67 H new ATOM 0 HE1 PHE A 630 2.098 48.521 15.110 1.00 68.46 H new ATOM 0 HE2 PHE A 630 3.907 50.452 18.131 1.00 68.35 H new ATOM 0 HZ PHE A 630 2.441 48.820 17.386 1.00 68.55 H new ATOM 644 N PRO A 631 6.554 54.549 14.207 1.00 68.06 N ATOM 645 CA PRO A 631 7.836 55.116 13.797 1.00 67.65 C ATOM 646 C PRO A 631 8.718 54.008 13.221 1.00 67.05 C ATOM 647 O PRO A 631 8.460 52.827 13.489 1.00 67.02 O ATOM 648 CB PRO A 631 8.445 55.620 15.113 1.00 67.81 C ATOM 649 CG PRO A 631 7.336 55.610 16.112 1.00 68.18 C ATOM 650 CD PRO A 631 6.386 54.559 15.672 1.00 68.08 C ATOM 0 HA PRO A 631 7.751 55.810 13.124 1.00 67.65 H new ATOM 0 HB2 PRO A 631 9.175 55.048 15.399 1.00 67.81 H new ATOM 0 HB3 PRO A 631 8.809 56.513 15.007 1.00 67.81 H new ATOM 0 HG2 PRO A 631 7.674 55.420 17.001 1.00 68.18 H new ATOM 0 HG3 PRO A 631 6.900 56.475 16.153 1.00 68.18 H new ATOM 0 HD2 PRO A 631 6.598 53.697 16.063 1.00 68.08 H new ATOM 0 HD3 PRO A 631 5.474 54.770 15.927 1.00 68.08 H new ATOM 651 N ALA A 632 9.738 54.375 12.441 1.00 66.01 N ATOM 652 CA ALA A 632 10.670 53.385 11.900 1.00 65.08 C ATOM 653 C ALA A 632 11.362 52.648 13.052 1.00 64.46 C ATOM 654 O ALA A 632 11.375 51.411 13.098 1.00 64.31 O ATOM 655 CB ALA A 632 11.677 54.039 10.983 1.00 65.32 C ATOM 0 H ALA A 632 9.906 55.188 12.215 1.00 66.01 H new ATOM 0 HA ALA A 632 10.176 52.739 11.371 1.00 65.08 H new ATOM 0 HB1 ALA A 632 12.284 53.366 10.636 1.00 65.32 H new ATOM 0 HB2 ALA A 632 11.214 54.467 10.246 1.00 65.32 H new ATOM 0 HB3 ALA A 632 12.181 54.704 11.477 1.00 65.32 H new ATOM 656 N TYR A 633 11.916 53.423 13.980 1.00 63.44 N ATOM 657 CA TYR A 633 12.366 52.911 15.254 1.00 62.42 C ATOM 658 C TYR A 633 11.391 53.382 16.325 1.00 62.17 C ATOM 659 O TYR A 633 11.158 54.577 16.473 1.00 62.33 O ATOM 660 CB TYR A 633 13.759 53.442 15.592 1.00 62.17 C ATOM 661 CG TYR A 633 14.935 52.837 14.835 1.00 61.57 C ATOM 662 CD1 TYR A 633 14.855 51.583 14.224 1.00 60.05 C ATOM 663 CD2 TYR A 633 16.155 53.521 14.775 1.00 61.36 C ATOM 664 CE1 TYR A 633 15.953 51.040 13.555 1.00 60.39 C ATOM 665 CE2 TYR A 633 17.257 52.985 14.115 1.00 60.89 C ATOM 666 CZ TYR A 633 17.155 51.749 13.509 1.00 60.97 C ATOM 667 OH TYR A 633 18.262 51.242 12.862 1.00 60.74 O ATOM 0 H TYR A 633 12.039 54.268 13.880 1.00 63.44 H new ATOM 0 HA TYR A 633 12.405 51.943 15.213 1.00 62.42 H new ATOM 0 HB2 TYR A 633 13.762 54.400 15.437 1.00 62.17 H new ATOM 0 HB3 TYR A 633 13.910 53.308 16.541 1.00 62.17 H new ATOM 0 HD1 TYR A 633 14.059 51.104 14.264 1.00 60.05 H new ATOM 0 HD2 TYR A 633 16.231 54.352 15.185 1.00 61.36 H new ATOM 0 HE1 TYR A 633 15.884 50.210 13.142 1.00 60.39 H new ATOM 0 HE2 TYR A 633 18.058 53.457 14.082 1.00 60.89 H new ATOM 0 HH TYR A 633 18.871 51.820 12.854 1.00 60.74 H new ATOM 668 N GLU A 634 10.825 52.436 17.068 1.00 61.87 N ATOM 669 CA GLU A 634 9.966 52.738 18.213 1.00 61.49 C ATOM 670 C GLU A 634 10.748 52.615 19.529 1.00 61.18 C ATOM 671 O GLU A 634 11.388 51.594 19.788 1.00 60.63 O ATOM 672 CB GLU A 634 8.746 51.802 18.217 1.00 61.16 C ATOM 673 CG GLU A 634 7.945 51.760 19.517 1.00 61.03 C ATOM 674 CD GLU A 634 7.044 50.525 19.622 1.00 62.06 C ATOM 675 OE1 GLU A 634 6.118 50.523 20.465 1.00 62.64 O ATOM 676 OE2 GLU A 634 7.250 49.547 18.866 1.00 62.62 O ATOM 0 H GLU A 634 10.928 51.595 16.922 1.00 61.87 H new ATOM 0 HA GLU A 634 9.656 53.654 18.134 1.00 61.49 H new ATOM 0 HB2 GLU A 634 8.151 52.070 17.499 1.00 61.16 H new ATOM 0 HB3 GLU A 634 9.049 50.903 18.014 1.00 61.16 H new ATOM 0 HG2 GLU A 634 8.557 51.773 20.269 1.00 61.03 H new ATOM 0 HG3 GLU A 634 7.399 52.559 19.581 1.00 61.03 H new ATOM 677 N ARG A 635 10.692 53.666 20.344 1.00 60.95 N ATOM 678 CA ARG A 635 11.195 53.618 21.715 1.00 60.79 C ATOM 679 C ARG A 635 10.360 52.629 22.515 1.00 60.01 C ATOM 680 O ARG A 635 9.128 52.661 22.469 1.00 60.03 O ATOM 681 CB ARG A 635 11.151 55.005 22.361 1.00 60.86 C ATOM 682 CG ARG A 635 12.173 55.981 21.784 1.00 61.51 C ATOM 683 CD ARG A 635 12.293 57.253 22.632 1.00 62.02 C ATOM 684 NE ARG A 635 13.362 57.250 23.644 1.00 63.92 N ATOM 685 CZ ARG A 635 14.211 56.251 23.903 1.00 64.39 C ATOM 686 NH1 ARG A 635 14.151 55.104 23.234 1.00 64.15 N ATOM 687 NH2 ARG A 635 15.132 56.403 24.854 1.00 63.91 N ATOM 0 H ARG A 635 10.361 54.427 20.118 1.00 60.95 H new ATOM 0 HA ARG A 635 12.121 53.328 21.705 1.00 60.79 H new ATOM 0 HB2 ARG A 635 10.262 55.377 22.251 1.00 60.86 H new ATOM 0 HB3 ARG A 635 11.304 54.914 23.315 1.00 60.86 H new ATOM 0 HG2 ARG A 635 13.039 55.547 21.729 1.00 61.51 H new ATOM 0 HG3 ARG A 635 11.917 56.219 20.879 1.00 61.51 H new ATOM 0 HD2 ARG A 635 12.436 58.006 22.037 1.00 62.02 H new ATOM 0 HD3 ARG A 635 11.446 57.403 23.081 1.00 62.02 H new ATOM 0 HE ARG A 635 13.449 57.963 24.116 1.00 63.92 H new ATOM 0 HH11 ARG A 635 13.558 54.994 22.621 1.00 64.15 H new ATOM 0 HH12 ARG A 635 14.706 54.472 23.414 1.00 64.15 H new ATOM 0 HH21 ARG A 635 15.177 57.140 25.296 1.00 63.91 H new ATOM 0 HH22 ARG A 635 15.682 55.764 25.026 1.00 63.91 H new ATOM 688 N VAL A 636 11.030 51.748 23.248 1.00 59.22 N ATOM 689 CA VAL A 636 10.345 50.593 23.801 1.00 58.34 C ATOM 690 C VAL A 636 10.866 50.172 25.185 1.00 58.06 C ATOM 691 O VAL A 636 12.032 50.402 25.521 1.00 58.34 O ATOM 692 CB VAL A 636 10.357 49.442 22.765 1.00 58.19 C ATOM 693 CG1 VAL A 636 11.434 48.407 23.070 1.00 57.64 C ATOM 694 CG2 VAL A 636 8.995 48.827 22.658 1.00 58.08 C ATOM 0 H VAL A 636 11.868 51.800 23.434 1.00 59.22 H new ATOM 0 HA VAL A 636 9.423 50.843 23.970 1.00 58.34 H new ATOM 0 HB VAL A 636 10.585 49.817 21.900 1.00 58.19 H new ATOM 0 HG11 VAL A 636 11.408 47.706 22.400 1.00 57.64 H new ATOM 0 HG12 VAL A 636 12.305 48.833 23.058 1.00 57.64 H new ATOM 0 HG13 VAL A 636 11.275 48.023 23.946 1.00 57.64 H new ATOM 0 HG21 VAL A 636 9.015 48.108 22.007 1.00 58.08 H new ATOM 0 HG22 VAL A 636 8.731 48.473 23.522 1.00 58.08 H new ATOM 0 HG23 VAL A 636 8.357 49.501 22.376 1.00 58.08 H new ATOM 695 N VAL A 637 9.990 49.560 25.981 1.00 57.47 N ATOM 696 CA VAL A 637 10.294 49.216 27.375 1.00 56.80 C ATOM 697 C VAL A 637 9.675 47.876 27.781 1.00 56.54 C ATOM 698 O VAL A 637 8.609 47.521 27.294 1.00 56.65 O ATOM 699 CB VAL A 637 9.859 50.383 28.333 1.00 56.91 C ATOM 700 CG1 VAL A 637 8.801 49.953 29.380 1.00 56.18 C ATOM 701 CG2 VAL A 637 11.080 51.038 28.977 1.00 55.84 C ATOM 0 H VAL A 637 9.200 49.331 25.729 1.00 57.47 H new ATOM 0 HA VAL A 637 11.254 49.106 27.456 1.00 56.80 H new ATOM 0 HB VAL A 637 9.416 51.049 27.784 1.00 56.91 H new ATOM 0 HG11 VAL A 637 8.573 50.711 29.940 1.00 56.18 H new ATOM 0 HG12 VAL A 637 8.005 49.637 28.925 1.00 56.18 H new ATOM 0 HG13 VAL A 637 9.162 49.241 29.932 1.00 56.18 H new ATOM 0 HG21 VAL A 637 10.791 51.755 29.564 1.00 55.84 H new ATOM 0 HG22 VAL A 637 11.569 50.377 29.491 1.00 55.84 H new ATOM 0 HG23 VAL A 637 11.656 51.399 28.285 1.00 55.84 H new ATOM 702 N LEU A 638 10.351 47.121 28.646 1.00 56.34 N ATOM 703 CA LEU A 638 9.774 45.879 29.181 1.00 56.39 C ATOM 704 C LEU A 638 8.807 46.121 30.335 1.00 56.21 C ATOM 705 O LEU A 638 9.051 46.970 31.190 1.00 56.25 O ATOM 706 CB LEU A 638 10.854 44.891 29.618 1.00 56.36 C ATOM 707 CG LEU A 638 11.294 43.817 28.621 1.00 57.04 C ATOM 708 CD1 LEU A 638 12.248 42.844 29.297 1.00 57.40 C ATOM 709 CD2 LEU A 638 10.113 43.051 28.000 1.00 57.32 C ATOM 0 H LEU A 638 11.139 47.305 28.936 1.00 56.34 H new ATOM 0 HA LEU A 638 9.271 45.493 28.447 1.00 56.39 H new ATOM 0 HB2 LEU A 638 11.639 45.402 29.870 1.00 56.36 H new ATOM 0 HB3 LEU A 638 10.539 44.442 30.418 1.00 56.36 H new ATOM 0 HG LEU A 638 11.744 44.275 27.894 1.00 57.04 H new ATOM 0 HD11 LEU A 638 12.523 42.166 28.661 1.00 57.40 H new ATOM 0 HD12 LEU A 638 13.028 43.324 29.615 1.00 57.40 H new ATOM 0 HD13 LEU A 638 11.801 42.421 30.047 1.00 57.40 H new ATOM 0 HD21 LEU A 638 10.449 42.386 27.379 1.00 57.32 H new ATOM 0 HD22 LEU A 638 9.608 42.611 28.701 1.00 57.32 H new ATOM 0 HD23 LEU A 638 9.537 43.672 27.528 1.00 57.32 H new ATOM 710 N ARG A 639 7.713 45.366 30.351 1.00 56.05 N ATOM 711 CA ARG A 639 6.704 45.491 31.396 1.00 56.28 C ATOM 712 C ARG A 639 5.993 44.150 31.613 1.00 55.99 C ATOM 713 O ARG A 639 5.759 43.413 30.660 1.00 55.64 O ATOM 714 CB ARG A 639 5.685 46.566 31.004 1.00 56.45 C ATOM 715 CG ARG A 639 5.247 47.464 32.151 1.00 57.64 C ATOM 716 CD ARG A 639 3.731 47.404 32.361 1.00 59.86 C ATOM 717 NE ARG A 639 2.989 47.622 31.117 1.00 61.83 N ATOM 718 CZ ARG A 639 1.684 47.410 30.960 1.00 62.48 C ATOM 719 NH1 ARG A 639 0.941 46.963 31.968 1.00 63.61 N ATOM 720 NH2 ARG A 639 1.122 47.636 29.782 1.00 63.16 N ATOM 0 H ARG A 639 7.535 44.769 29.758 1.00 56.05 H new ATOM 0 HA ARG A 639 7.139 45.749 32.224 1.00 56.28 H new ATOM 0 HB2 ARG A 639 6.066 47.118 30.303 1.00 56.45 H new ATOM 0 HB3 ARG A 639 4.902 46.133 30.630 1.00 56.45 H new ATOM 0 HG2 ARG A 639 5.699 47.194 32.966 1.00 57.64 H new ATOM 0 HG3 ARG A 639 5.514 48.378 31.968 1.00 57.64 H new ATOM 0 HD2 ARG A 639 3.492 46.540 32.731 1.00 59.86 H new ATOM 0 HD3 ARG A 639 3.470 48.074 33.013 1.00 59.86 H new ATOM 0 HE ARG A 639 3.430 47.909 30.436 1.00 61.83 H new ATOM 0 HH11 ARG A 639 1.303 46.807 32.733 1.00 63.61 H new ATOM 0 HH12 ARG A 639 0.099 46.830 31.855 1.00 63.61 H new ATOM 0 HH21 ARG A 639 1.600 47.918 29.125 1.00 63.16 H new ATOM 0 HH22 ARG A 639 0.280 47.501 29.674 1.00 63.16 H new ATOM 721 N GLU A 640 5.653 43.825 32.857 1.00 55.90 N ATOM 722 CA GLU A 640 4.827 42.639 33.093 1.00 56.27 C ATOM 723 C GLU A 640 3.419 42.928 32.586 1.00 55.75 C ATOM 724 O GLU A 640 2.940 44.062 32.704 1.00 55.60 O ATOM 725 CB GLU A 640 4.796 42.214 34.571 1.00 56.60 C ATOM 726 CG GLU A 640 6.179 42.079 35.234 1.00 58.49 C ATOM 727 CD GLU A 640 6.287 40.871 36.170 1.00 61.25 C ATOM 728 OE1 GLU A 640 6.479 39.743 35.659 1.00 62.32 O ATOM 729 OE2 GLU A 640 6.194 41.045 37.414 1.00 61.40 O ATOM 0 H GLU A 640 5.881 44.262 33.562 1.00 55.90 H new ATOM 0 HA GLU A 640 5.219 41.894 32.612 1.00 56.27 H new ATOM 0 HB2 GLU A 640 4.274 42.862 35.070 1.00 56.60 H new ATOM 0 HB3 GLU A 640 4.334 41.364 34.640 1.00 56.60 H new ATOM 0 HG2 GLU A 640 6.856 42.007 34.543 1.00 58.49 H new ATOM 0 HG3 GLU A 640 6.371 42.887 35.735 1.00 58.49 H new ATOM 730 N ALA A 641 2.775 41.916 32.004 1.00 55.14 N ATOM 731 CA ALA A 641 1.434 42.085 31.453 1.00 54.86 C ATOM 732 C ALA A 641 0.460 42.404 32.577 1.00 54.81 C ATOM 733 O ALA A 641 0.339 41.651 33.548 1.00 54.67 O ATOM 734 CB ALA A 641 0.997 40.846 30.695 1.00 54.68 C ATOM 0 H ALA A 641 3.099 41.124 31.919 1.00 55.14 H new ATOM 0 HA ALA A 641 1.444 42.823 30.824 1.00 54.86 H new ATOM 0 HB1 ALA A 641 0.105 40.982 30.339 1.00 54.68 H new ATOM 0 HB2 ALA A 641 1.614 40.678 29.965 1.00 54.68 H new ATOM 0 HB3 ALA A 641 0.992 40.084 31.295 1.00 54.68 H new ATOM 735 N GLY A 642 -0.227 43.534 32.446 1.00 54.79 N ATOM 736 CA GLY A 642 -1.106 44.015 33.508 1.00 54.34 C ATOM 737 C GLY A 642 -2.542 43.577 33.374 1.00 53.97 C ATOM 738 O GLY A 642 -3.429 44.148 34.024 1.00 54.05 O ATOM 0 H GLY A 642 -0.199 44.038 31.750 1.00 54.79 H new ATOM 0 HA2 GLY A 642 -0.763 43.706 34.361 1.00 54.34 H new ATOM 0 HA3 GLY A 642 -1.075 44.984 33.524 1.00 54.34 H new ATOM 739 N PHE A 643 -2.757 42.562 32.534 1.00 53.48 N ATOM 740 CA PHE A 643 -4.078 42.008 32.238 1.00 53.09 C ATOM 741 C PHE A 643 -3.948 40.731 31.399 1.00 52.85 C ATOM 742 O PHE A 643 -2.869 40.419 30.880 1.00 53.11 O ATOM 743 CB PHE A 643 -4.914 43.039 31.480 1.00 53.14 C ATOM 744 CG PHE A 643 -4.359 43.390 30.121 1.00 53.59 C ATOM 745 CD1 PHE A 643 -4.828 42.743 28.975 1.00 52.91 C ATOM 746 CD2 PHE A 643 -3.367 44.359 29.986 1.00 53.22 C ATOM 747 CE1 PHE A 643 -4.326 43.058 27.726 1.00 52.47 C ATOM 748 CE2 PHE A 643 -2.856 44.686 28.737 1.00 52.65 C ATOM 749 CZ PHE A 643 -3.337 44.027 27.601 1.00 53.53 C ATOM 0 H PHE A 643 -2.121 42.167 32.110 1.00 53.48 H new ATOM 0 HA PHE A 643 -4.517 41.789 33.075 1.00 53.09 H new ATOM 0 HB2 PHE A 643 -5.816 42.697 31.374 1.00 53.14 H new ATOM 0 HB3 PHE A 643 -4.978 43.847 32.013 1.00 53.14 H new ATOM 0 HD1 PHE A 643 -5.487 42.091 29.053 1.00 52.91 H new ATOM 0 HD2 PHE A 643 -3.043 44.792 30.742 1.00 53.22 H new ATOM 0 HE1 PHE A 643 -4.649 42.622 26.971 1.00 52.47 H new ATOM 0 HE2 PHE A 643 -2.198 45.339 28.656 1.00 52.65 H new ATOM 0 HZ PHE A 643 -2.995 44.237 26.762 1.00 53.53 H new ATOM 750 N LEU A 644 -5.045 39.998 31.252 1.00 52.35 N ATOM 751 CA LEU A 644 -5.055 38.811 30.405 1.00 52.08 C ATOM 752 C LEU A 644 -5.154 39.205 28.927 1.00 51.49 C ATOM 753 O LEU A 644 -6.157 39.766 28.477 1.00 51.67 O ATOM 754 CB LEU A 644 -6.170 37.841 30.825 1.00 52.06 C ATOM 755 CG LEU A 644 -5.773 36.509 31.504 1.00 53.54 C ATOM 756 CD1 LEU A 644 -4.900 36.648 32.775 1.00 51.91 C ATOM 757 CD2 LEU A 644 -7.011 35.684 31.818 1.00 52.89 C ATOM 0 H LEU A 644 -5.796 40.171 31.635 1.00 52.35 H new ATOM 0 HA LEU A 644 -4.215 38.340 30.523 1.00 52.08 H new ATOM 0 HB2 LEU A 644 -6.761 38.316 31.430 1.00 52.06 H new ATOM 0 HB3 LEU A 644 -6.687 37.626 30.033 1.00 52.06 H new ATOM 0 HG LEU A 644 -5.213 36.058 30.853 1.00 53.54 H new ATOM 0 HD11 LEU A 644 -4.702 35.767 33.130 1.00 51.91 H new ATOM 0 HD12 LEU A 644 -4.071 37.100 32.551 1.00 51.91 H new ATOM 0 HD13 LEU A 644 -5.379 37.164 33.442 1.00 51.91 H new ATOM 0 HD21 LEU A 644 -6.747 34.853 32.243 1.00 52.89 H new ATOM 0 HD22 LEU A 644 -7.589 36.183 32.416 1.00 52.89 H new ATOM 0 HD23 LEU A 644 -7.487 35.489 30.996 1.00 52.89 H new ATOM 758 N ARG A 645 -4.098 38.921 28.176 1.00 50.72 N ATOM 759 CA ARG A 645 -4.000 39.405 26.812 1.00 50.02 C ATOM 760 C ARG A 645 -4.899 38.615 25.874 1.00 50.38 C ATOM 761 O ARG A 645 -5.005 37.379 25.985 1.00 50.23 O ATOM 762 CB ARG A 645 -2.555 39.363 26.329 1.00 49.79 C ATOM 763 CG ARG A 645 -1.610 40.289 27.093 1.00 48.81 C ATOM 764 CD ARG A 645 -0.178 39.816 26.970 1.00 48.30 C ATOM 765 NE ARG A 645 0.252 39.768 25.572 1.00 49.63 N ATOM 766 CZ ARG A 645 1.341 39.153 25.108 1.00 48.10 C ATOM 767 NH1 ARG A 645 2.162 38.495 25.913 1.00 46.53 N ATOM 768 NH2 ARG A 645 1.600 39.197 23.815 1.00 48.25 N ATOM 0 H ARG A 645 -3.429 38.449 28.439 1.00 50.72 H new ATOM 0 HA ARG A 645 -4.303 40.327 26.805 1.00 50.02 H new ATOM 0 HB2 ARG A 645 -2.227 38.453 26.401 1.00 49.79 H new ATOM 0 HB3 ARG A 645 -2.532 39.599 25.388 1.00 49.79 H new ATOM 0 HG2 ARG A 645 -1.687 41.192 26.749 1.00 48.81 H new ATOM 0 HG3 ARG A 645 -1.866 40.319 28.028 1.00 48.81 H new ATOM 0 HD2 ARG A 645 0.404 40.410 27.469 1.00 48.30 H new ATOM 0 HD3 ARG A 645 -0.092 38.935 27.367 1.00 48.30 H new ATOM 0 HE ARG A 645 -0.243 40.173 24.997 1.00 49.63 H new ATOM 0 HH11 ARG A 645 1.998 38.457 26.756 1.00 46.53 H new ATOM 0 HH12 ARG A 645 2.858 38.106 25.592 1.00 46.53 H new ATOM 0 HH21 ARG A 645 1.070 39.618 23.284 1.00 48.25 H new ATOM 0 HH22 ARG A 645 2.299 38.805 23.503 1.00 48.25 H new ATOM 769 N PRO A 646 -5.565 39.328 24.947 1.00 50.45 N ATOM 770 CA PRO A 646 -6.364 38.706 23.896 1.00 50.35 C ATOM 771 C PRO A 646 -5.496 37.759 23.082 1.00 50.57 C ATOM 772 O PRO A 646 -4.293 37.975 22.989 1.00 51.02 O ATOM 773 CB PRO A 646 -6.785 39.899 23.031 1.00 49.73 C ATOM 774 CG PRO A 646 -5.906 40.986 23.402 1.00 50.08 C ATOM 775 CD PRO A 646 -5.573 40.793 24.834 1.00 50.11 C ATOM 0 HA PRO A 646 -7.113 38.189 24.233 1.00 50.35 H new ATOM 0 HB2 PRO A 646 -6.702 39.691 22.087 1.00 49.73 H new ATOM 0 HB3 PRO A 646 -7.713 40.133 23.189 1.00 49.73 H new ATOM 0 HG2 PRO A 646 -5.103 40.981 22.858 1.00 50.08 H new ATOM 0 HG3 PRO A 646 -6.339 41.843 23.261 1.00 50.08 H new ATOM 0 HD2 PRO A 646 -4.714 41.180 25.063 1.00 50.11 H new ATOM 0 HD3 PRO A 646 -6.232 41.199 25.419 1.00 50.11 H new ATOM 776 N VAL A 647 -6.089 36.717 22.506 1.00 51.21 N ATOM 777 CA VAL A 647 -5.317 35.691 21.786 1.00 51.18 C ATOM 778 C VAL A 647 -5.815 35.571 20.355 1.00 52.21 C ATOM 779 O VAL A 647 -7.024 35.329 20.115 1.00 52.37 O ATOM 780 CB VAL A 647 -5.416 34.299 22.456 1.00 51.31 C ATOM 781 CG1 VAL A 647 -4.609 33.256 21.664 1.00 51.51 C ATOM 782 CG2 VAL A 647 -4.971 34.338 23.928 1.00 49.39 C ATOM 0 H VAL A 647 -6.938 36.580 22.517 1.00 51.21 H new ATOM 0 HA VAL A 647 -4.390 35.976 21.806 1.00 51.18 H new ATOM 0 HB VAL A 647 -6.350 34.037 22.446 1.00 51.31 H new ATOM 0 HG11 VAL A 647 -4.683 32.392 22.098 1.00 51.51 H new ATOM 0 HG12 VAL A 647 -4.958 33.195 20.761 1.00 51.51 H new ATOM 0 HG13 VAL A 647 -3.677 33.523 21.633 1.00 51.51 H new ATOM 0 HG21 VAL A 647 -5.047 33.451 24.313 1.00 49.39 H new ATOM 0 HG22 VAL A 647 -4.049 34.635 23.980 1.00 49.39 H new ATOM 0 HG23 VAL A 647 -5.536 34.953 24.421 1.00 49.39 H new ATOM 783 N THR A 648 -4.878 35.738 19.417 1.00 52.42 N ATOM 784 CA THR A 648 -5.136 35.638 17.993 1.00 53.09 C ATOM 785 C THR A 648 -4.414 34.397 17.446 1.00 53.20 C ATOM 786 O THR A 648 -3.198 34.242 17.653 1.00 54.15 O ATOM 787 CB THR A 648 -4.626 36.895 17.268 1.00 53.50 C ATOM 788 OG1 THR A 648 -5.428 38.024 17.625 1.00 55.80 O ATOM 789 CG2 THR A 648 -4.724 36.737 15.772 1.00 55.05 C ATOM 0 H THR A 648 -4.058 35.917 19.604 1.00 52.42 H new ATOM 0 HA THR A 648 -6.091 35.561 17.843 1.00 53.09 H new ATOM 0 HB THR A 648 -3.701 37.023 17.530 1.00 53.50 H new ATOM 0 HG1 THR A 648 -5.144 38.707 17.227 1.00 55.80 H new ATOM 0 HG21 THR A 648 -4.397 37.541 15.339 1.00 55.05 H new ATOM 0 HG22 THR A 648 -4.189 35.979 15.491 1.00 55.05 H new ATOM 0 HG23 THR A 648 -5.650 36.589 15.522 1.00 55.05 H new ATOM 790 N ILE A 649 -5.151 33.529 16.744 1.00 52.38 N ATOM 791 CA ILE A 649 -4.606 32.294 16.186 1.00 51.83 C ATOM 792 C ILE A 649 -4.726 32.285 14.658 1.00 52.07 C ATOM 793 O ILE A 649 -5.812 32.517 14.105 1.00 52.04 O ATOM 794 CB ILE A 649 -5.284 31.040 16.800 1.00 52.17 C ATOM 795 CG1 ILE A 649 -5.217 31.105 18.334 1.00 52.67 C ATOM 796 CG2 ILE A 649 -4.651 29.740 16.270 1.00 50.67 C ATOM 797 CD1 ILE A 649 -6.154 30.149 19.066 1.00 51.31 C ATOM 0 H ILE A 649 -5.987 33.645 16.579 1.00 52.38 H new ATOM 0 HA ILE A 649 -3.665 32.260 16.418 1.00 51.83 H new ATOM 0 HB ILE A 649 -6.216 31.034 16.530 1.00 52.17 H new ATOM 0 HG12 ILE A 649 -4.307 30.919 18.612 1.00 52.67 H new ATOM 0 HG13 ILE A 649 -5.419 32.011 18.614 1.00 52.67 H new ATOM 0 HG21 ILE A 649 -5.095 28.977 16.671 1.00 50.67 H new ATOM 0 HG22 ILE A 649 -4.750 29.701 15.306 1.00 50.67 H new ATOM 0 HG23 ILE A 649 -3.709 29.722 16.499 1.00 50.67 H new ATOM 0 HD11 ILE A 649 -6.045 30.258 20.024 1.00 51.31 H new ATOM 0 HD12 ILE A 649 -7.072 30.345 18.821 1.00 51.31 H new ATOM 0 HD13 ILE A 649 -5.942 29.235 18.819 1.00 51.31 H new ATOM 798 N PHE A 650 -3.602 32.033 13.983 1.00 51.70 N ATOM 799 CA PHE A 650 -3.557 31.962 12.511 1.00 51.41 C ATOM 800 C PHE A 650 -3.135 30.580 12.066 1.00 51.19 C ATOM 801 O PHE A 650 -2.463 29.850 12.814 1.00 50.21 O ATOM 802 CB PHE A 650 -2.583 32.990 11.906 1.00 51.18 C ATOM 803 CG PHE A 650 -2.985 34.414 12.136 1.00 52.19 C ATOM 804 CD1 PHE A 650 -4.092 34.953 11.493 1.00 51.85 C ATOM 805 CD2 PHE A 650 -2.242 35.231 12.973 1.00 54.36 C ATOM 806 CE1 PHE A 650 -4.474 36.254 11.698 1.00 50.29 C ATOM 807 CE2 PHE A 650 -2.628 36.549 13.178 1.00 54.06 C ATOM 808 CZ PHE A 650 -3.754 37.048 12.534 1.00 51.92 C ATOM 0 H PHE A 650 -2.842 31.898 14.362 1.00 51.70 H new ATOM 0 HA PHE A 650 -4.452 32.163 12.195 1.00 51.41 H new ATOM 0 HB2 PHE A 650 -1.701 32.847 12.283 1.00 51.18 H new ATOM 0 HB3 PHE A 650 -2.513 32.833 10.951 1.00 51.18 H new ATOM 0 HD1 PHE A 650 -4.585 34.420 10.911 1.00 51.85 H new ATOM 0 HD2 PHE A 650 -1.485 34.897 13.397 1.00 54.36 H new ATOM 0 HE1 PHE A 650 -5.225 36.593 11.266 1.00 50.29 H new ATOM 0 HE2 PHE A 650 -2.134 37.097 13.745 1.00 54.06 H new ATOM 0 HZ PHE A 650 -4.016 37.929 12.676 1.00 51.92 H new ATOM 809 N GLY A 651 -3.533 30.241 10.842 1.00 51.45 N ATOM 810 CA GLY A 651 -3.182 28.972 10.215 1.00 52.08 C ATOM 811 C GLY A 651 -4.394 28.116 9.871 1.00 52.17 C ATOM 812 O GLY A 651 -5.501 28.417 10.291 1.00 51.86 O ATOM 0 H GLY A 651 -4.020 30.749 10.347 1.00 51.45 H new ATOM 0 HA2 GLY A 651 -2.677 29.147 9.406 1.00 52.08 H new ATOM 0 HA3 GLY A 651 -2.600 28.474 10.810 1.00 52.08 H new ATOM 813 N PRO A 652 -4.173 26.999 9.151 1.00 52.49 N ATOM 814 CA PRO A 652 -5.245 26.288 8.463 1.00 52.46 C ATOM 815 C PRO A 652 -6.292 25.619 9.357 1.00 52.73 C ATOM 816 O PRO A 652 -7.283 25.115 8.828 1.00 53.14 O ATOM 817 CB PRO A 652 -4.496 25.245 7.637 1.00 52.35 C ATOM 818 CG PRO A 652 -3.216 25.059 8.320 1.00 52.44 C ATOM 819 CD PRO A 652 -2.873 26.311 9.021 1.00 52.15 C ATOM 0 HA PRO A 652 -5.781 26.915 7.953 1.00 52.46 H new ATOM 0 HB2 PRO A 652 -4.992 24.413 7.591 1.00 52.35 H new ATOM 0 HB3 PRO A 652 -4.365 25.549 6.725 1.00 52.35 H new ATOM 0 HG2 PRO A 652 -3.274 24.325 8.951 1.00 52.44 H new ATOM 0 HG3 PRO A 652 -2.523 24.830 7.681 1.00 52.44 H new ATOM 0 HD2 PRO A 652 -2.472 26.137 9.887 1.00 52.15 H new ATOM 0 HD3 PRO A 652 -2.237 26.841 8.515 1.00 52.15 H new ATOM 820 N ILE A 653 -6.084 25.617 10.680 1.00 53.08 N ATOM 821 CA ILE A 653 -7.043 25.058 11.654 1.00 52.98 C ATOM 822 C ILE A 653 -7.327 25.956 12.869 1.00 53.49 C ATOM 823 O ILE A 653 -7.787 25.489 13.935 1.00 53.35 O ATOM 824 CB ILE A 653 -6.641 23.650 12.161 1.00 52.78 C ATOM 825 CG1 ILE A 653 -5.346 23.700 12.970 1.00 52.53 C ATOM 826 CG2 ILE A 653 -6.574 22.629 11.001 1.00 53.37 C ATOM 827 CD1 ILE A 653 -5.170 22.499 13.898 1.00 52.37 C ATOM 0 H ILE A 653 -5.376 25.943 11.043 1.00 53.08 H new ATOM 0 HA ILE A 653 -7.861 24.997 11.137 1.00 52.98 H new ATOM 0 HB ILE A 653 -7.336 23.341 12.763 1.00 52.78 H new ATOM 0 HG12 ILE A 653 -4.592 23.744 12.361 1.00 52.53 H new ATOM 0 HG13 ILE A 653 -5.332 24.514 13.498 1.00 52.53 H new ATOM 0 HG21 ILE A 653 -6.321 21.760 11.349 1.00 53.37 H new ATOM 0 HG22 ILE A 653 -7.443 22.565 10.575 1.00 53.37 H new ATOM 0 HG23 ILE A 653 -5.916 22.921 10.351 1.00 53.37 H new ATOM 0 HD11 ILE A 653 -4.335 22.585 14.384 1.00 52.37 H new ATOM 0 HD12 ILE A 653 -5.907 22.465 14.527 1.00 52.37 H new ATOM 0 HD13 ILE A 653 -5.156 21.683 13.373 1.00 52.37 H new ATOM 828 N ALA A 654 -7.076 27.246 12.694 1.00 53.68 N ATOM 829 CA ALA A 654 -7.304 28.239 13.736 1.00 54.04 C ATOM 830 C ALA A 654 -8.781 28.346 14.190 1.00 54.44 C ATOM 831 O ALA A 654 -9.056 28.666 15.358 1.00 53.81 O ATOM 832 CB ALA A 654 -6.779 29.584 13.290 1.00 53.68 C ATOM 0 H ALA A 654 -6.766 27.573 11.962 1.00 53.68 H new ATOM 0 HA ALA A 654 -6.814 27.937 14.517 1.00 54.04 H new ATOM 0 HB1 ALA A 654 -6.934 30.240 13.988 1.00 53.68 H new ATOM 0 HB2 ALA A 654 -5.827 29.518 13.114 1.00 53.68 H new ATOM 0 HB3 ALA A 654 -7.238 29.859 12.481 1.00 53.68 H new ATOM 833 N ASP A 655 -9.721 28.082 13.281 1.00 55.02 N ATOM 834 CA ASP A 655 -11.150 28.084 13.654 1.00 55.67 C ATOM 835 C ASP A 655 -11.492 26.921 14.604 1.00 55.93 C ATOM 836 O ASP A 655 -12.116 27.130 15.640 1.00 56.19 O ATOM 837 CB ASP A 655 -12.066 28.110 12.421 1.00 55.13 C ATOM 838 CG ASP A 655 -11.749 27.019 11.431 1.00 56.65 C ATOM 839 OD1 ASP A 655 -12.529 26.857 10.465 1.00 55.05 O ATOM 840 OD2 ASP A 655 -10.713 26.319 11.611 1.00 59.82 O ATOM 0 H ASP A 655 -9.563 27.901 12.455 1.00 55.02 H new ATOM 0 HA ASP A 655 -11.316 28.906 14.141 1.00 55.67 H new ATOM 0 HB2 ASP A 655 -12.989 28.022 12.707 1.00 55.13 H new ATOM 0 HB3 ASP A 655 -11.986 28.971 11.982 1.00 55.13 H new ATOM 841 N VAL A 656 -11.061 25.712 14.256 1.00 56.15 N ATOM 842 CA VAL A 656 -11.123 24.565 15.164 1.00 56.55 C ATOM 843 C VAL A 656 -10.456 24.883 16.519 1.00 57.09 C ATOM 844 O VAL A 656 -11.046 24.663 17.565 1.00 57.48 O ATOM 845 CB VAL A 656 -10.450 23.337 14.513 1.00 56.56 C ATOM 846 CG1 VAL A 656 -10.160 22.232 15.538 1.00 54.94 C ATOM 847 CG2 VAL A 656 -11.292 22.843 13.354 1.00 56.71 C ATOM 0 H VAL A 656 -10.723 25.531 13.486 1.00 56.15 H new ATOM 0 HA VAL A 656 -12.057 24.366 15.332 1.00 56.55 H new ATOM 0 HB VAL A 656 -9.586 23.607 14.164 1.00 56.56 H new ATOM 0 HG11 VAL A 656 -9.739 21.480 15.093 1.00 54.94 H new ATOM 0 HG12 VAL A 656 -9.567 22.575 16.224 1.00 54.94 H new ATOM 0 HG13 VAL A 656 -10.991 21.942 15.945 1.00 54.94 H new ATOM 0 HG21 VAL A 656 -10.865 22.072 12.949 1.00 56.71 H new ATOM 0 HG22 VAL A 656 -12.172 22.592 13.677 1.00 56.71 H new ATOM 0 HG23 VAL A 656 -11.379 23.548 12.693 1.00 56.71 H new ATOM 848 N ALA A 657 -9.236 25.414 16.483 1.00 57.60 N ATOM 849 CA ALA A 657 -8.508 25.834 17.686 1.00 57.89 C ATOM 850 C ALA A 657 -9.320 26.750 18.620 1.00 58.23 C ATOM 851 O ALA A 657 -9.404 26.496 19.832 1.00 58.34 O ATOM 852 CB ALA A 657 -7.188 26.506 17.289 1.00 57.40 C ATOM 0 H ALA A 657 -8.800 25.543 15.753 1.00 57.60 H new ATOM 0 HA ALA A 657 -8.332 25.028 18.196 1.00 57.89 H new ATOM 0 HB1 ALA A 657 -6.712 26.781 18.088 1.00 57.40 H new ATOM 0 HB2 ALA A 657 -6.643 25.879 16.788 1.00 57.40 H new ATOM 0 HB3 ALA A 657 -7.373 27.284 16.739 1.00 57.40 H new ATOM 853 N ARG A 658 -9.896 27.807 18.044 1.00 58.44 N ATOM 854 CA ARG A 658 -10.723 28.781 18.751 1.00 58.50 C ATOM 855 C ARG A 658 -11.934 28.125 19.421 1.00 58.96 C ATOM 856 O ARG A 658 -12.201 28.343 20.608 1.00 58.88 O ATOM 857 CB ARG A 658 -11.209 29.825 17.758 1.00 58.46 C ATOM 858 CG ARG A 658 -10.386 31.069 17.684 1.00 57.77 C ATOM 859 CD ARG A 658 -11.031 32.040 16.703 1.00 61.27 C ATOM 860 NE ARG A 658 -10.201 32.155 15.499 1.00 67.00 N ATOM 861 CZ ARG A 658 -10.581 31.903 14.250 1.00 68.01 C ATOM 862 NH1 ARG A 658 -11.826 31.543 13.963 1.00 69.01 N ATOM 863 NH2 ARG A 658 -9.694 32.039 13.277 1.00 69.86 N ATOM 0 H ARG A 658 -9.812 27.980 17.206 1.00 58.44 H new ATOM 0 HA ARG A 658 -10.182 29.187 19.446 1.00 58.50 H new ATOM 0 HB2 ARG A 658 -11.239 29.422 16.876 1.00 58.46 H new ATOM 0 HB3 ARG A 658 -12.119 30.070 17.989 1.00 58.46 H new ATOM 0 HG2 ARG A 658 -10.317 31.477 18.561 1.00 57.77 H new ATOM 0 HG3 ARG A 658 -9.484 30.856 17.399 1.00 57.77 H new ATOM 0 HD2 ARG A 658 -11.919 31.730 16.465 1.00 61.27 H new ATOM 0 HD3 ARG A 658 -11.136 32.910 17.118 1.00 61.27 H new ATOM 0 HE ARG A 658 -9.388 32.411 15.612 1.00 67.00 H new ATOM 0 HH11 ARG A 658 -12.408 31.468 14.592 1.00 69.01 H new ATOM 0 HH12 ARG A 658 -12.051 31.385 13.148 1.00 69.01 H new ATOM 0 HH21 ARG A 658 -8.891 32.286 13.459 1.00 69.86 H new ATOM 0 HH22 ARG A 658 -9.921 31.880 12.463 1.00 69.86 H new ATOM 864 N GLU A 659 -12.642 27.308 18.643 1.00 59.52 N ATOM 865 CA GLU A 659 -13.873 26.631 19.056 1.00 60.67 C ATOM 866 C GLU A 659 -13.630 25.622 20.173 1.00 59.28 C ATOM 867 O GLU A 659 -14.360 25.585 21.147 1.00 59.44 O ATOM 868 CB GLU A 659 -14.508 25.919 17.857 1.00 60.40 C ATOM 869 CG GLU A 659 -14.971 26.836 16.713 1.00 63.69 C ATOM 870 CD GLU A 659 -15.652 26.064 15.553 1.00 65.07 C ATOM 871 OE1 GLU A 659 -16.714 25.433 15.813 1.00 69.89 O ATOM 872 OE2 GLU A 659 -15.137 26.097 14.386 1.00 69.28 O ATOM 0 H GLU A 659 -12.413 27.126 17.834 1.00 59.52 H new ATOM 0 HA GLU A 659 -14.474 27.312 19.397 1.00 60.67 H new ATOM 0 HB2 GLU A 659 -13.868 25.283 17.502 1.00 60.40 H new ATOM 0 HB3 GLU A 659 -15.271 25.408 18.171 1.00 60.40 H new ATOM 0 HG2 GLU A 659 -15.591 27.494 17.064 1.00 63.69 H new ATOM 0 HG3 GLU A 659 -14.207 27.322 16.366 1.00 63.69 H new ATOM 873 N LYS A 660 -12.592 24.814 20.018 1.00 58.56 N ATOM 874 CA LYS A 660 -12.195 23.834 21.000 1.00 57.62 C ATOM 875 C LYS A 660 -11.812 24.475 22.337 1.00 57.14 C ATOM 876 O LYS A 660 -12.248 24.023 23.398 1.00 56.67 O ATOM 877 CB LYS A 660 -11.044 23.017 20.435 1.00 57.46 C ATOM 878 CG LYS A 660 -10.914 21.645 21.025 1.00 59.14 C ATOM 879 CD LYS A 660 -10.183 20.719 20.053 1.00 61.03 C ATOM 880 CE LYS A 660 -9.924 19.342 20.661 1.00 60.32 C ATOM 881 NZ LYS A 660 -11.198 18.662 21.007 1.00 60.22 N ATOM 0 H LYS A 660 -12.090 24.824 19.320 1.00 58.56 H new ATOM 0 HA LYS A 660 -12.951 23.255 21.185 1.00 57.62 H new ATOM 0 HB2 LYS A 660 -11.159 22.935 19.475 1.00 57.46 H new ATOM 0 HB3 LYS A 660 -10.216 23.500 20.581 1.00 57.46 H new ATOM 0 HG2 LYS A 660 -10.430 21.691 21.864 1.00 59.14 H new ATOM 0 HG3 LYS A 660 -11.793 21.287 21.224 1.00 59.14 H new ATOM 0 HD2 LYS A 660 -10.709 20.621 19.244 1.00 61.03 H new ATOM 0 HD3 LYS A 660 -9.339 21.122 19.796 1.00 61.03 H new ATOM 0 HE2 LYS A 660 -9.423 18.797 20.034 1.00 60.32 H new ATOM 0 HE3 LYS A 660 -9.377 19.434 21.457 1.00 60.32 H new ATOM 0 HZ1 LYS A 660 -11.101 17.783 20.910 1.00 60.22 H new ATOM 0 HZ2 LYS A 660 -11.413 18.845 21.851 1.00 60.22 H new ATOM 0 HZ3 LYS A 660 -11.845 18.950 20.467 1.00 60.22 H new ATOM 882 N LEU A 661 -11.017 25.542 22.291 1.00 57.04 N ATOM 883 CA LEU A 661 -10.574 26.208 23.524 1.00 56.67 C ATOM 884 C LEU A 661 -11.738 26.820 24.313 1.00 56.69 C ATOM 885 O LEU A 661 -11.797 26.696 25.546 1.00 56.19 O ATOM 886 CB LEU A 661 -9.532 27.278 23.225 1.00 56.19 C ATOM 887 CG LEU A 661 -8.122 26.823 22.835 1.00 56.54 C ATOM 888 CD1 LEU A 661 -7.366 28.004 22.186 1.00 55.07 C ATOM 889 CD2 LEU A 661 -7.357 26.254 24.026 1.00 53.90 C ATOM 0 H LEU A 661 -10.723 25.896 21.565 1.00 57.04 H new ATOM 0 HA LEU A 661 -10.174 25.519 24.077 1.00 56.67 H new ATOM 0 HB2 LEU A 661 -9.874 27.833 22.507 1.00 56.19 H new ATOM 0 HB3 LEU A 661 -9.455 27.844 24.009 1.00 56.19 H new ATOM 0 HG LEU A 661 -8.196 26.102 22.190 1.00 56.54 H new ATOM 0 HD11 LEU A 661 -6.473 27.719 21.938 1.00 55.07 H new ATOM 0 HD12 LEU A 661 -7.843 28.298 21.394 1.00 55.07 H new ATOM 0 HD13 LEU A 661 -7.307 28.737 22.818 1.00 55.07 H new ATOM 0 HD21 LEU A 661 -6.472 25.978 23.740 1.00 53.90 H new ATOM 0 HD22 LEU A 661 -7.277 26.933 24.714 1.00 53.90 H new ATOM 0 HD23 LEU A 661 -7.835 25.489 24.382 1.00 53.90 H new ATOM 890 N ALA A 662 -12.645 27.470 23.582 1.00 56.57 N ATOM 891 CA ALA A 662 -13.796 28.149 24.144 1.00 56.79 C ATOM 892 C ALA A 662 -14.820 27.157 24.647 1.00 57.12 C ATOM 893 O ALA A 662 -15.558 27.443 25.577 1.00 56.63 O ATOM 894 CB ALA A 662 -14.431 29.060 23.094 1.00 56.85 C ATOM 0 H ALA A 662 -12.601 27.526 22.725 1.00 56.57 H new ATOM 0 HA ALA A 662 -13.494 28.684 24.895 1.00 56.79 H new ATOM 0 HB1 ALA A 662 -15.200 29.510 23.478 1.00 56.85 H new ATOM 0 HB2 ALA A 662 -13.782 29.720 22.803 1.00 56.85 H new ATOM 0 HB3 ALA A 662 -14.714 28.529 22.333 1.00 56.85 H new ATOM 895 N ARG A 663 -14.872 25.995 24.018 1.00 57.96 N ATOM 896 CA ARG A 663 -15.819 24.974 24.422 1.00 59.98 C ATOM 897 C ARG A 663 -15.340 24.261 25.698 1.00 59.90 C ATOM 898 O ARG A 663 -16.099 24.107 26.653 1.00 59.54 O ATOM 899 CB ARG A 663 -16.055 23.974 23.278 1.00 59.43 C ATOM 900 CG ARG A 663 -17.389 23.242 23.359 1.00 61.70 C ATOM 901 CD ARG A 663 -17.570 22.238 22.204 1.00 62.53 C ATOM 902 NE ARG A 663 -16.617 21.126 22.296 1.00 67.81 N ATOM 903 CZ ARG A 663 -15.528 20.989 21.538 1.00 69.25 C ATOM 904 NH1 ARG A 663 -15.239 21.894 20.601 1.00 71.78 N ATOM 905 NH2 ARG A 663 -14.725 19.944 21.716 1.00 67.94 N ATOM 0 H ARG A 663 -14.368 25.778 23.356 1.00 57.96 H new ATOM 0 HA ARG A 663 -16.666 25.402 24.624 1.00 59.98 H new ATOM 0 HB2 ARG A 663 -16.007 24.447 22.432 1.00 59.43 H new ATOM 0 HB3 ARG A 663 -15.338 23.321 23.279 1.00 59.43 H new ATOM 0 HG2 ARG A 663 -17.448 22.773 24.206 1.00 61.70 H new ATOM 0 HG3 ARG A 663 -18.113 23.888 23.341 1.00 61.70 H new ATOM 0 HD2 ARG A 663 -18.475 21.890 22.216 1.00 62.53 H new ATOM 0 HD3 ARG A 663 -17.453 22.695 21.356 1.00 62.53 H new ATOM 0 HE ARG A 663 -16.772 20.517 22.883 1.00 67.81 H new ATOM 0 HH11 ARG A 663 -15.756 22.571 20.483 1.00 71.78 H new ATOM 0 HH12 ARG A 663 -14.535 21.800 20.115 1.00 71.78 H new ATOM 0 HH21 ARG A 663 -14.908 19.359 22.319 1.00 67.94 H new ATOM 0 HH22 ARG A 663 -14.022 19.854 21.228 1.00 67.94 H new ATOM 906 N GLU A 664 -14.068 23.868 25.697 1.00 60.48 N ATOM 907 CA GLU A 664 -13.500 22.965 26.695 1.00 61.76 C ATOM 908 C GLU A 664 -12.914 23.675 27.910 1.00 60.80 C ATOM 909 O GLU A 664 -12.880 23.112 28.999 1.00 61.11 O ATOM 910 CB GLU A 664 -12.448 22.058 26.045 1.00 61.56 C ATOM 911 CG GLU A 664 -13.049 21.093 24.988 1.00 64.30 C ATOM 912 CD GLU A 664 -12.016 20.129 24.385 1.00 65.46 C ATOM 913 OE1 GLU A 664 -11.033 19.767 25.092 1.00 69.99 O ATOM 914 OE2 GLU A 664 -12.190 19.733 23.201 1.00 69.20 O ATOM 0 H GLU A 664 -13.500 24.124 25.104 1.00 60.48 H new ATOM 0 HA GLU A 664 -14.238 22.432 27.030 1.00 61.76 H new ATOM 0 HB2 GLU A 664 -11.769 22.608 25.624 1.00 61.56 H new ATOM 0 HB3 GLU A 664 -12.005 21.539 26.735 1.00 61.56 H new ATOM 0 HG2 GLU A 664 -13.761 20.578 25.398 1.00 64.30 H new ATOM 0 HG3 GLU A 664 -13.450 21.614 24.275 1.00 64.30 H new ATOM 915 N GLU A 665 -12.460 24.908 27.726 1.00 60.18 N ATOM 916 CA GLU A 665 -12.076 25.739 28.848 1.00 59.92 C ATOM 917 C GLU A 665 -12.884 27.041 28.848 1.00 59.00 C ATOM 918 O GLU A 665 -12.307 28.121 28.748 1.00 59.01 O ATOM 919 CB GLU A 665 -10.568 26.043 28.827 1.00 60.60 C ATOM 920 CG GLU A 665 -9.660 24.885 28.398 1.00 62.39 C ATOM 921 CD GLU A 665 -9.439 23.850 29.495 1.00 65.85 C ATOM 922 OE1 GLU A 665 -8.975 22.727 29.155 1.00 66.43 O ATOM 923 OE2 GLU A 665 -9.704 24.161 30.691 1.00 65.92 O ATOM 0 H GLU A 665 -12.368 25.280 26.956 1.00 60.18 H new ATOM 0 HA GLU A 665 -12.270 25.250 29.663 1.00 59.92 H new ATOM 0 HB2 GLU A 665 -10.414 26.791 28.229 1.00 60.60 H new ATOM 0 HB3 GLU A 665 -10.301 26.330 29.714 1.00 60.60 H new ATOM 0 HG2 GLU A 665 -10.048 24.448 27.624 1.00 62.39 H new ATOM 0 HG3 GLU A 665 -8.801 25.242 28.121 1.00 62.39 H new ATOM 924 N PRO A 666 -14.221 26.950 28.980 1.00 58.43 N ATOM 925 CA PRO A 666 -14.997 28.188 28.949 1.00 58.08 C ATOM 926 C PRO A 666 -14.656 29.167 30.075 1.00 57.56 C ATOM 927 O PRO A 666 -15.007 30.327 29.979 1.00 57.97 O ATOM 928 CB PRO A 666 -16.447 27.700 29.087 1.00 57.40 C ATOM 929 CG PRO A 666 -16.351 26.370 29.693 1.00 57.37 C ATOM 930 CD PRO A 666 -15.098 25.777 29.175 1.00 58.29 C ATOM 0 HA PRO A 666 -14.815 28.690 28.139 1.00 58.08 H new ATOM 0 HB2 PRO A 666 -16.967 28.301 29.643 1.00 57.40 H new ATOM 0 HB3 PRO A 666 -16.887 27.660 28.223 1.00 57.40 H new ATOM 0 HG2 PRO A 666 -16.333 26.430 30.661 1.00 57.37 H new ATOM 0 HG3 PRO A 666 -17.117 25.824 29.457 1.00 57.37 H new ATOM 0 HD2 PRO A 666 -14.715 25.144 29.803 1.00 58.29 H new ATOM 0 HD3 PRO A 666 -15.245 25.298 28.344 1.00 58.29 H new ATOM 931 N ASP A 667 -13.980 28.711 31.121 1.00 57.25 N ATOM 932 CA ASP A 667 -13.578 29.605 32.211 1.00 57.30 C ATOM 933 C ASP A 667 -12.287 30.368 31.930 1.00 56.55 C ATOM 934 O ASP A 667 -12.012 31.375 32.579 1.00 56.99 O ATOM 935 CB ASP A 667 -13.451 28.843 33.539 1.00 57.76 C ATOM 936 CG ASP A 667 -14.764 28.760 34.296 1.00 59.93 C ATOM 937 OD1 ASP A 667 -15.846 29.039 33.710 1.00 62.63 O ATOM 938 OD2 ASP A 667 -14.713 28.409 35.492 1.00 63.39 O ATOM 0 H ASP A 667 -13.743 27.891 31.223 1.00 57.25 H new ATOM 0 HA ASP A 667 -14.288 30.262 32.280 1.00 57.30 H new ATOM 0 HB2 ASP A 667 -13.127 27.946 33.363 1.00 57.76 H new ATOM 0 HB3 ASP A 667 -12.788 29.280 34.096 1.00 57.76 H new ATOM 939 N ILE A 668 -11.490 29.878 30.986 1.00 55.60 N ATOM 940 CA ILE A 668 -10.248 30.529 30.620 1.00 54.76 C ATOM 941 C ILE A 668 -10.367 31.347 29.312 1.00 55.22 C ATOM 942 O ILE A 668 -9.746 32.406 29.178 1.00 55.02 O ATOM 943 CB ILE A 668 -9.084 29.494 30.520 1.00 54.87 C ATOM 944 CG1 ILE A 668 -8.883 28.765 31.858 1.00 53.87 C ATOM 945 CG2 ILE A 668 -7.796 30.171 30.070 1.00 53.08 C ATOM 946 CD1 ILE A 668 -7.883 27.610 31.811 1.00 53.54 C ATOM 0 H ILE A 668 -11.657 29.160 30.543 1.00 55.60 H new ATOM 0 HA ILE A 668 -10.045 31.159 31.329 1.00 54.76 H new ATOM 0 HB ILE A 668 -9.325 28.833 29.853 1.00 54.87 H new ATOM 0 HG12 ILE A 668 -8.586 29.407 32.521 1.00 53.87 H new ATOM 0 HG13 ILE A 668 -9.740 28.423 32.158 1.00 53.87 H new ATOM 0 HG21 ILE A 668 -7.086 29.512 30.014 1.00 53.08 H new ATOM 0 HG22 ILE A 668 -7.930 30.576 29.199 1.00 53.08 H new ATOM 0 HG23 ILE A 668 -7.550 30.857 30.710 1.00 53.08 H new ATOM 0 HD11 ILE A 668 -7.814 27.205 32.690 1.00 53.54 H new ATOM 0 HD12 ILE A 668 -8.186 26.946 31.172 1.00 53.54 H new ATOM 0 HD13 ILE A 668 -7.014 27.945 31.541 1.00 53.54 H new ATOM 947 N TYR A 669 -11.154 30.838 28.362 1.00 55.56 N ATOM 948 CA TYR A 669 -11.238 31.385 27.003 1.00 56.06 C ATOM 949 C TYR A 669 -12.663 31.721 26.638 1.00 56.93 C ATOM 950 O TYR A 669 -13.595 31.005 27.015 1.00 56.88 O ATOM 951 CB TYR A 669 -10.704 30.381 25.975 1.00 55.67 C ATOM 952 CG TYR A 669 -9.268 30.026 26.212 1.00 55.31 C ATOM 953 CD1 TYR A 669 -8.274 30.921 25.887 1.00 53.62 C ATOM 954 CD2 TYR A 669 -8.904 28.806 26.793 1.00 56.01 C ATOM 955 CE1 TYR A 669 -6.968 30.638 26.111 1.00 54.20 C ATOM 956 CE2 TYR A 669 -7.564 28.504 27.031 1.00 55.14 C ATOM 957 CZ TYR A 669 -6.609 29.441 26.676 1.00 55.64 C ATOM 958 OH TYR A 669 -5.270 29.233 26.882 1.00 57.74 O ATOM 0 H TYR A 669 -11.662 30.156 28.490 1.00 55.56 H new ATOM 0 HA TYR A 669 -10.699 32.191 26.989 1.00 56.06 H new ATOM 0 HB2 TYR A 669 -11.243 29.575 26.005 1.00 55.67 H new ATOM 0 HB3 TYR A 669 -10.799 30.753 25.084 1.00 55.67 H new ATOM 0 HD1 TYR A 669 -8.504 31.737 25.505 1.00 53.62 H new ATOM 0 HD2 TYR A 669 -9.562 28.191 27.023 1.00 56.01 H new ATOM 0 HE1 TYR A 669 -6.313 31.257 25.881 1.00 54.20 H new ATOM 0 HE2 TYR A 669 -7.318 27.695 27.418 1.00 55.14 H new ATOM 0 HH TYR A 669 -5.154 28.478 27.230 1.00 57.74 H new ATOM 959 N GLN A 670 -12.810 32.820 25.900 1.00 57.66 N ATOM 960 CA GLN A 670 -14.072 33.213 25.308 1.00 58.32 C ATOM 961 C GLN A 670 -13.840 33.871 23.958 1.00 58.70 C ATOM 962 O GLN A 670 -13.018 34.781 23.841 1.00 58.71 O ATOM 963 CB GLN A 670 -14.824 34.167 26.228 1.00 57.98 C ATOM 964 CG GLN A 670 -16.225 34.477 25.748 1.00 57.99 C ATOM 965 CD GLN A 670 -17.020 35.341 26.720 1.00 59.09 C ATOM 966 OE1 GLN A 670 -17.699 36.275 26.305 1.00 61.18 O ATOM 967 NE2 GLN A 670 -16.943 35.033 28.017 1.00 60.41 N ATOM 0 H GLN A 670 -12.165 33.363 25.730 1.00 57.66 H new ATOM 0 HA GLN A 670 -14.609 32.415 25.182 1.00 58.32 H new ATOM 0 HB2 GLN A 670 -14.871 33.781 27.116 1.00 57.98 H new ATOM 0 HB3 GLN A 670 -14.324 34.995 26.305 1.00 57.98 H new ATOM 0 HG2 GLN A 670 -16.174 34.929 24.891 1.00 57.99 H new ATOM 0 HG3 GLN A 670 -16.701 33.645 25.601 1.00 57.99 H new ATOM 0 HE21 GLN A 670 -16.457 34.371 28.274 1.00 60.41 H new ATOM 0 HE22 GLN A 670 -17.379 35.496 28.596 1.00 60.41 H new ATOM 968 N ILE A 671 -14.578 33.412 22.949 1.00 59.58 N ATOM 969 CA ILE A 671 -14.562 34.034 21.625 1.00 60.51 C ATOM 970 C ILE A 671 -15.209 35.407 21.689 1.00 60.69 C ATOM 971 O ILE A 671 -16.379 35.526 22.042 1.00 60.34 O ATOM 972 CB ILE A 671 -15.295 33.189 20.540 1.00 60.48 C ATOM 973 CG1 ILE A 671 -14.702 31.768 20.472 1.00 61.17 C ATOM 974 CG2 ILE A 671 -15.224 33.915 19.167 1.00 59.42 C ATOM 975 CD1 ILE A 671 -15.245 30.889 19.330 1.00 61.41 C ATOM 0 H ILE A 671 -15.101 32.732 23.012 1.00 59.58 H new ATOM 0 HA ILE A 671 -13.629 34.099 21.367 1.00 60.51 H new ATOM 0 HB ILE A 671 -16.230 33.098 20.780 1.00 60.48 H new ATOM 0 HG12 ILE A 671 -13.739 31.838 20.378 1.00 61.17 H new ATOM 0 HG13 ILE A 671 -14.873 31.320 21.315 1.00 61.17 H new ATOM 0 HG21 ILE A 671 -15.682 33.384 18.496 1.00 59.42 H new ATOM 0 HG22 ILE A 671 -15.650 34.784 19.238 1.00 59.42 H new ATOM 0 HG23 ILE A 671 -14.296 34.030 18.909 1.00 59.42 H new ATOM 0 HD11 ILE A 671 -14.820 30.018 19.362 1.00 61.41 H new ATOM 0 HD12 ILE A 671 -16.204 30.785 19.430 1.00 61.41 H new ATOM 0 HD13 ILE A 671 -15.053 31.310 18.478 1.00 61.41 H new ATOM 976 N ALA A 672 -14.430 36.433 21.357 1.00 61.28 N ATOM 977 CA ALA A 672 -14.939 37.792 21.227 1.00 61.91 C ATOM 978 C ALA A 672 -15.760 37.910 19.951 1.00 62.47 C ATOM 979 O ALA A 672 -15.295 37.513 18.886 1.00 62.16 O ATOM 980 CB ALA A 672 -13.784 38.783 21.204 1.00 61.77 C ATOM 0 H ALA A 672 -13.588 36.358 21.200 1.00 61.28 H new ATOM 0 HA ALA A 672 -15.505 37.995 21.988 1.00 61.91 H new ATOM 0 HB1 ALA A 672 -14.132 39.684 21.117 1.00 61.77 H new ATOM 0 HB2 ALA A 672 -13.278 38.710 22.029 1.00 61.77 H new ATOM 0 HB3 ALA A 672 -13.204 38.587 20.451 1.00 61.77 H new ATOM 981 N LYS A 673 -16.976 38.443 20.060 1.00 63.63 N ATOM 982 CA LYS A 673 -17.802 38.673 18.873 1.00 65.04 C ATOM 983 C LYS A 673 -17.159 39.692 17.941 1.00 65.32 C ATOM 984 O LYS A 673 -16.533 40.654 18.388 1.00 65.55 O ATOM 985 CB LYS A 673 -19.218 39.142 19.225 1.00 65.43 C ATOM 986 CG LYS A 673 -20.314 38.515 18.339 1.00 66.15 C ATOM 987 CD LYS A 673 -19.725 37.710 17.136 1.00 67.53 C ATOM 988 CE LYS A 673 -20.709 36.670 16.581 1.00 68.25 C ATOM 989 NZ LYS A 673 -21.967 37.267 15.993 1.00 67.97 N ATOM 0 H LYS A 673 -17.339 38.677 20.804 1.00 63.63 H new ATOM 0 HA LYS A 673 -17.867 37.816 18.424 1.00 65.04 H new ATOM 0 HB2 LYS A 673 -19.401 38.927 20.153 1.00 65.43 H new ATOM 0 HB3 LYS A 673 -19.260 40.108 19.144 1.00 65.43 H new ATOM 0 HG2 LYS A 673 -20.865 37.927 18.879 1.00 66.15 H new ATOM 0 HG3 LYS A 673 -20.894 39.216 18.002 1.00 66.15 H new ATOM 0 HD2 LYS A 673 -19.479 38.326 16.429 1.00 67.53 H new ATOM 0 HD3 LYS A 673 -18.912 37.262 17.418 1.00 67.53 H new ATOM 0 HE2 LYS A 673 -20.261 36.146 15.899 1.00 68.25 H new ATOM 0 HE3 LYS A 673 -20.954 36.058 17.293 1.00 68.25 H new ATOM 0 HZ1 LYS A 673 -22.492 36.615 15.691 1.00 67.97 H new ATOM 0 HZ2 LYS A 673 -22.398 37.728 16.620 1.00 67.97 H new ATOM 0 HZ3 LYS A 673 -21.752 37.810 15.321 1.00 67.97 H new ATOM 990 N SER A 674 -17.311 39.462 16.644 1.00 65.87 N ATOM 991 CA SER A 674 -16.793 40.374 15.630 1.00 66.42 C ATOM 992 C SER A 674 -17.942 41.043 14.884 1.00 66.32 C ATOM 993 O SER A 674 -19.047 40.502 14.823 1.00 66.04 O ATOM 994 CB SER A 674 -15.850 39.637 14.668 1.00 66.42 C ATOM 995 OG SER A 674 -16.465 38.480 14.126 1.00 67.06 O ATOM 0 H SER A 674 -17.717 38.774 16.325 1.00 65.87 H new ATOM 0 HA SER A 674 -16.277 41.069 16.069 1.00 66.42 H new ATOM 0 HB2 SER A 674 -15.588 40.233 13.949 1.00 66.42 H new ATOM 0 HB3 SER A 674 -15.039 39.385 15.137 1.00 66.42 H new ATOM 0 HG SER A 674 -15.930 38.097 13.603 1.00 67.06 H new ATOM 996 N GLU A 675 -17.679 42.228 14.339 1.00 66.81 N ATOM 997 CA GLU A 675 -18.699 42.983 13.599 1.00 67.44 C ATOM 998 C GLU A 675 -18.859 42.408 12.217 1.00 67.48 C ATOM 999 O GLU A 675 -17.882 41.988 11.611 1.00 67.93 O ATOM 1000 CB GLU A 675 -18.326 44.460 13.463 1.00 67.50 C ATOM 1001 CG GLU A 675 -18.350 45.236 14.757 1.00 68.11 C ATOM 1002 CD GLU A 675 -19.655 45.096 15.475 1.00 68.53 C ATOM 1003 OE1 GLU A 675 -20.669 45.583 14.947 1.00 69.96 O ATOM 1004 OE2 GLU A 675 -19.663 44.496 16.564 1.00 69.02 O ATOM 0 H GLU A 675 -16.913 42.617 14.385 1.00 66.81 H new ATOM 0 HA GLU A 675 -19.527 42.914 14.100 1.00 67.44 H new ATOM 0 HB2 GLU A 675 -17.438 44.523 13.078 1.00 67.50 H new ATOM 0 HB3 GLU A 675 -18.937 44.879 12.837 1.00 67.50 H new ATOM 0 HG2 GLU A 675 -17.632 44.927 15.331 1.00 68.11 H new ATOM 0 HG3 GLU A 675 -18.183 46.174 14.573 1.00 68.11 H new ATOM 1005 N PRO A 676 -20.092 42.388 11.703 1.00 67.58 N ATOM 1006 CA PRO A 676 -20.244 41.944 10.327 1.00 67.68 C ATOM 1007 C PRO A 676 -19.289 42.722 9.430 1.00 67.97 C ATOM 1008 O PRO A 676 -19.109 43.923 9.618 1.00 68.07 O ATOM 1009 CB PRO A 676 -21.683 42.322 9.995 1.00 67.67 C ATOM 1010 CG PRO A 676 -22.380 42.408 11.297 1.00 67.56 C ATOM 1011 CD PRO A 676 -21.370 42.766 12.329 1.00 67.57 C ATOM 0 HA PRO A 676 -20.055 41.001 10.203 1.00 67.68 H new ATOM 0 HB2 PRO A 676 -21.722 43.168 9.522 1.00 67.67 H new ATOM 0 HB3 PRO A 676 -22.095 41.657 9.422 1.00 67.67 H new ATOM 0 HG2 PRO A 676 -23.083 43.075 11.263 1.00 67.56 H new ATOM 0 HG3 PRO A 676 -22.802 41.562 11.513 1.00 67.56 H new ATOM 0 HD2 PRO A 676 -21.397 43.712 12.543 1.00 67.57 H new ATOM 0 HD3 PRO A 676 -21.519 42.284 13.157 1.00 67.57 H new ATOM 1012 N ARG A 677 -18.646 42.029 8.500 1.00 68.44 N ATOM 1013 CA ARG A 677 -17.922 42.684 7.413 1.00 69.02 C ATOM 1014 C ARG A 677 -18.923 43.455 6.534 1.00 68.65 C ATOM 1015 O ARG A 677 -20.024 42.964 6.255 1.00 68.46 O ATOM 1016 CB ARG A 677 -17.190 41.626 6.588 1.00 69.18 C ATOM 1017 CG ARG A 677 -16.275 42.175 5.515 1.00 71.35 C ATOM 1018 CD ARG A 677 -16.371 41.326 4.243 1.00 75.26 C ATOM 1019 NE ARG A 677 -15.694 41.974 3.124 1.00 76.90 N ATOM 1020 CZ ARG A 677 -14.433 41.737 2.767 1.00 78.48 C ATOM 1021 NH1 ARG A 677 -13.698 40.838 3.432 1.00 78.45 N ATOM 1022 NH2 ARG A 677 -13.908 42.394 1.734 1.00 77.52 N ATOM 0 H ARG A 677 -18.615 41.170 8.479 1.00 68.44 H new ATOM 0 HA ARG A 677 -17.271 43.308 7.771 1.00 69.02 H new ATOM 0 HB2 ARG A 677 -16.667 41.072 7.188 1.00 69.18 H new ATOM 0 HB3 ARG A 677 -17.848 41.049 6.170 1.00 69.18 H new ATOM 0 HG2 ARG A 677 -16.515 43.094 5.316 1.00 71.35 H new ATOM 0 HG3 ARG A 677 -15.360 42.184 5.836 1.00 71.35 H new ATOM 0 HD2 ARG A 677 -15.976 40.454 4.402 1.00 75.26 H new ATOM 0 HD3 ARG A 677 -17.303 41.179 4.019 1.00 75.26 H new ATOM 0 HE ARG A 677 -16.140 42.548 2.664 1.00 76.90 H new ATOM 0 HH11 ARG A 677 -14.039 40.409 4.095 1.00 78.45 H new ATOM 0 HH12 ARG A 677 -12.884 40.689 3.197 1.00 78.45 H new ATOM 0 HH21 ARG A 677 -14.383 42.967 1.303 1.00 77.52 H new ATOM 0 HH22 ARG A 677 -13.094 42.245 1.499 1.00 77.52 H new ATOM 1023 N ASP A 678 -18.549 44.653 6.097 1.00 68.64 N ATOM 1024 CA ASP A 678 -19.443 45.465 5.253 1.00 68.86 C ATOM 1025 C ASP A 678 -19.323 45.231 3.747 1.00 69.27 C ATOM 1026 O ASP A 678 -18.243 45.347 3.176 1.00 69.52 O ATOM 1027 CB ASP A 678 -19.275 46.947 5.575 1.00 68.53 C ATOM 1028 CG ASP A 678 -20.169 47.387 6.697 1.00 67.53 C ATOM 1029 OD1 ASP A 678 -21.395 47.413 6.495 1.00 65.71 O ATOM 1030 OD2 ASP A 678 -19.647 47.685 7.786 1.00 67.44 O ATOM 0 H ASP A 678 -17.790 45.018 6.272 1.00 68.64 H new ATOM 0 HA ASP A 678 -20.337 45.165 5.479 1.00 68.86 H new ATOM 0 HB2 ASP A 678 -18.351 47.122 5.812 1.00 68.53 H new ATOM 0 HB3 ASP A 678 -19.469 47.473 4.783 1.00 68.53 H new ATOM 1031 N ALA A 679 -20.445 44.933 3.107 1.00 69.98 N ATOM 1032 CA ALA A 679 -20.479 44.688 1.664 1.00 71.18 C ATOM 1033 C ALA A 679 -19.906 45.824 0.817 1.00 72.18 C ATOM 1034 O ALA A 679 -20.489 46.907 0.728 1.00 72.36 O ATOM 1035 CB ALA A 679 -21.890 44.381 1.222 1.00 70.99 C ATOM 0 H ALA A 679 -21.211 44.866 3.493 1.00 69.98 H new ATOM 0 HA ALA A 679 -19.900 43.924 1.514 1.00 71.18 H new ATOM 0 HB1 ALA A 679 -21.902 44.220 0.265 1.00 70.99 H new ATOM 0 HB2 ALA A 679 -22.210 43.592 1.686 1.00 70.99 H new ATOM 0 HB3 ALA A 679 -22.466 45.134 1.430 1.00 70.99 H new ATOM 1036 N GLY A 680 -18.767 45.558 0.186 1.00 73.40 N ATOM 1037 CA GLY A 680 -18.147 46.504 -0.736 1.00 74.75 C ATOM 1038 C GLY A 680 -16.987 47.238 -0.101 1.00 75.97 C ATOM 1039 O GLY A 680 -16.752 48.406 -0.410 1.00 76.27 O ATOM 0 H GLY A 680 -18.331 44.823 0.280 1.00 73.40 H new ATOM 0 HA2 GLY A 680 -17.837 46.030 -1.524 1.00 74.75 H new ATOM 0 HA3 GLY A 680 -18.810 47.146 -1.034 1.00 74.75 H new ATOM 1040 N THR A 681 -16.276 46.551 0.794 1.00 77.05 N ATOM 1041 CA THR A 681 -15.085 47.089 1.470 1.00 78.56 C ATOM 1042 C THR A 681 -13.868 46.134 1.392 1.00 79.80 C ATOM 1043 O THR A 681 -13.919 45.099 0.721 1.00 79.94 O ATOM 1044 CB THR A 681 -15.368 47.483 2.961 1.00 78.56 C ATOM 1045 OG1 THR A 681 -15.687 46.315 3.737 1.00 77.59 O ATOM 1046 CG2 THR A 681 -16.502 48.520 3.056 1.00 78.31 C ATOM 0 H THR A 681 -16.472 45.748 1.031 1.00 77.05 H new ATOM 0 HA THR A 681 -14.859 47.897 0.983 1.00 78.56 H new ATOM 0 HB THR A 681 -14.563 47.886 3.323 1.00 78.56 H new ATOM 0 HG1 THR A 681 -16.466 46.061 3.554 1.00 77.59 H new ATOM 0 HG21 THR A 681 -16.657 48.746 3.986 1.00 78.31 H new ATOM 0 HG22 THR A 681 -16.252 49.319 2.567 1.00 78.31 H new ATOM 0 HG23 THR A 681 -17.313 48.149 2.675 1.00 78.31 H new ATOM 1047 N ASP A 682 -12.795 46.484 2.103 1.00 81.08 N ATOM 1048 CA ASP A 682 -11.461 45.884 1.913 1.00 82.43 C ATOM 1049 C ASP A 682 -11.289 44.435 2.400 1.00 83.12 C ATOM 1050 O ASP A 682 -12.141 43.894 3.116 1.00 83.19 O ATOM 1051 CB ASP A 682 -10.387 46.778 2.563 1.00 82.64 C ATOM 1052 CG ASP A 682 -10.434 48.219 2.064 1.00 83.23 C ATOM 1053 OD1 ASP A 682 -11.548 48.746 1.829 1.00 83.79 O ATOM 1054 OD2 ASP A 682 -9.352 48.828 1.912 1.00 83.90 O ATOM 0 H ASP A 682 -12.817 47.084 2.719 1.00 81.08 H new ATOM 0 HA ASP A 682 -11.355 45.834 0.950 1.00 82.43 H new ATOM 0 HB2 ASP A 682 -10.505 46.770 3.526 1.00 82.64 H new ATOM 0 HB3 ASP A 682 -9.510 46.406 2.382 1.00 82.64 H new ATOM 1055 N GLN A 683 -10.171 43.821 2.004 1.00 83.81 N ATOM 1056 CA GLN A 683 -9.831 42.464 2.432 1.00 84.49 C ATOM 1057 C GLN A 683 -9.323 42.470 3.874 1.00 84.70 C ATOM 1058 O GLN A 683 -9.356 43.501 4.553 1.00 84.95 O ATOM 1059 CB GLN A 683 -8.783 41.833 1.504 1.00 84.51 C ATOM 1060 CG GLN A 683 -9.304 41.417 0.124 1.00 84.53 C ATOM 1061 CD GLN A 683 -8.324 40.518 -0.635 1.00 84.99 C ATOM 1062 OE1 GLN A 683 -7.824 39.523 -0.090 1.00 85.28 O ATOM 1063 NE2 GLN A 683 -8.049 40.863 -1.900 1.00 84.63 N ATOM 0 H GLN A 683 -9.591 44.180 1.481 1.00 83.81 H new ATOM 0 HA GLN A 683 -10.638 41.927 2.384 1.00 84.49 H new ATOM 0 HB2 GLN A 683 -8.056 42.464 1.383 1.00 84.51 H new ATOM 0 HB3 GLN A 683 -8.411 41.052 1.943 1.00 84.51 H new ATOM 0 HG2 GLN A 683 -10.149 40.951 0.229 1.00 84.53 H new ATOM 0 HG3 GLN A 683 -9.482 42.212 -0.403 1.00 84.53 H new ATOM 0 HE21 GLN A 683 -8.415 41.561 -2.245 1.00 84.63 H new ATOM 0 HE22 GLN A 683 -7.506 40.387 -2.367 1.00 84.63 H new ATOM 1064 N GLY A 687 -12.326 46.642 10.644 1.00 78.29 N ATOM 1065 CA GLY A 687 -12.828 47.168 11.913 1.00 78.26 C ATOM 1066 C GLY A 687 -13.754 46.189 12.617 1.00 78.20 C ATOM 1067 O GLY A 687 -14.619 46.595 13.398 1.00 77.98 O ATOM 0 HA2 GLY A 687 -12.079 47.376 12.493 1.00 78.26 H new ATOM 0 HA3 GLY A 687 -13.302 47.999 11.752 1.00 78.26 H new ATOM 1068 N ILE A 688 -13.546 44.897 12.350 1.00 78.12 N ATOM 1069 CA ILE A 688 -14.440 43.817 12.811 1.00 78.13 C ATOM 1070 C ILE A 688 -14.673 43.700 14.344 1.00 77.55 C ATOM 1071 O ILE A 688 -15.810 43.821 14.798 1.00 77.83 O ATOM 1072 CB ILE A 688 -14.087 42.426 12.167 1.00 78.36 C ATOM 1073 CG1 ILE A 688 -12.594 42.089 12.331 1.00 78.92 C ATOM 1074 CG2 ILE A 688 -14.532 42.383 10.689 1.00 78.41 C ATOM 1075 CD1 ILE A 688 -12.228 40.661 11.914 1.00 78.63 C ATOM 0 H ILE A 688 -12.875 44.615 11.891 1.00 78.12 H new ATOM 0 HA ILE A 688 -15.303 44.106 12.476 1.00 78.13 H new ATOM 0 HB ILE A 688 -14.580 41.739 12.642 1.00 78.36 H new ATOM 0 HG12 ILE A 688 -12.071 42.714 11.805 1.00 78.92 H new ATOM 0 HG13 ILE A 688 -12.342 42.220 13.259 1.00 78.92 H new ATOM 0 HG21 ILE A 688 -14.307 41.520 10.308 1.00 78.41 H new ATOM 0 HG22 ILE A 688 -15.491 42.520 10.635 1.00 78.41 H new ATOM 0 HG23 ILE A 688 -14.078 43.083 10.194 1.00 78.41 H new ATOM 0 HD11 ILE A 688 -11.277 40.520 12.043 1.00 78.63 H new ATOM 0 HD12 ILE A 688 -12.725 40.028 12.455 1.00 78.63 H new ATOM 0 HD13 ILE A 688 -12.450 40.530 10.979 1.00 78.63 H new ATOM 1076 N ILE A 689 -13.635 43.487 15.148 1.00 76.40 N ATOM 1077 CA ILE A 689 -13.860 43.442 16.603 1.00 75.38 C ATOM 1078 C ILE A 689 -13.598 44.804 17.280 1.00 74.99 C ATOM 1079 O ILE A 689 -12.487 45.335 17.206 1.00 75.50 O ATOM 1080 CB ILE A 689 -13.084 42.265 17.292 1.00 75.30 C ATOM 1081 CG1 ILE A 689 -13.322 40.954 16.530 1.00 74.97 C ATOM 1082 CG2 ILE A 689 -13.511 42.114 18.735 1.00 74.45 C ATOM 1083 CD1 ILE A 689 -12.609 39.734 17.067 1.00 74.97 C ATOM 0 H ILE A 689 -12.822 43.370 14.892 1.00 76.40 H new ATOM 0 HA ILE A 689 -14.803 43.254 16.730 1.00 75.38 H new ATOM 0 HB ILE A 689 -12.137 42.472 17.273 1.00 75.30 H new ATOM 0 HG12 ILE A 689 -14.275 40.773 16.524 1.00 74.97 H new ATOM 0 HG13 ILE A 689 -13.052 41.084 15.607 1.00 74.97 H new ATOM 0 HG21 ILE A 689 -13.021 41.383 19.143 1.00 74.45 H new ATOM 0 HG22 ILE A 689 -13.324 42.936 19.216 1.00 74.45 H new ATOM 0 HG23 ILE A 689 -14.462 41.927 18.773 1.00 74.45 H new ATOM 0 HD11 ILE A 689 -12.825 38.964 16.518 1.00 74.97 H new ATOM 0 HD12 ILE A 689 -11.651 39.885 17.049 1.00 74.97 H new ATOM 0 HD13 ILE A 689 -12.893 39.569 17.980 1.00 74.97 H new ATOM 1084 N ARG A 690 -14.632 45.368 17.910 1.00 73.83 N ATOM 1085 CA ARG A 690 -14.533 46.619 18.674 1.00 72.83 C ATOM 1086 C ARG A 690 -13.760 46.421 19.969 1.00 72.03 C ATOM 1087 O ARG A 690 -13.758 45.330 20.525 1.00 72.16 O ATOM 1088 CB ARG A 690 -15.926 47.117 19.037 1.00 72.97 C ATOM 1089 CG ARG A 690 -16.815 47.348 17.864 1.00 73.58 C ATOM 1090 CD ARG A 690 -16.832 48.806 17.477 1.00 75.75 C ATOM 1091 NE ARG A 690 -17.768 49.044 16.380 1.00 77.17 N ATOM 1092 CZ ARG A 690 -19.095 48.968 16.481 1.00 77.56 C ATOM 1093 NH1 ARG A 690 -19.675 48.652 17.637 1.00 77.47 N ATOM 1094 NH2 ARG A 690 -19.847 49.206 15.414 1.00 77.92 N ATOM 0 H ARG A 690 -15.423 45.030 17.906 1.00 73.83 H new ATOM 0 HA ARG A 690 -14.068 47.261 18.115 1.00 72.83 H new ATOM 0 HB2 ARG A 690 -16.346 46.471 19.627 1.00 72.97 H new ATOM 0 HB3 ARG A 690 -15.843 47.945 19.536 1.00 72.97 H new ATOM 0 HG2 ARG A 690 -16.511 46.814 17.113 1.00 73.58 H new ATOM 0 HG3 ARG A 690 -17.716 47.055 18.074 1.00 73.58 H new ATOM 0 HD2 ARG A 690 -17.083 49.345 18.244 1.00 75.75 H new ATOM 0 HD3 ARG A 690 -15.941 49.085 17.213 1.00 75.75 H new ATOM 0 HE ARG A 690 -17.438 49.248 15.612 1.00 77.17 H new ATOM 0 HH11 ARG A 690 -19.192 48.494 18.331 1.00 77.47 H new ATOM 0 HH12 ARG A 690 -20.532 48.606 17.690 1.00 77.47 H new ATOM 0 HH21 ARG A 690 -19.478 49.408 14.664 1.00 77.92 H new ATOM 0 HH22 ARG A 690 -20.704 49.159 15.472 1.00 77.92 H new ATOM 1095 N LEU A 691 -13.136 47.484 20.469 1.00 71.16 N ATOM 1096 CA LEU A 691 -12.337 47.400 21.696 1.00 70.15 C ATOM 1097 C LEU A 691 -13.162 47.057 22.953 1.00 69.55 C ATOM 1098 O LEU A 691 -12.707 46.282 23.791 1.00 69.40 O ATOM 1099 CB LEU A 691 -11.490 48.674 21.911 1.00 70.06 C ATOM 1100 CG LEU A 691 -10.355 49.034 20.927 1.00 70.08 C ATOM 1101 CD1 LEU A 691 -9.633 50.366 21.298 1.00 69.00 C ATOM 1102 CD2 LEU A 691 -9.339 47.898 20.768 1.00 69.27 C ATOM 0 H LEU A 691 -13.161 48.267 20.114 1.00 71.16 H new ATOM 0 HA LEU A 691 -11.734 46.652 21.563 1.00 70.15 H new ATOM 0 HB2 LEU A 691 -12.103 49.426 21.929 1.00 70.06 H new ATOM 0 HB3 LEU A 691 -11.094 48.609 22.794 1.00 70.06 H new ATOM 0 HG LEU A 691 -10.790 49.168 20.070 1.00 70.08 H new ATOM 0 HD11 LEU A 691 -8.932 50.545 20.652 1.00 69.00 H new ATOM 0 HD12 LEU A 691 -10.273 51.094 21.290 1.00 69.00 H new ATOM 0 HD13 LEU A 691 -9.244 50.288 22.183 1.00 69.00 H new ATOM 0 HD21 LEU A 691 -8.647 48.167 20.144 1.00 69.27 H new ATOM 0 HD22 LEU A 691 -8.938 47.700 21.629 1.00 69.27 H new ATOM 0 HD23 LEU A 691 -9.788 47.107 20.431 1.00 69.27 H new ATOM 1103 N HIS A 692 -14.365 47.622 23.071 1.00 68.85 N ATOM 1104 CA HIS A 692 -15.239 47.386 24.231 1.00 67.97 C ATOM 1105 C HIS A 692 -15.544 45.905 24.456 1.00 67.02 C ATOM 1106 O HIS A 692 -15.493 45.433 25.586 1.00 66.81 O ATOM 1107 CB HIS A 692 -16.547 48.174 24.096 1.00 68.18 C ATOM 1108 CG HIS A 692 -17.373 48.210 25.349 1.00 69.38 C ATOM 1109 ND1 HIS A 692 -17.071 49.029 26.420 1.00 70.79 N ATOM 1110 CD2 HIS A 692 -18.504 47.546 25.693 1.00 69.92 C ATOM 1111 CE1 HIS A 692 -17.975 48.861 27.371 1.00 70.53 C ATOM 1112 NE2 HIS A 692 -18.855 47.967 26.955 1.00 70.48 N ATOM 0 H HIS A 692 -14.700 48.153 22.483 1.00 68.85 H new ATOM 0 HA HIS A 692 -14.750 47.700 25.008 1.00 67.97 H new ATOM 0 HB2 HIS A 692 -16.339 49.084 23.831 1.00 68.18 H new ATOM 0 HB3 HIS A 692 -17.076 47.784 23.382 1.00 68.18 H new ATOM 0 HD2 HIS A 692 -18.958 46.923 25.173 1.00 69.92 H new ATOM 0 HE1 HIS A 692 -17.989 49.297 28.192 1.00 70.53 H new ATOM 0 HE2 HIS A 692 -19.537 47.693 27.401 1.00 70.48 H new ATOM 1113 N THR A 693 -15.861 45.188 23.380 1.00 66.04 N ATOM 1114 CA THR A 693 -16.110 43.748 23.427 1.00 65.68 C ATOM 1115 C THR A 693 -14.944 42.988 24.093 1.00 65.18 C ATOM 1116 O THR A 693 -15.165 42.121 24.942 1.00 65.05 O ATOM 1117 CB THR A 693 -16.344 43.179 22.004 1.00 65.88 C ATOM 1118 OG1 THR A 693 -17.392 43.907 21.363 1.00 65.92 O ATOM 1119 CG2 THR A 693 -16.715 41.698 22.045 1.00 65.96 C ATOM 0 H THR A 693 -15.938 45.527 22.594 1.00 66.04 H new ATOM 0 HA THR A 693 -16.909 43.619 23.961 1.00 65.68 H new ATOM 0 HB THR A 693 -15.516 43.272 21.507 1.00 65.88 H new ATOM 0 HG1 THR A 693 -17.517 43.599 20.592 1.00 65.92 H new ATOM 0 HG21 THR A 693 -16.854 41.374 21.141 1.00 65.96 H new ATOM 0 HG22 THR A 693 -15.997 41.196 22.461 1.00 65.96 H new ATOM 0 HG23 THR A 693 -17.530 41.582 22.559 1.00 65.96 H new ATOM 1120 N ILE A 694 -13.716 43.328 23.706 1.00 64.33 N ATOM 1121 CA ILE A 694 -12.516 42.734 24.295 1.00 63.85 C ATOM 1122 C ILE A 694 -12.382 43.047 25.791 1.00 63.61 C ATOM 1123 O ILE A 694 -12.015 42.167 26.575 1.00 63.34 O ATOM 1124 CB ILE A 694 -11.230 43.157 23.535 1.00 63.99 C ATOM 1125 CG1 ILE A 694 -11.397 42.933 22.024 1.00 63.49 C ATOM 1126 CG2 ILE A 694 -10.018 42.411 24.075 1.00 63.65 C ATOM 1127 CD1 ILE A 694 -10.220 43.370 21.195 1.00 63.14 C ATOM 0 H ILE A 694 -13.555 43.910 23.094 1.00 64.33 H new ATOM 0 HA ILE A 694 -12.620 41.774 24.205 1.00 63.85 H new ATOM 0 HB ILE A 694 -11.083 44.105 23.680 1.00 63.99 H new ATOM 0 HG12 ILE A 694 -11.558 41.990 21.864 1.00 63.49 H new ATOM 0 HG13 ILE A 694 -12.186 43.411 21.723 1.00 63.49 H new ATOM 0 HG21 ILE A 694 -9.225 42.687 23.589 1.00 63.65 H new ATOM 0 HG22 ILE A 694 -9.907 42.613 25.017 1.00 63.65 H new ATOM 0 HG23 ILE A 694 -10.149 41.456 23.963 1.00 63.65 H new ATOM 0 HD11 ILE A 694 -10.402 43.197 20.258 1.00 63.14 H new ATOM 0 HD12 ILE A 694 -10.068 44.319 21.324 1.00 63.14 H new ATOM 0 HD13 ILE A 694 -9.431 42.876 21.468 1.00 63.14 H new ATOM 1128 N LYS A 695 -12.689 44.293 26.162 1.00 63.30 N ATOM 1129 CA LYS A 695 -12.655 44.759 27.550 1.00 63.37 C ATOM 1130 C LYS A 695 -13.611 43.995 28.450 1.00 63.32 C ATOM 1131 O LYS A 695 -13.263 43.696 29.598 1.00 63.24 O ATOM 1132 CB LYS A 695 -12.992 46.251 27.651 1.00 63.32 C ATOM 1133 CG LYS A 695 -11.846 47.130 28.102 1.00 64.08 C ATOM 1134 CD LYS A 695 -12.348 48.390 28.812 1.00 65.25 C ATOM 1135 CE LYS A 695 -12.965 49.408 27.847 1.00 65.64 C ATOM 1136 NZ LYS A 695 -13.564 50.568 28.574 1.00 66.06 N ATOM 0 H LYS A 695 -12.927 44.901 25.603 1.00 63.30 H new ATOM 0 HA LYS A 695 -11.747 44.601 27.851 1.00 63.37 H new ATOM 0 HB2 LYS A 695 -13.299 46.560 26.784 1.00 63.32 H new ATOM 0 HB3 LYS A 695 -13.731 46.362 28.269 1.00 63.32 H new ATOM 0 HG2 LYS A 695 -11.269 46.629 28.700 1.00 64.08 H new ATOM 0 HG3 LYS A 695 -11.309 47.382 27.334 1.00 64.08 H new ATOM 0 HD2 LYS A 695 -13.008 48.140 29.478 1.00 65.25 H new ATOM 0 HD3 LYS A 695 -11.610 48.805 29.286 1.00 65.25 H new ATOM 0 HE2 LYS A 695 -12.284 49.727 27.234 1.00 65.64 H new ATOM 0 HE3 LYS A 695 -13.648 48.974 27.312 1.00 65.64 H new ATOM 0 HZ1 LYS A 695 -13.913 51.139 27.987 1.00 66.06 H new ATOM 0 HZ2 LYS A 695 -14.204 50.278 29.121 1.00 66.06 H new ATOM 0 HZ3 LYS A 695 -12.933 50.979 29.048 1.00 66.06 H new ATOM 1137 N GLN A 696 -14.810 43.701 27.938 1.00 62.96 N ATOM 1138 CA GLN A 696 -15.796 42.913 28.685 1.00 63.09 C ATOM 1139 C GLN A 696 -15.217 41.550 29.063 1.00 62.44 C ATOM 1140 O GLN A 696 -15.433 41.081 30.174 1.00 62.70 O ATOM 1141 CB GLN A 696 -17.102 42.701 27.898 1.00 63.27 C ATOM 1142 CG GLN A 696 -17.847 43.961 27.456 1.00 65.35 C ATOM 1143 CD GLN A 696 -18.336 44.825 28.615 1.00 67.66 C ATOM 1144 OE1 GLN A 696 -17.572 45.616 29.185 1.00 67.81 O ATOM 1145 NE2 GLN A 696 -19.624 44.697 28.949 1.00 68.34 N ATOM 0 H GLN A 696 -15.072 43.949 27.157 1.00 62.96 H new ATOM 0 HA GLN A 696 -16.006 43.422 29.484 1.00 63.09 H new ATOM 0 HB2 GLN A 696 -16.898 42.176 27.108 1.00 63.27 H new ATOM 0 HB3 GLN A 696 -17.702 42.170 28.444 1.00 63.27 H new ATOM 0 HG2 GLN A 696 -17.262 44.491 26.892 1.00 65.35 H new ATOM 0 HG3 GLN A 696 -18.608 43.703 26.912 1.00 65.35 H new ATOM 0 HE21 GLN A 696 -20.123 44.136 28.530 1.00 68.34 H new ATOM 0 HE22 GLN A 696 -19.953 45.175 29.583 1.00 68.34 H new ATOM 1146 N ILE A 697 -14.488 40.929 28.135 1.00 61.46 N ATOM 1147 CA ILE A 697 -13.931 39.609 28.358 1.00 60.59 C ATOM 1148 C ILE A 697 -12.709 39.711 29.259 1.00 61.17 C ATOM 1149 O ILE A 697 -12.564 38.905 30.184 1.00 61.44 O ATOM 1150 CB ILE A 697 -13.613 38.871 27.028 1.00 60.37 C ATOM 1151 CG1 ILE A 697 -14.900 38.541 26.268 1.00 58.13 C ATOM 1152 CG2 ILE A 697 -12.832 37.578 27.284 1.00 59.01 C ATOM 1153 CD1 ILE A 697 -14.687 38.356 24.788 1.00 54.96 C ATOM 0 H ILE A 697 -14.307 41.265 27.364 1.00 61.46 H new ATOM 0 HA ILE A 697 -14.601 39.069 28.806 1.00 60.59 H new ATOM 0 HB ILE A 697 -13.067 39.467 26.491 1.00 60.37 H new ATOM 0 HG12 ILE A 697 -15.287 37.732 26.636 1.00 58.13 H new ATOM 0 HG13 ILE A 697 -15.543 39.253 26.409 1.00 58.13 H new ATOM 0 HG21 ILE A 697 -12.647 37.139 26.439 1.00 59.01 H new ATOM 0 HG22 ILE A 697 -11.996 37.787 27.729 1.00 59.01 H new ATOM 0 HG23 ILE A 697 -13.358 36.988 27.847 1.00 59.01 H new ATOM 0 HD11 ILE A 697 -15.534 38.150 24.362 1.00 54.96 H new ATOM 0 HD12 ILE A 697 -14.325 39.172 24.409 1.00 54.96 H new ATOM 0 HD13 ILE A 697 -14.065 37.627 24.639 1.00 54.96 H new ATOM 1154 N ILE A 698 -11.846 40.703 29.000 1.00 61.26 N ATOM 1155 CA ILE A 698 -10.658 40.940 29.822 1.00 61.19 C ATOM 1156 C ILE A 698 -11.041 41.127 31.279 1.00 61.51 C ATOM 1157 O ILE A 698 -10.379 40.591 32.172 1.00 61.76 O ATOM 1158 CB ILE A 698 -9.832 42.145 29.330 1.00 61.31 C ATOM 1159 CG1 ILE A 698 -8.931 41.717 28.169 1.00 60.91 C ATOM 1160 CG2 ILE A 698 -8.968 42.738 30.465 1.00 60.79 C ATOM 1161 CD1 ILE A 698 -8.430 42.868 27.315 1.00 60.15 C ATOM 0 H ILE A 698 -11.935 41.253 28.345 1.00 61.26 H new ATOM 0 HA ILE A 698 -10.098 40.152 29.738 1.00 61.19 H new ATOM 0 HB ILE A 698 -10.451 42.830 29.031 1.00 61.31 H new ATOM 0 HG12 ILE A 698 -8.168 41.235 28.525 1.00 60.91 H new ATOM 0 HG13 ILE A 698 -9.419 41.097 27.605 1.00 60.91 H new ATOM 0 HG21 ILE A 698 -8.461 43.492 30.126 1.00 60.79 H new ATOM 0 HG22 ILE A 698 -9.542 43.034 31.188 1.00 60.79 H new ATOM 0 HG23 ILE A 698 -8.357 42.061 30.795 1.00 60.79 H new ATOM 0 HD11 ILE A 698 -7.869 42.523 26.603 1.00 60.15 H new ATOM 0 HD12 ILE A 698 -9.186 43.339 26.930 1.00 60.15 H new ATOM 0 HD13 ILE A 698 -7.915 43.479 27.865 1.00 60.15 H new ATOM 1162 N ASP A 699 -12.126 41.860 31.508 1.00 61.72 N ATOM 1163 CA ASP A 699 -12.586 42.150 32.866 1.00 62.06 C ATOM 1164 C ASP A 699 -13.199 40.943 33.580 1.00 61.91 C ATOM 1165 O ASP A 699 -13.383 40.970 34.799 1.00 62.31 O ATOM 1166 CB ASP A 699 -13.543 43.352 32.881 1.00 62.30 C ATOM 1167 CG ASP A 699 -12.849 44.670 32.500 1.00 63.57 C ATOM 1168 OD1 ASP A 699 -11.761 44.969 33.040 1.00 64.87 O ATOM 1169 OD2 ASP A 699 -13.395 45.417 31.658 1.00 65.23 O ATOM 0 H ASP A 699 -12.614 42.202 30.888 1.00 61.72 H new ATOM 0 HA ASP A 699 -11.791 42.379 33.373 1.00 62.06 H new ATOM 0 HB2 ASP A 699 -14.274 43.186 32.265 1.00 62.30 H new ATOM 0 HB3 ASP A 699 -13.932 43.440 33.765 1.00 62.30 H new ATOM 1170 N GLN A 700 -13.496 39.884 32.831 1.00 61.45 N ATOM 1171 CA GLN A 700 -13.996 38.635 33.417 1.00 61.16 C ATOM 1172 C GLN A 700 -12.895 37.615 33.713 1.00 60.72 C ATOM 1173 O GLN A 700 -13.185 36.428 33.874 1.00 60.65 O ATOM 1174 CB GLN A 700 -14.971 37.966 32.466 1.00 61.27 C ATOM 1175 CG GLN A 700 -16.311 38.612 32.361 1.00 62.61 C ATOM 1176 CD GLN A 700 -17.114 38.009 31.235 1.00 63.80 C ATOM 1177 OE1 GLN A 700 -18.004 37.195 31.467 1.00 65.67 O ATOM 1178 NE2 GLN A 700 -16.789 38.387 30.003 1.00 63.84 N ATOM 0 H GLN A 700 -13.415 39.866 31.975 1.00 61.45 H new ATOM 0 HA GLN A 700 -14.416 38.893 34.253 1.00 61.16 H new ATOM 0 HB2 GLN A 700 -14.571 37.941 31.583 1.00 61.27 H new ATOM 0 HB3 GLN A 700 -15.094 37.046 32.748 1.00 61.27 H new ATOM 0 HG2 GLN A 700 -16.791 38.507 33.197 1.00 62.61 H new ATOM 0 HG3 GLN A 700 -16.204 39.565 32.213 1.00 62.61 H new ATOM 0 HE21 GLN A 700 -16.159 38.960 29.881 1.00 63.84 H new ATOM 0 HE22 GLN A 700 -17.208 38.059 29.328 1.00 63.84 H new ATOM 1179 N ASP A 701 -11.642 38.065 33.760 1.00 60.08 N ATOM 1180 CA ASP A 701 -10.495 37.172 33.938 1.00 59.39 C ATOM 1181 C ASP A 701 -10.456 36.055 32.871 1.00 58.66 C ATOM 1182 O ASP A 701 -10.340 34.872 33.199 1.00 58.45 O ATOM 1183 CB ASP A 701 -10.499 36.585 35.360 1.00 59.58 C ATOM 1184 CG ASP A 701 -9.114 36.197 35.847 1.00 60.21 C ATOM 1185 OD1 ASP A 701 -9.019 35.306 36.713 1.00 61.48 O ATOM 1186 OD2 ASP A 701 -8.119 36.783 35.378 1.00 62.25 O ATOM 0 H ASP A 701 -11.432 38.896 33.690 1.00 60.08 H new ATOM 0 HA ASP A 701 -9.688 37.697 33.819 1.00 59.39 H new ATOM 0 HB2 ASP A 701 -10.881 37.234 35.971 1.00 59.58 H new ATOM 0 HB3 ASP A 701 -11.074 35.804 35.380 1.00 59.58 H new ATOM 1187 N LYS A 702 -10.571 36.434 31.598 1.00 57.42 N ATOM 1188 CA LYS A 702 -10.508 35.462 30.511 1.00 56.30 C ATOM 1189 C LYS A 702 -9.657 35.999 29.393 1.00 55.88 C ATOM 1190 O LYS A 702 -9.486 37.208 29.264 1.00 55.70 O ATOM 1191 CB LYS A 702 -11.898 35.141 29.955 1.00 56.19 C ATOM 1192 CG LYS A 702 -12.749 34.206 30.804 1.00 55.54 C ATOM 1193 CD LYS A 702 -14.209 34.345 30.422 1.00 55.97 C ATOM 1194 CE LYS A 702 -15.080 33.265 31.045 1.00 57.16 C ATOM 1195 NZ LYS A 702 -14.726 33.024 32.470 1.00 56.62 N ATOM 0 H LYS A 702 -10.686 37.248 31.345 1.00 57.42 H new ATOM 0 HA LYS A 702 -10.123 34.649 30.873 1.00 56.30 H new ATOM 0 HB2 LYS A 702 -12.381 35.974 29.837 1.00 56.19 H new ATOM 0 HB3 LYS A 702 -11.793 34.747 29.075 1.00 56.19 H new ATOM 0 HG2 LYS A 702 -12.460 33.289 30.678 1.00 55.54 H new ATOM 0 HG3 LYS A 702 -12.632 34.414 31.744 1.00 55.54 H new ATOM 0 HD2 LYS A 702 -14.531 35.217 30.700 1.00 55.97 H new ATOM 0 HD3 LYS A 702 -14.293 34.307 29.456 1.00 55.97 H new ATOM 0 HE2 LYS A 702 -16.012 33.525 30.983 1.00 57.16 H new ATOM 0 HE3 LYS A 702 -14.982 32.441 30.543 1.00 57.16 H new ATOM 0 HZ1 LYS A 702 -15.388 32.585 32.871 1.00 56.62 H new ATOM 0 HZ2 LYS A 702 -13.981 32.539 32.513 1.00 56.62 H new ATOM 0 HZ3 LYS A 702 -14.597 33.803 32.880 1.00 56.62 H new ATOM 1196 N HIS A 703 -9.122 35.086 28.588 1.00 55.33 N ATOM 1197 CA HIS A 703 -8.486 35.430 27.330 1.00 54.73 C ATOM 1198 C HIS A 703 -9.533 35.583 26.231 1.00 53.77 C ATOM 1199 O HIS A 703 -10.282 34.650 25.957 1.00 53.76 O ATOM 1200 CB HIS A 703 -7.504 34.328 26.944 1.00 54.76 C ATOM 1201 CG HIS A 703 -6.245 34.336 27.751 1.00 56.91 C ATOM 1202 ND1 HIS A 703 -5.180 35.163 27.457 1.00 57.67 N ATOM 1203 CD2 HIS A 703 -5.876 33.619 28.843 1.00 57.07 C ATOM 1204 CE1 HIS A 703 -4.208 34.949 28.329 1.00 57.80 C ATOM 1205 NE2 HIS A 703 -4.606 34.019 29.179 1.00 57.98 N ATOM 0 H HIS A 703 -9.120 34.244 28.762 1.00 55.33 H new ATOM 0 HA HIS A 703 -8.015 36.271 27.434 1.00 54.73 H new ATOM 0 HB2 HIS A 703 -7.939 33.467 27.047 1.00 54.76 H new ATOM 0 HB3 HIS A 703 -7.278 34.421 26.005 1.00 54.76 H new ATOM 0 HD1 HIS A 703 -5.152 35.728 26.809 1.00 57.67 H new ATOM 0 HD2 HIS A 703 -6.387 32.977 29.281 1.00 57.07 H new ATOM 0 HE1 HIS A 703 -3.384 35.380 28.341 1.00 57.80 H new ATOM 1206 N ALA A 704 -9.596 36.753 25.610 1.00 53.49 N ATOM 1207 CA ALA A 704 -10.442 36.937 24.416 1.00 53.79 C ATOM 1208 C ALA A 704 -9.835 36.262 23.182 1.00 53.88 C ATOM 1209 O ALA A 704 -8.705 36.576 22.765 1.00 54.00 O ATOM 1210 CB ALA A 704 -10.682 38.415 24.139 1.00 53.51 C ATOM 0 H ALA A 704 -9.163 37.455 25.855 1.00 53.49 H new ATOM 0 HA ALA A 704 -11.294 36.512 24.603 1.00 53.79 H new ATOM 0 HB1 ALA A 704 -11.240 38.510 23.351 1.00 53.51 H new ATOM 0 HB2 ALA A 704 -11.127 38.819 24.900 1.00 53.51 H new ATOM 0 HB3 ALA A 704 -9.832 38.858 23.989 1.00 53.51 H new ATOM 1211 N LEU A 705 -10.578 35.326 22.606 1.00 53.83 N ATOM 1212 CA LEU A 705 -10.181 34.728 21.336 1.00 53.86 C ATOM 1213 C LEU A 705 -10.645 35.625 20.220 1.00 54.14 C ATOM 1214 O LEU A 705 -11.820 35.915 20.129 1.00 54.72 O ATOM 1215 CB LEU A 705 -10.764 33.317 21.191 1.00 53.49 C ATOM 1216 CG LEU A 705 -10.035 32.270 22.028 1.00 52.70 C ATOM 1217 CD1 LEU A 705 -10.685 30.898 21.920 1.00 53.83 C ATOM 1218 CD2 LEU A 705 -8.566 32.190 21.623 1.00 52.44 C ATOM 0 H LEU A 705 -11.314 35.023 22.932 1.00 53.83 H new ATOM 0 HA LEU A 705 -9.215 34.642 21.301 1.00 53.86 H new ATOM 0 HB2 LEU A 705 -11.699 33.333 21.448 1.00 53.49 H new ATOM 0 HB3 LEU A 705 -10.731 33.055 20.258 1.00 53.49 H new ATOM 0 HG LEU A 705 -10.096 32.550 22.955 1.00 52.70 H new ATOM 0 HD11 LEU A 705 -10.194 30.263 22.464 1.00 53.83 H new ATOM 0 HD12 LEU A 705 -11.602 30.949 22.232 1.00 53.83 H new ATOM 0 HD13 LEU A 705 -10.674 30.606 20.995 1.00 53.83 H new ATOM 0 HD21 LEU A 705 -8.117 31.521 22.163 1.00 52.44 H new ATOM 0 HD22 LEU A 705 -8.501 31.945 20.687 1.00 52.44 H new ATOM 0 HD23 LEU A 705 -8.145 33.053 21.761 1.00 52.44 H new ATOM 1219 N LEU A 706 -9.717 36.085 19.390 1.00 55.38 N ATOM 1220 CA LEU A 706 -10.028 37.025 18.290 1.00 56.30 C ATOM 1221 C LEU A 706 -9.914 36.413 16.881 1.00 57.03 C ATOM 1222 O LEU A 706 -8.893 35.856 16.501 1.00 57.85 O ATOM 1223 CB LEU A 706 -9.160 38.287 18.381 1.00 55.68 C ATOM 1224 CG LEU A 706 -9.148 39.064 19.707 1.00 55.63 C ATOM 1225 CD1 LEU A 706 -8.221 40.260 19.609 1.00 54.38 C ATOM 1226 CD2 LEU A 706 -10.501 39.519 20.110 1.00 53.54 C ATOM 0 H LEU A 706 -8.886 35.868 19.440 1.00 55.38 H new ATOM 0 HA LEU A 706 -10.962 37.256 18.413 1.00 56.30 H new ATOM 0 HB2 LEU A 706 -8.246 38.034 18.177 1.00 55.68 H new ATOM 0 HB3 LEU A 706 -9.448 38.896 17.683 1.00 55.68 H new ATOM 0 HG LEU A 706 -8.828 38.452 20.388 1.00 55.63 H new ATOM 0 HD11 LEU A 706 -8.223 40.741 20.451 1.00 54.38 H new ATOM 0 HD12 LEU A 706 -7.321 39.957 19.412 1.00 54.38 H new ATOM 0 HD13 LEU A 706 -8.526 40.849 18.901 1.00 54.38 H new ATOM 0 HD21 LEU A 706 -10.443 40.003 20.949 1.00 53.54 H new ATOM 0 HD22 LEU A 706 -10.864 40.102 19.425 1.00 53.54 H new ATOM 0 HD23 LEU A 706 -11.082 38.750 20.220 1.00 53.54 H new ATOM 1227 N ASP A 707 -10.980 36.503 16.111 1.00 58.35 N ATOM 1228 CA ASP A 707 -10.920 36.107 14.716 1.00 59.50 C ATOM 1229 C ASP A 707 -10.681 37.362 13.885 1.00 59.75 C ATOM 1230 O ASP A 707 -11.627 38.013 13.418 1.00 60.45 O ATOM 1231 CB ASP A 707 -12.211 35.423 14.282 1.00 59.55 C ATOM 1232 CG ASP A 707 -12.141 34.915 12.857 1.00 60.87 C ATOM 1233 OD1 ASP A 707 -11.041 34.962 12.263 1.00 61.37 O ATOM 1234 OD2 ASP A 707 -13.187 34.459 12.334 1.00 63.21 O ATOM 0 H ASP A 707 -11.747 36.790 16.373 1.00 58.35 H new ATOM 0 HA ASP A 707 -10.200 35.470 14.587 1.00 59.50 H new ATOM 0 HB2 ASP A 707 -12.398 34.682 14.879 1.00 59.55 H new ATOM 0 HB3 ASP A 707 -12.949 36.047 14.365 1.00 59.55 H new ATOM 1235 N VAL A 708 -9.411 37.696 13.715 1.00 59.61 N ATOM 1236 CA VAL A 708 -9.029 38.953 13.094 1.00 59.65 C ATOM 1237 C VAL A 708 -7.927 38.820 12.046 1.00 59.73 C ATOM 1238 O VAL A 708 -7.323 37.771 11.847 1.00 60.09 O ATOM 1239 CB VAL A 708 -8.589 40.035 14.142 1.00 59.57 C ATOM 1240 CG1 VAL A 708 -9.736 40.410 15.063 1.00 59.87 C ATOM 1241 CG2 VAL A 708 -7.350 39.601 14.917 1.00 58.34 C ATOM 0 H VAL A 708 -8.749 37.203 13.955 1.00 59.61 H new ATOM 0 HA VAL A 708 -9.840 39.241 12.646 1.00 59.65 H new ATOM 0 HB VAL A 708 -8.344 40.834 13.650 1.00 59.57 H new ATOM 0 HG11 VAL A 708 -9.436 41.079 15.698 1.00 59.87 H new ATOM 0 HG12 VAL A 708 -10.468 40.769 14.538 1.00 59.87 H new ATOM 0 HG13 VAL A 708 -10.038 39.622 15.542 1.00 59.87 H new ATOM 0 HG21 VAL A 708 -7.108 40.292 15.553 1.00 58.34 H new ATOM 0 HG22 VAL A 708 -7.537 38.776 15.392 1.00 58.34 H new ATOM 0 HG23 VAL A 708 -6.615 39.459 14.300 1.00 58.34 H new ATOM 1242 N THR A 709 -7.658 39.951 11.428 1.00 60.07 N ATOM 1243 CA THR A 709 -6.812 40.090 10.277 1.00 59.87 C ATOM 1244 C THR A 709 -5.402 40.513 10.736 1.00 59.68 C ATOM 1245 O THR A 709 -5.237 41.103 11.830 1.00 59.86 O ATOM 1246 CB THR A 709 -7.474 41.144 9.388 1.00 59.91 C ATOM 1247 OG1 THR A 709 -7.259 40.839 8.015 1.00 62.22 O ATOM 1248 CG2 THR A 709 -7.009 42.542 9.722 1.00 59.62 C ATOM 0 H THR A 709 -7.987 40.702 11.689 1.00 60.07 H new ATOM 0 HA THR A 709 -6.709 39.262 9.782 1.00 59.87 H new ATOM 0 HB THR A 709 -8.428 41.121 9.562 1.00 59.91 H new ATOM 0 HG1 THR A 709 -7.628 41.423 7.537 1.00 62.22 H new ATOM 0 HG21 THR A 709 -7.451 43.178 9.138 1.00 59.62 H new ATOM 0 HG22 THR A 709 -7.228 42.744 10.645 1.00 59.62 H new ATOM 0 HG23 THR A 709 -6.049 42.602 9.598 1.00 59.62 H new ATOM 1249 N PRO A 710 -4.364 40.176 9.944 1.00 58.90 N ATOM 1250 CA PRO A 710 -3.066 40.637 10.403 1.00 58.25 C ATOM 1251 C PRO A 710 -3.054 42.135 10.718 1.00 57.68 C ATOM 1252 O PRO A 710 -2.517 42.534 11.746 1.00 58.20 O ATOM 1253 CB PRO A 710 -2.142 40.256 9.246 1.00 58.14 C ATOM 1254 CG PRO A 710 -2.790 39.033 8.700 1.00 57.87 C ATOM 1255 CD PRO A 710 -4.243 39.378 8.711 1.00 58.51 C ATOM 0 HA PRO A 710 -2.793 40.238 11.244 1.00 58.25 H new ATOM 0 HB2 PRO A 710 -2.086 40.961 8.582 1.00 58.14 H new ATOM 0 HB3 PRO A 710 -1.238 40.080 9.550 1.00 58.14 H new ATOM 0 HG2 PRO A 710 -2.477 38.832 7.804 1.00 57.87 H new ATOM 0 HG3 PRO A 710 -2.603 38.254 9.247 1.00 57.87 H new ATOM 0 HD2 PRO A 710 -4.501 39.884 7.925 1.00 58.51 H new ATOM 0 HD3 PRO A 710 -4.803 38.586 8.735 1.00 58.51 H new ATOM 1256 N ASN A 711 -3.681 42.944 9.876 1.00 57.19 N ATOM 1257 CA ASN A 711 -3.771 44.391 10.105 1.00 56.67 C ATOM 1258 C ASN A 711 -4.466 44.817 11.403 1.00 55.78 C ATOM 1259 O ASN A 711 -4.076 45.810 12.024 1.00 55.45 O ATOM 1260 CB ASN A 711 -4.439 45.061 8.912 1.00 56.91 C ATOM 1261 CG ASN A 711 -3.468 45.344 7.791 1.00 58.75 C ATOM 1262 OD1 ASN A 711 -3.867 45.475 6.627 1.00 61.57 O ATOM 1263 ND2 ASN A 711 -2.182 45.451 8.129 1.00 58.84 N ATOM 0 H ASN A 711 -4.067 42.677 9.156 1.00 57.19 H new ATOM 0 HA ASN A 711 -2.853 44.687 10.207 1.00 56.67 H new ATOM 0 HB2 ASN A 711 -5.152 44.492 8.583 1.00 56.91 H new ATOM 0 HB3 ASN A 711 -4.849 45.892 9.199 1.00 56.91 H new ATOM 0 HD21 ASN A 711 -1.591 45.618 7.526 1.00 58.84 H new ATOM 0 HD22 ASN A 711 -1.943 45.353 8.949 1.00 58.84 H new ATOM 1264 N ALA A 712 -5.497 44.072 11.798 1.00 54.75 N ATOM 1265 CA ALA A 712 -6.112 44.261 13.103 1.00 54.06 C ATOM 1266 C ALA A 712 -5.085 44.037 14.235 1.00 53.64 C ATOM 1267 O ALA A 712 -5.041 44.816 15.191 1.00 53.19 O ATOM 1268 CB ALA A 712 -7.331 43.361 13.266 1.00 53.54 C ATOM 0 H ALA A 712 -5.854 43.451 11.322 1.00 54.75 H new ATOM 0 HA ALA A 712 -6.417 45.180 13.164 1.00 54.06 H new ATOM 0 HB1 ALA A 712 -7.724 43.504 14.141 1.00 53.54 H new ATOM 0 HB2 ALA A 712 -7.984 43.573 12.581 1.00 53.54 H new ATOM 0 HB3 ALA A 712 -7.062 42.433 13.180 1.00 53.54 H new ATOM 1269 N VAL A 713 -4.256 42.997 14.111 1.00 53.25 N ATOM 1270 CA VAL A 713 -3.206 42.721 15.099 1.00 53.49 C ATOM 1271 C VAL A 713 -2.214 43.887 15.236 1.00 53.95 C ATOM 1272 O VAL A 713 -1.969 44.401 16.331 1.00 53.89 O ATOM 1273 CB VAL A 713 -2.462 41.400 14.787 1.00 53.66 C ATOM 1274 CG1 VAL A 713 -1.215 41.222 15.697 1.00 53.73 C ATOM 1275 CG2 VAL A 713 -3.402 40.201 14.920 1.00 52.23 C ATOM 0 H VAL A 713 -4.285 42.437 13.459 1.00 53.25 H new ATOM 0 HA VAL A 713 -3.653 42.620 15.954 1.00 53.49 H new ATOM 0 HB VAL A 713 -2.154 41.447 13.868 1.00 53.66 H new ATOM 0 HG11 VAL A 713 -0.771 40.388 15.478 1.00 53.73 H new ATOM 0 HG12 VAL A 713 -0.602 41.961 15.555 1.00 53.73 H new ATOM 0 HG13 VAL A 713 -1.492 41.206 16.626 1.00 53.73 H new ATOM 0 HG21 VAL A 713 -2.917 39.385 14.721 1.00 52.23 H new ATOM 0 HG22 VAL A 713 -3.746 40.159 15.826 1.00 52.23 H new ATOM 0 HG23 VAL A 713 -4.140 40.298 14.298 1.00 52.23 H new ATOM 1276 N ASP A 714 -1.657 44.302 14.108 1.00 54.54 N ATOM 1277 CA ASP A 714 -0.869 45.523 14.017 1.00 55.28 C ATOM 1278 C ASP A 714 -1.511 46.686 14.784 1.00 54.61 C ATOM 1279 O ASP A 714 -0.854 47.335 15.611 1.00 54.26 O ATOM 1280 CB ASP A 714 -0.727 45.911 12.546 1.00 56.08 C ATOM 1281 CG ASP A 714 0.680 46.333 12.187 1.00 59.61 C ATOM 1282 OD1 ASP A 714 1.088 47.462 12.565 1.00 61.73 O ATOM 1283 OD2 ASP A 714 1.371 45.526 11.502 1.00 64.51 O ATOM 0 H ASP A 714 -1.726 43.877 13.363 1.00 54.54 H new ATOM 0 HA ASP A 714 -0.003 45.350 14.417 1.00 55.28 H new ATOM 0 HB2 ASP A 714 -0.987 45.159 11.991 1.00 56.08 H new ATOM 0 HB3 ASP A 714 -1.339 46.636 12.346 1.00 56.08 H new ATOM 1284 N ARG A 715 -2.790 46.938 14.498 1.00 53.80 N ATOM 1285 CA ARG A 715 -3.543 48.006 15.159 1.00 53.75 C ATOM 1286 C ARG A 715 -3.708 47.768 16.656 1.00 52.75 C ATOM 1287 O ARG A 715 -3.589 48.700 17.459 1.00 52.89 O ATOM 1288 CB ARG A 715 -4.892 48.274 14.464 1.00 53.29 C ATOM 1289 CG ARG A 715 -4.734 49.120 13.194 1.00 54.08 C ATOM 1290 CD ARG A 715 -6.056 49.361 12.472 1.00 55.29 C ATOM 1291 NE ARG A 715 -6.634 48.101 12.018 1.00 60.54 N ATOM 1292 CZ ARG A 715 -7.923 47.906 11.751 1.00 63.31 C ATOM 1293 NH1 ARG A 715 -8.798 48.909 11.874 1.00 65.72 N ATOM 1294 NH2 ARG A 715 -8.342 46.698 11.366 1.00 63.33 N ATOM 0 H ARG A 715 -3.244 46.496 13.917 1.00 53.80 H new ATOM 0 HA ARG A 715 -3.011 48.812 15.069 1.00 53.75 H new ATOM 0 HB2 ARG A 715 -5.310 47.429 14.237 1.00 53.29 H new ATOM 0 HB3 ARG A 715 -5.487 48.728 15.081 1.00 53.29 H new ATOM 0 HG2 ARG A 715 -4.338 49.974 13.427 1.00 54.08 H new ATOM 0 HG3 ARG A 715 -4.117 48.677 12.590 1.00 54.08 H new ATOM 0 HD2 ARG A 715 -6.677 49.811 13.066 1.00 55.29 H new ATOM 0 HD3 ARG A 715 -5.913 49.948 11.713 1.00 55.29 H new ATOM 0 HE ARG A 715 -6.101 47.434 11.915 1.00 60.54 H new ATOM 0 HH11 ARG A 715 -8.529 49.686 12.127 1.00 65.72 H new ATOM 0 HH12 ARG A 715 -9.630 48.778 11.700 1.00 65.72 H new ATOM 0 HH21 ARG A 715 -7.780 46.051 11.292 1.00 63.33 H new ATOM 0 HH22 ARG A 715 -9.174 46.567 11.192 1.00 63.33 H new ATOM 1295 N LEU A 716 -3.934 46.520 17.034 1.00 51.77 N ATOM 1296 CA LEU A 716 -4.011 46.189 18.446 1.00 51.61 C ATOM 1297 C LEU A 716 -2.676 46.427 19.147 1.00 50.89 C ATOM 1298 O LEU A 716 -2.644 46.931 20.273 1.00 50.46 O ATOM 1299 CB LEU A 716 -4.505 44.755 18.659 1.00 51.41 C ATOM 1300 CG LEU A 716 -6.019 44.617 18.488 1.00 51.82 C ATOM 1301 CD1 LEU A 716 -6.394 43.149 18.186 1.00 51.90 C ATOM 1302 CD2 LEU A 716 -6.787 45.155 19.698 1.00 50.41 C ATOM 0 H LEU A 716 -4.044 45.858 16.497 1.00 51.77 H new ATOM 0 HA LEU A 716 -4.663 46.784 18.849 1.00 51.61 H new ATOM 0 HB2 LEU A 716 -4.058 44.167 18.030 1.00 51.41 H new ATOM 0 HB3 LEU A 716 -4.256 44.461 19.549 1.00 51.41 H new ATOM 0 HG LEU A 716 -6.282 45.162 17.730 1.00 51.82 H new ATOM 0 HD11 LEU A 716 -7.355 43.076 18.080 1.00 51.90 H new ATOM 0 HD12 LEU A 716 -5.956 42.865 17.368 1.00 51.90 H new ATOM 0 HD13 LEU A 716 -6.106 42.584 18.920 1.00 51.90 H new ATOM 0 HD21 LEU A 716 -7.740 45.049 19.550 1.00 50.41 H new ATOM 0 HD22 LEU A 716 -6.527 44.662 20.492 1.00 50.41 H new ATOM 0 HD23 LEU A 716 -6.582 46.095 19.820 1.00 50.41 H new ATOM 1303 N ASN A 717 -1.586 46.092 18.464 1.00 50.24 N ATOM 1304 CA ASN A 717 -0.250 46.417 18.957 1.00 50.23 C ATOM 1305 C ASN A 717 -0.062 47.922 19.176 1.00 50.21 C ATOM 1306 O ASN A 717 0.448 48.343 20.212 1.00 50.25 O ATOM 1307 CB ASN A 717 0.841 45.850 18.038 1.00 49.68 C ATOM 1308 CG ASN A 717 0.912 44.324 18.068 1.00 49.22 C ATOM 1309 OD1 ASN A 717 0.392 43.657 18.987 1.00 47.53 O ATOM 1310 ND2 ASN A 717 1.558 43.761 17.048 1.00 46.15 N ATOM 0 H ASN A 717 -1.598 45.675 17.712 1.00 50.24 H new ATOM 0 HA ASN A 717 -0.161 45.991 19.824 1.00 50.23 H new ATOM 0 HB2 ASN A 717 0.675 46.143 17.128 1.00 49.68 H new ATOM 0 HB3 ASN A 717 1.701 46.214 18.302 1.00 49.68 H new ATOM 0 HD21 ASN A 717 1.630 42.905 17.004 1.00 46.15 H new ATOM 0 HD22 ASN A 717 1.903 44.253 16.433 1.00 46.15 H new ATOM 1311 N TYR A 718 -0.509 48.720 18.212 1.00 50.54 N ATOM 1312 CA TYR A 718 -0.414 50.177 18.292 1.00 50.87 C ATOM 1313 C TYR A 718 -1.227 50.788 19.434 1.00 51.15 C ATOM 1314 O TYR A 718 -0.790 51.750 20.062 1.00 50.83 O ATOM 1315 CB TYR A 718 -0.807 50.821 16.958 1.00 50.95 C ATOM 1316 CG TYR A 718 -0.558 52.307 16.911 1.00 50.95 C ATOM 1317 CD1 TYR A 718 0.743 52.806 16.835 1.00 51.55 C ATOM 1318 CD2 TYR A 718 -1.616 53.222 16.961 1.00 51.03 C ATOM 1319 CE1 TYR A 718 0.991 54.173 16.806 1.00 50.87 C ATOM 1320 CE2 TYR A 718 -1.374 54.605 16.931 1.00 50.76 C ATOM 1321 CZ TYR A 718 -0.065 55.064 16.851 1.00 51.04 C ATOM 1322 OH TYR A 718 0.210 56.414 16.805 1.00 51.92 O ATOM 0 H TYR A 718 -0.877 48.432 17.490 1.00 50.54 H new ATOM 0 HA TYR A 718 0.517 50.370 18.487 1.00 50.87 H new ATOM 0 HB2 TYR A 718 -0.310 50.394 16.242 1.00 50.95 H new ATOM 0 HB3 TYR A 718 -1.747 50.652 16.790 1.00 50.95 H new ATOM 0 HD1 TYR A 718 1.458 52.212 16.803 1.00 51.55 H new ATOM 0 HD2 TYR A 718 -2.490 52.910 17.015 1.00 51.03 H new ATOM 0 HE1 TYR A 718 1.865 54.488 16.756 1.00 50.87 H new ATOM 0 HE2 TYR A 718 -2.082 55.207 16.964 1.00 50.76 H new ATOM 0 HH TYR A 718 -0.509 56.848 16.838 1.00 51.92 H new ATOM 1323 N ALA A 719 -2.405 50.227 19.700 1.00 51.65 N ATOM 1324 CA ALA A 719 -3.249 50.707 20.799 1.00 52.14 C ATOM 1325 C ALA A 719 -2.840 50.142 22.172 1.00 52.55 C ATOM 1326 O ALA A 719 -3.540 50.347 23.165 1.00 52.51 O ATOM 1327 CB ALA A 719 -4.719 50.422 20.497 1.00 51.90 C ATOM 0 H ALA A 719 -2.736 49.568 19.258 1.00 51.65 H new ATOM 0 HA ALA A 719 -3.117 51.666 20.860 1.00 52.14 H new ATOM 0 HB1 ALA A 719 -5.268 50.743 21.229 1.00 51.90 H new ATOM 0 HB2 ALA A 719 -4.975 50.875 19.679 1.00 51.90 H new ATOM 0 HB3 ALA A 719 -4.848 49.467 20.391 1.00 51.90 H new ATOM 1328 N GLN A 720 -1.704 49.440 22.210 1.00 53.28 N ATOM 1329 CA GLN A 720 -1.129 48.851 23.441 1.00 54.23 C ATOM 1330 C GLN A 720 -1.896 47.650 24.004 1.00 54.51 C ATOM 1331 O GLN A 720 -1.830 47.381 25.206 1.00 54.55 O ATOM 1332 CB GLN A 720 -0.910 49.899 24.550 1.00 54.14 C ATOM 1333 CG GLN A 720 -0.148 51.157 24.114 1.00 56.36 C ATOM 1334 CD GLN A 720 1.306 50.884 23.744 1.00 58.18 C ATOM 1335 OE1 GLN A 720 2.186 50.821 24.615 1.00 58.96 O ATOM 1336 NE2 GLN A 720 1.567 50.741 22.445 1.00 57.77 N ATOM 0 H GLN A 720 -1.231 49.286 21.509 1.00 53.28 H new ATOM 0 HA GLN A 720 -0.269 48.513 23.147 1.00 54.23 H new ATOM 0 HB2 GLN A 720 -1.775 50.166 24.899 1.00 54.14 H new ATOM 0 HB3 GLN A 720 -0.426 49.481 25.280 1.00 54.14 H new ATOM 0 HG2 GLN A 720 -0.600 51.554 23.353 1.00 56.36 H new ATOM 0 HG3 GLN A 720 -0.176 51.809 24.832 1.00 56.36 H new ATOM 0 HE21 GLN A 720 0.929 50.791 21.870 1.00 57.77 H new ATOM 0 HE22 GLN A 720 2.373 50.599 22.182 1.00 57.77 H new ATOM 1337 N TRP A 721 -2.595 46.914 23.142 1.00 54.88 N ATOM 1338 CA TRP A 721 -3.400 45.773 23.594 1.00 55.30 C ATOM 1339 C TRP A 721 -2.644 44.461 23.441 1.00 55.33 C ATOM 1340 O TRP A 721 -3.063 43.429 23.958 1.00 55.85 O ATOM 1341 CB TRP A 721 -4.761 45.740 22.887 1.00 55.73 C ATOM 1342 CG TRP A 721 -5.688 46.831 23.373 1.00 56.95 C ATOM 1343 CD1 TRP A 721 -5.487 48.185 23.278 1.00 57.43 C ATOM 1344 CD2 TRP A 721 -6.947 46.664 24.035 1.00 58.02 C ATOM 1345 NE1 TRP A 721 -6.537 48.867 23.841 1.00 58.06 N ATOM 1346 CE2 TRP A 721 -7.448 47.963 24.314 1.00 58.01 C ATOM 1347 CE3 TRP A 721 -7.700 45.548 24.425 1.00 57.54 C ATOM 1348 CZ2 TRP A 721 -8.670 48.173 24.958 1.00 57.05 C ATOM 1349 CZ3 TRP A 721 -8.916 45.759 25.066 1.00 57.20 C ATOM 1350 CH2 TRP A 721 -9.390 47.061 25.323 1.00 57.14 C ATOM 0 H TRP A 721 -2.619 47.056 22.294 1.00 54.88 H new ATOM 0 HA TRP A 721 -3.572 45.889 24.542 1.00 55.30 H new ATOM 0 HB2 TRP A 721 -4.628 45.834 21.931 1.00 55.73 H new ATOM 0 HB3 TRP A 721 -5.178 44.876 23.032 1.00 55.73 H new ATOM 0 HD1 TRP A 721 -4.744 48.585 22.887 1.00 57.43 H new ATOM 0 HE1 TRP A 721 -6.610 49.723 23.889 1.00 58.06 H new ATOM 0 HE3 TRP A 721 -7.393 44.686 24.259 1.00 57.54 H new ATOM 0 HZ2 TRP A 721 -8.984 49.031 25.133 1.00 57.05 H new ATOM 0 HZ3 TRP A 721 -9.426 45.027 25.330 1.00 57.20 H new ATOM 0 HH2 TRP A 721 -10.209 47.170 25.750 1.00 57.14 H new ATOM 1351 N TYR A 722 -1.514 44.524 22.746 1.00 55.06 N ATOM 1352 CA TYR A 722 -0.567 43.405 22.586 1.00 54.81 C ATOM 1353 C TYR A 722 -1.119 41.993 22.698 1.00 54.13 C ATOM 1354 O TYR A 722 -0.898 41.323 23.691 1.00 53.74 O ATOM 1355 CB TYR A 722 0.641 43.590 23.508 1.00 54.84 C ATOM 1356 CG TYR A 722 1.353 44.899 23.247 1.00 55.73 C ATOM 1357 CD1 TYR A 722 1.318 45.932 24.187 1.00 54.57 C ATOM 1358 CD2 TYR A 722 2.032 45.117 22.042 1.00 55.90 C ATOM 1359 CE1 TYR A 722 1.957 47.133 23.947 1.00 55.38 C ATOM 1360 CE2 TYR A 722 2.677 46.329 21.793 1.00 56.42 C ATOM 1361 CZ TYR A 722 2.629 47.331 22.747 1.00 55.68 C ATOM 1362 OH TYR A 722 3.260 48.531 22.514 1.00 56.03 O ATOM 0 H TYR A 722 -1.262 45.238 22.339 1.00 55.06 H new ATOM 0 HA TYR A 722 -0.310 43.463 21.653 1.00 54.81 H new ATOM 0 HB2 TYR A 722 0.350 43.559 24.433 1.00 54.84 H new ATOM 0 HB3 TYR A 722 1.260 42.854 23.381 1.00 54.84 H new ATOM 0 HD1 TYR A 722 0.858 45.809 24.986 1.00 54.57 H new ATOM 0 HD2 TYR A 722 2.053 44.445 21.399 1.00 55.90 H new ATOM 0 HE1 TYR A 722 1.937 47.807 24.587 1.00 55.38 H new ATOM 0 HE2 TYR A 722 3.134 46.462 20.994 1.00 56.42 H new ATOM 0 HH TYR A 722 3.624 48.514 21.757 1.00 56.03 H new ATOM 1363 N PRO A 723 -1.820 41.533 21.654 1.00 53.81 N ATOM 1364 CA PRO A 723 -2.327 40.171 21.621 1.00 53.45 C ATOM 1365 C PRO A 723 -1.208 39.144 21.638 1.00 53.32 C ATOM 1366 O PRO A 723 -0.071 39.448 21.219 1.00 52.50 O ATOM 1367 CB PRO A 723 -3.045 40.098 20.272 1.00 53.67 C ATOM 1368 CG PRO A 723 -2.438 41.174 19.442 1.00 53.08 C ATOM 1369 CD PRO A 723 -2.168 42.271 20.429 1.00 53.90 C ATOM 0 HA PRO A 723 -2.886 39.978 22.390 1.00 53.45 H new ATOM 0 HB2 PRO A 723 -2.925 39.228 19.859 1.00 53.67 H new ATOM 0 HB3 PRO A 723 -4.000 40.234 20.376 1.00 53.67 H new ATOM 0 HG2 PRO A 723 -1.623 40.874 19.010 1.00 53.08 H new ATOM 0 HG3 PRO A 723 -3.040 41.466 18.740 1.00 53.08 H new ATOM 0 HD2 PRO A 723 -1.443 42.846 20.138 1.00 53.90 H new ATOM 0 HD3 PRO A 723 -2.945 42.837 20.559 1.00 53.90 H new ATOM 1370 N ILE A 724 -1.539 37.954 22.153 1.00 52.92 N ATOM 1371 CA ILE A 724 -0.717 36.778 21.973 1.00 52.61 C ATOM 1372 C ILE A 724 -1.083 36.266 20.589 1.00 52.35 C ATOM 1373 O ILE A 724 -2.232 36.008 20.335 1.00 52.72 O ATOM 1374 CB ILE A 724 -0.999 35.729 23.056 1.00 52.71 C ATOM 1375 CG1 ILE A 724 -0.483 36.215 24.419 1.00 53.27 C ATOM 1376 CG2 ILE A 724 -0.331 34.395 22.728 1.00 52.25 C ATOM 1377 CD1 ILE A 724 -1.202 35.555 25.627 1.00 51.22 C ATOM 0 H ILE A 724 -2.251 37.817 22.616 1.00 52.92 H new ATOM 0 HA ILE A 724 0.230 36.976 22.049 1.00 52.61 H new ATOM 0 HB ILE A 724 -1.960 35.602 23.090 1.00 52.71 H new ATOM 0 HG12 ILE A 724 0.468 36.034 24.480 1.00 53.27 H new ATOM 0 HG13 ILE A 724 -0.592 37.177 24.473 1.00 53.27 H new ATOM 0 HG21 ILE A 724 -0.527 33.754 23.429 1.00 52.25 H new ATOM 0 HG22 ILE A 724 -0.670 34.062 21.882 1.00 52.25 H new ATOM 0 HG23 ILE A 724 0.629 34.521 22.664 1.00 52.25 H new ATOM 0 HD11 ILE A 724 -0.832 35.903 26.453 1.00 51.22 H new ATOM 0 HD12 ILE A 724 -2.150 35.755 25.588 1.00 51.22 H new ATOM 0 HD13 ILE A 724 -1.073 34.594 25.595 1.00 51.22 H new ATOM 1378 N VAL A 725 -0.109 36.178 19.685 1.00 52.22 N ATOM 1379 CA VAL A 725 -0.357 35.765 18.310 1.00 51.70 C ATOM 1380 C VAL A 725 0.318 34.421 18.014 1.00 51.91 C ATOM 1381 O VAL A 725 1.554 34.329 17.927 1.00 51.78 O ATOM 1382 CB VAL A 725 0.145 36.824 17.318 1.00 51.79 C ATOM 1383 CG1 VAL A 725 -0.295 36.487 15.892 1.00 51.79 C ATOM 1384 CG2 VAL A 725 -0.346 38.207 17.706 1.00 51.59 C ATOM 0 H VAL A 725 0.715 36.357 19.854 1.00 52.22 H new ATOM 0 HA VAL A 725 -1.316 35.666 18.203 1.00 51.70 H new ATOM 0 HB VAL A 725 1.114 36.823 17.349 1.00 51.79 H new ATOM 0 HG11 VAL A 725 0.032 37.167 15.283 1.00 51.79 H new ATOM 0 HG12 VAL A 725 0.067 35.624 15.637 1.00 51.79 H new ATOM 0 HG13 VAL A 725 -1.264 36.456 15.851 1.00 51.79 H new ATOM 0 HG21 VAL A 725 -0.017 38.858 17.067 1.00 51.59 H new ATOM 0 HG22 VAL A 725 -1.316 38.217 17.708 1.00 51.59 H new ATOM 0 HG23 VAL A 725 -0.019 38.430 18.591 1.00 51.59 H new ATOM 1385 N VAL A 726 -0.494 33.374 17.890 1.00 51.76 N ATOM 1386 CA VAL A 726 0.027 32.030 17.662 1.00 51.49 C ATOM 1387 C VAL A 726 -0.169 31.654 16.204 1.00 51.83 C ATOM 1388 O VAL A 726 -1.264 31.801 15.658 1.00 52.07 O ATOM 1389 CB VAL A 726 -0.679 30.972 18.566 1.00 52.02 C ATOM 1390 CG1 VAL A 726 -0.102 29.566 18.337 1.00 50.75 C ATOM 1391 CG2 VAL A 726 -0.597 31.365 20.064 1.00 51.24 C ATOM 0 H VAL A 726 -1.352 33.421 17.935 1.00 51.76 H new ATOM 0 HA VAL A 726 0.970 32.035 17.888 1.00 51.49 H new ATOM 0 HB VAL A 726 -1.615 30.954 18.313 1.00 52.02 H new ATOM 0 HG11 VAL A 726 -0.559 28.931 18.911 1.00 50.75 H new ATOM 0 HG12 VAL A 726 -0.228 29.312 17.409 1.00 50.75 H new ATOM 0 HG13 VAL A 726 0.845 29.567 18.546 1.00 50.75 H new ATOM 0 HG21 VAL A 726 -1.043 30.691 20.600 1.00 51.24 H new ATOM 0 HG22 VAL A 726 0.333 31.428 20.332 1.00 51.24 H new ATOM 0 HG23 VAL A 726 -1.030 32.223 20.198 1.00 51.24 H new ATOM 1392 N PHE A 727 0.894 31.183 15.565 1.00 51.93 N ATOM 1393 CA PHE A 727 0.792 30.596 14.239 1.00 52.14 C ATOM 1394 C PHE A 727 0.820 29.065 14.310 1.00 52.57 C ATOM 1395 O PHE A 727 1.686 28.457 14.953 1.00 52.99 O ATOM 1396 CB PHE A 727 1.923 31.092 13.348 1.00 51.91 C ATOM 1397 CG PHE A 727 1.871 30.545 11.952 1.00 51.89 C ATOM 1398 CD1 PHE A 727 0.747 30.751 11.150 1.00 50.85 C ATOM 1399 CD2 PHE A 727 2.944 29.831 11.436 1.00 51.46 C ATOM 1400 CE1 PHE A 727 0.679 30.238 9.861 1.00 50.44 C ATOM 1401 CE2 PHE A 727 2.894 29.327 10.144 1.00 52.76 C ATOM 1402 CZ PHE A 727 1.747 29.526 9.347 1.00 51.42 C ATOM 0 H PHE A 727 1.691 31.195 15.887 1.00 51.93 H new ATOM 0 HA PHE A 727 -0.057 30.871 13.858 1.00 52.14 H new ATOM 0 HB2 PHE A 727 1.893 32.061 13.309 1.00 51.91 H new ATOM 0 HB3 PHE A 727 2.772 30.850 13.751 1.00 51.91 H new ATOM 0 HD1 PHE A 727 0.031 31.241 11.485 1.00 50.85 H new ATOM 0 HD2 PHE A 727 3.700 29.690 11.959 1.00 51.46 H new ATOM 0 HE1 PHE A 727 -0.083 30.373 9.345 1.00 50.44 H new ATOM 0 HE2 PHE A 727 3.620 28.856 9.802 1.00 52.76 H new ATOM 0 HZ PHE A 727 1.710 29.181 8.484 1.00 51.42 H new ATOM 1403 N LEU A 728 -0.139 28.439 13.660 1.00 52.70 N ATOM 1404 CA LEU A 728 -0.145 26.995 13.585 1.00 53.22 C ATOM 1405 C LEU A 728 0.377 26.643 12.213 1.00 53.27 C ATOM 1406 O LEU A 728 -0.274 26.910 11.207 1.00 53.25 O ATOM 1407 CB LEU A 728 -1.548 26.439 13.787 1.00 52.73 C ATOM 1408 CG LEU A 728 -2.203 26.811 15.108 1.00 54.17 C ATOM 1409 CD1 LEU A 728 -3.680 26.348 15.118 1.00 54.46 C ATOM 1410 CD2 LEU A 728 -1.425 26.219 16.292 1.00 53.91 C ATOM 0 H LEU A 728 -0.792 28.828 13.258 1.00 52.70 H new ATOM 0 HA LEU A 728 0.406 26.609 14.284 1.00 53.22 H new ATOM 0 HB2 LEU A 728 -2.112 26.751 13.062 1.00 52.73 H new ATOM 0 HB3 LEU A 728 -1.511 25.472 13.721 1.00 52.73 H new ATOM 0 HG LEU A 728 -2.186 27.776 15.203 1.00 54.17 H new ATOM 0 HD11 LEU A 728 -4.089 26.589 15.964 1.00 54.46 H new ATOM 0 HD12 LEU A 728 -4.159 26.779 14.393 1.00 54.46 H new ATOM 0 HD13 LEU A 728 -3.718 25.386 15.004 1.00 54.46 H new ATOM 0 HD21 LEU A 728 -1.860 26.469 17.122 1.00 53.91 H new ATOM 0 HD22 LEU A 728 -1.405 25.252 16.216 1.00 53.91 H new ATOM 0 HD23 LEU A 728 -0.518 26.562 16.287 1.00 53.91 H new ATOM 1411 N ASN A 729 1.559 26.055 12.172 1.00 53.60 N ATOM 1412 CA ASN A 729 2.200 25.798 10.902 1.00 54.21 C ATOM 1413 C ASN A 729 1.864 24.398 10.351 1.00 54.46 C ATOM 1414 O ASN A 729 2.126 23.386 11.010 1.00 54.69 O ATOM 1415 CB ASN A 729 3.713 26.046 11.029 1.00 53.94 C ATOM 1416 CG ASN A 729 4.475 25.783 9.743 1.00 54.03 C ATOM 1417 OD1 ASN A 729 4.129 26.293 8.678 1.00 56.97 O ATOM 1418 ND2 ASN A 729 5.536 25.007 9.842 1.00 54.15 N ATOM 0 H ASN A 729 2.003 25.799 12.863 1.00 53.60 H new ATOM 0 HA ASN A 729 1.849 26.418 10.244 1.00 54.21 H new ATOM 0 HB2 ASN A 729 3.862 26.964 11.304 1.00 53.94 H new ATOM 0 HB3 ASN A 729 4.070 25.479 11.730 1.00 53.94 H new ATOM 0 HD21 ASN A 729 6.014 24.841 9.147 1.00 54.15 H new ATOM 0 HD22 ASN A 729 5.750 24.666 10.602 1.00 54.15 H new ATOM 1419 N PRO A 730 1.290 24.344 9.138 1.00 54.47 N ATOM 1420 CA PRO A 730 0.922 23.076 8.517 1.00 54.92 C ATOM 1421 C PRO A 730 2.115 22.339 7.933 1.00 55.58 C ATOM 1422 O PRO A 730 3.068 22.967 7.432 1.00 55.57 O ATOM 1423 CB PRO A 730 -0.003 23.507 7.373 1.00 54.97 C ATOM 1424 CG PRO A 730 0.474 24.860 6.992 1.00 54.34 C ATOM 1425 CD PRO A 730 0.949 25.497 8.280 1.00 54.29 C ATOM 0 HA PRO A 730 0.525 22.469 9.161 1.00 54.92 H new ATOM 0 HB2 PRO A 730 0.050 22.891 6.626 1.00 54.97 H new ATOM 0 HB3 PRO A 730 -0.930 23.527 7.658 1.00 54.97 H new ATOM 0 HG2 PRO A 730 1.193 24.807 6.342 1.00 54.34 H new ATOM 0 HG3 PRO A 730 -0.237 25.380 6.586 1.00 54.34 H new ATOM 0 HD2 PRO A 730 1.717 26.070 8.132 1.00 54.29 H new ATOM 0 HD3 PRO A 730 0.258 26.047 8.681 1.00 54.29 H new ATOM 1426 N ASP A 731 2.061 21.012 7.988 1.00 55.72 N ATOM 1427 CA ASP A 731 3.063 20.201 7.302 1.00 55.55 C ATOM 1428 C ASP A 731 2.880 20.261 5.777 1.00 55.13 C ATOM 1429 O ASP A 731 3.854 20.460 5.056 1.00 55.51 O ATOM 1430 CB ASP A 731 3.094 18.750 7.823 1.00 55.53 C ATOM 1431 CG ASP A 731 1.699 18.157 8.044 1.00 56.53 C ATOM 1432 OD1 ASP A 731 0.692 18.900 7.977 1.00 58.93 O ATOM 1433 OD2 ASP A 731 1.608 16.934 8.306 1.00 57.10 O ATOM 0 H ASP A 731 1.460 20.565 8.411 1.00 55.72 H new ATOM 0 HA ASP A 731 3.931 20.584 7.506 1.00 55.55 H new ATOM 0 HB2 ASP A 731 3.578 18.196 7.191 1.00 55.53 H new ATOM 0 HB3 ASP A 731 3.586 18.723 8.658 1.00 55.53 H new ATOM 1434 N SER A 732 1.646 20.086 5.290 1.00 54.37 N ATOM 1435 CA SER A 732 1.363 20.073 3.836 1.00 53.64 C ATOM 1436 C SER A 732 -0.116 20.297 3.548 1.00 53.35 C ATOM 1437 O SER A 732 -0.932 20.243 4.472 1.00 53.03 O ATOM 1438 CB SER A 732 1.803 18.756 3.190 1.00 53.27 C ATOM 1439 OG SER A 732 1.237 17.650 3.863 1.00 53.25 O ATOM 0 H SER A 732 0.951 19.972 5.784 1.00 54.37 H new ATOM 0 HA SER A 732 1.874 20.803 3.452 1.00 53.64 H new ATOM 0 HB2 SER A 732 1.535 18.744 2.258 1.00 53.27 H new ATOM 0 HB3 SER A 732 2.771 18.690 3.208 1.00 53.27 H new ATOM 0 HG SER A 732 1.488 16.939 3.494 1.00 53.25 H new ATOM 1440 N LYS A 733 -0.447 20.542 2.272 1.00 52.90 N ATOM 1441 CA LYS A 733 -1.836 20.704 1.846 1.00 52.70 C ATOM 1442 C LYS A 733 -2.635 19.475 2.245 1.00 52.65 C ATOM 1443 O LYS A 733 -3.720 19.603 2.828 1.00 52.68 O ATOM 1444 CB LYS A 733 -1.968 20.967 0.334 1.00 52.77 C ATOM 1445 CG LYS A 733 -3.422 20.859 -0.168 1.00 52.92 C ATOM 1446 CD LYS A 733 -3.700 21.621 -1.454 1.00 54.62 C ATOM 1447 CE LYS A 733 -4.023 20.707 -2.625 1.00 53.78 C ATOM 1448 NZ LYS A 733 -2.835 20.523 -3.491 1.00 54.41 N ATOM 0 H LYS A 733 0.127 20.618 1.636 1.00 52.90 H new ATOM 0 HA LYS A 733 -2.190 21.488 2.294 1.00 52.70 H new ATOM 0 HB2 LYS A 733 -1.626 21.852 0.133 1.00 52.77 H new ATOM 0 HB3 LYS A 733 -1.416 20.333 -0.150 1.00 52.77 H new ATOM 0 HG2 LYS A 733 -3.636 19.923 -0.307 1.00 52.92 H new ATOM 0 HG3 LYS A 733 -4.017 21.187 0.524 1.00 52.92 H new ATOM 0 HD2 LYS A 733 -4.442 22.229 -1.310 1.00 54.62 H new ATOM 0 HD3 LYS A 733 -2.927 22.164 -1.677 1.00 54.62 H new ATOM 0 HE2 LYS A 733 -4.325 19.846 -2.295 1.00 53.78 H new ATOM 0 HE3 LYS A 733 -4.751 21.083 -3.143 1.00 53.78 H new ATOM 0 HZ1 LYS A 733 -3.042 19.986 -4.170 1.00 54.41 H new ATOM 0 HZ2 LYS A 733 -2.573 21.313 -3.807 1.00 54.41 H new ATOM 0 HZ3 LYS A 733 -2.175 20.160 -3.017 1.00 54.41 H new ATOM 1449 N GLN A 734 -2.083 18.301 1.921 1.00 52.46 N ATOM 1450 CA GLN A 734 -2.648 17.001 2.285 1.00 52.56 C ATOM 1451 C GLN A 734 -2.883 16.906 3.787 1.00 51.55 C ATOM 1452 O GLN A 734 -3.945 16.440 4.228 1.00 51.03 O ATOM 1453 CB GLN A 734 -1.700 15.872 1.905 1.00 52.74 C ATOM 1454 CG GLN A 734 -1.142 15.878 0.480 1.00 54.64 C ATOM 1455 CD GLN A 734 -0.338 14.603 0.183 1.00 54.60 C ATOM 1456 OE1 GLN A 734 0.262 14.004 1.087 1.00 57.82 O ATOM 1457 NE2 GLN A 734 -0.332 14.182 -1.078 1.00 56.27 N ATOM 0 H GLN A 734 -1.352 18.240 1.472 1.00 52.46 H new ATOM 0 HA GLN A 734 -3.487 16.918 1.806 1.00 52.56 H new ATOM 0 HB2 GLN A 734 -0.951 15.888 2.521 1.00 52.74 H new ATOM 0 HB3 GLN A 734 -2.163 15.031 2.043 1.00 52.74 H new ATOM 0 HG2 GLN A 734 -1.872 15.956 -0.154 1.00 54.64 H new ATOM 0 HG3 GLN A 734 -0.575 16.655 0.357 1.00 54.64 H new ATOM 0 HE21 GLN A 734 -0.760 14.622 -1.680 1.00 56.27 H new ATOM 0 HE22 GLN A 734 0.099 13.469 -1.291 1.00 56.27 H new ATOM 1458 N GLY A 735 -1.876 17.338 4.557 1.00 50.89 N ATOM 1459 CA GLY A 735 -1.948 17.408 6.023 1.00 49.76 C ATOM 1460 C GLY A 735 -3.183 18.168 6.469 1.00 49.44 C ATOM 1461 O GLY A 735 -3.924 17.725 7.362 1.00 48.29 O ATOM 0 H GLY A 735 -1.122 17.602 4.238 1.00 50.89 H new ATOM 0 HA2 GLY A 735 -1.964 16.511 6.393 1.00 49.76 H new ATOM 0 HA3 GLY A 735 -1.153 17.843 6.369 1.00 49.76 H new ATOM 1462 N VAL A 736 -3.424 19.291 5.797 1.00 49.41 N ATOM 1463 CA VAL A 736 -4.542 20.162 6.108 1.00 49.90 C ATOM 1464 C VAL A 736 -5.843 19.424 5.827 1.00 50.40 C ATOM 1465 O VAL A 736 -6.709 19.339 6.698 1.00 51.23 O ATOM 1466 CB VAL A 736 -4.469 21.497 5.322 1.00 49.95 C ATOM 1467 CG1 VAL A 736 -5.751 22.310 5.503 1.00 48.96 C ATOM 1468 CG2 VAL A 736 -3.234 22.298 5.746 1.00 48.95 C ATOM 0 H VAL A 736 -2.937 19.567 5.144 1.00 49.41 H new ATOM 0 HA VAL A 736 -4.503 20.395 7.049 1.00 49.90 H new ATOM 0 HB VAL A 736 -4.386 21.294 4.377 1.00 49.95 H new ATOM 0 HG11 VAL A 736 -5.682 23.139 5.003 1.00 48.96 H new ATOM 0 HG12 VAL A 736 -6.508 21.798 5.177 1.00 48.96 H new ATOM 0 HG13 VAL A 736 -5.878 22.510 6.444 1.00 48.96 H new ATOM 0 HG21 VAL A 736 -3.200 23.129 5.247 1.00 48.95 H new ATOM 0 HG22 VAL A 736 -3.284 22.492 6.695 1.00 48.95 H new ATOM 0 HG23 VAL A 736 -2.434 21.780 5.564 1.00 48.95 H new ATOM 1469 N LYS A 737 -5.958 18.865 4.630 1.00 50.54 N ATOM 1470 CA LYS A 737 -7.114 18.057 4.259 1.00 50.83 C ATOM 1471 C LYS A 737 -7.400 16.963 5.301 1.00 50.89 C ATOM 1472 O LYS A 737 -8.506 16.867 5.813 1.00 51.39 O ATOM 1473 CB LYS A 737 -6.896 17.445 2.879 1.00 50.94 C ATOM 1474 CG LYS A 737 -8.121 17.536 1.980 1.00 51.64 C ATOM 1475 CD LYS A 737 -7.844 17.003 0.583 1.00 53.49 C ATOM 1476 CE LYS A 737 -6.998 17.971 -0.254 1.00 54.14 C ATOM 1477 NZ LYS A 737 -7.091 17.675 -1.711 1.00 54.94 N ATOM 0 H LYS A 737 -5.369 18.943 4.009 1.00 50.54 H new ATOM 0 HA LYS A 737 -7.891 18.636 4.231 1.00 50.83 H new ATOM 0 HB2 LYS A 737 -6.152 17.893 2.447 1.00 50.94 H new ATOM 0 HB3 LYS A 737 -6.646 16.513 2.981 1.00 50.94 H new ATOM 0 HG2 LYS A 737 -8.851 17.035 2.377 1.00 51.64 H new ATOM 0 HG3 LYS A 737 -8.410 18.460 1.921 1.00 51.64 H new ATOM 0 HD2 LYS A 737 -7.385 16.151 0.650 1.00 53.49 H new ATOM 0 HD3 LYS A 737 -8.685 16.838 0.130 1.00 53.49 H new ATOM 0 HE2 LYS A 737 -7.292 18.881 -0.090 1.00 54.14 H new ATOM 0 HE3 LYS A 737 -6.071 17.917 0.028 1.00 54.14 H new ATOM 0 HZ1 LYS A 737 -6.590 18.254 -2.164 1.00 54.94 H new ATOM 0 HZ2 LYS A 737 -6.801 16.848 -1.865 1.00 54.94 H new ATOM 0 HZ3 LYS A 737 -7.938 17.746 -1.975 1.00 54.94 H new ATOM 1478 N THR A 738 -6.384 16.175 5.638 1.00 50.78 N ATOM 1479 CA THR A 738 -6.491 15.124 6.642 1.00 50.41 C ATOM 1480 C THR A 738 -6.943 15.607 8.020 1.00 50.84 C ATOM 1481 O THR A 738 -7.840 15.017 8.610 1.00 51.30 O ATOM 1482 CB THR A 738 -5.160 14.373 6.764 1.00 50.37 C ATOM 1483 OG1 THR A 738 -4.880 13.748 5.516 1.00 49.25 O ATOM 1484 CG2 THR A 738 -5.203 13.304 7.874 1.00 49.65 C ATOM 0 H THR A 738 -5.602 16.237 5.284 1.00 50.78 H new ATOM 0 HA THR A 738 -7.191 14.531 6.326 1.00 50.41 H new ATOM 0 HB THR A 738 -4.467 15.010 6.998 1.00 50.37 H new ATOM 0 HG1 THR A 738 -4.570 14.317 4.981 1.00 49.25 H new ATOM 0 HG21 THR A 738 -4.346 12.851 7.921 1.00 49.65 H new ATOM 0 HG22 THR A 738 -5.391 13.729 8.726 1.00 49.65 H new ATOM 0 HG23 THR A 738 -5.899 12.658 7.675 1.00 49.65 H new ATOM 1485 N MET A 739 -6.311 16.655 8.541 1.00 51.33 N ATOM 1486 CA MET A 739 -6.731 17.267 9.820 1.00 51.51 C ATOM 1487 C MET A 739 -8.176 17.778 9.789 1.00 51.93 C ATOM 1488 O MET A 739 -8.910 17.640 10.773 1.00 52.05 O ATOM 1489 CB MET A 739 -5.799 18.415 10.225 1.00 51.30 C ATOM 1490 CG MET A 739 -4.357 17.989 10.437 1.00 50.84 C ATOM 1491 SD MET A 739 -3.326 19.211 11.273 1.00 51.13 S ATOM 1492 CE MET A 739 -3.461 18.653 12.971 1.00 48.61 C ATOM 0 H MET A 739 -5.632 17.035 8.174 1.00 51.33 H new ATOM 0 HA MET A 739 -6.677 16.558 10.479 1.00 51.51 H new ATOM 0 HB2 MET A 739 -5.827 19.100 9.539 1.00 51.30 H new ATOM 0 HB3 MET A 739 -6.132 18.818 11.042 1.00 51.30 H new ATOM 0 HG2 MET A 739 -4.348 17.168 10.953 1.00 50.84 H new ATOM 0 HG3 MET A 739 -3.962 17.786 9.575 1.00 50.84 H new ATOM 0 HE1 MET A 739 -2.683 18.945 13.471 1.00 48.61 H new ATOM 0 HE2 MET A 739 -4.261 19.027 13.372 1.00 48.61 H new ATOM 0 HE3 MET A 739 -3.512 17.685 12.990 1.00 48.61 H new ATOM 1493 N ARG A 740 -8.587 18.367 8.668 1.00 52.39 N ATOM 1494 CA ARG A 740 -9.954 18.898 8.565 1.00 52.73 C ATOM 1495 C ARG A 740 -11.007 17.801 8.545 1.00 53.18 C ATOM 1496 O ARG A 740 -12.080 17.982 9.122 1.00 52.80 O ATOM 1497 CB ARG A 740 -10.120 19.813 7.358 1.00 52.29 C ATOM 1498 CG ARG A 740 -9.306 21.069 7.470 1.00 52.12 C ATOM 1499 CD ARG A 740 -10.057 22.304 6.985 1.00 52.51 C ATOM 1500 NE ARG A 740 -9.865 23.280 8.025 1.00 51.49 N ATOM 1501 CZ ARG A 740 -10.792 24.046 8.582 1.00 49.31 C ATOM 1502 NH1 ARG A 740 -12.048 24.081 8.123 1.00 40.33 N ATOM 1503 NH2 ARG A 740 -10.393 24.852 9.580 1.00 49.03 N ATOM 0 H ARG A 740 -8.103 18.470 7.965 1.00 52.39 H new ATOM 0 HA ARG A 740 -10.094 19.424 9.368 1.00 52.73 H new ATOM 0 HB2 ARG A 740 -9.861 19.334 6.555 1.00 52.29 H new ATOM 0 HB3 ARG A 740 -11.056 20.046 7.259 1.00 52.29 H new ATOM 0 HG2 ARG A 740 -9.043 21.198 8.395 1.00 52.12 H new ATOM 0 HG3 ARG A 740 -8.490 20.968 6.955 1.00 52.12 H new ATOM 0 HD2 ARG A 740 -9.707 22.619 6.137 1.00 52.51 H new ATOM 0 HD3 ARG A 740 -10.998 22.114 6.850 1.00 52.51 H new ATOM 0 HE ARG A 740 -9.062 23.377 8.317 1.00 51.49 H new ATOM 0 HH11 ARG A 740 -12.273 23.598 7.448 1.00 40.33 H new ATOM 0 HH12 ARG A 740 -12.631 24.587 8.503 1.00 40.33 H new ATOM 0 HH21 ARG A 740 -9.570 24.854 9.828 1.00 49.03 H new ATOM 0 HH22 ARG A 740 -10.961 25.366 9.970 1.00 49.03 H new ATOM 1504 N MET A 741 -10.690 16.668 7.908 1.00 53.65 N ATOM 1505 CA MET A 741 -11.627 15.543 7.822 1.00 55.35 C ATOM 1506 C MET A 741 -11.909 15.025 9.225 1.00 54.60 C ATOM 1507 O MET A 741 -13.058 14.781 9.590 1.00 54.59 O ATOM 1508 CB MET A 741 -11.093 14.407 6.929 1.00 55.03 C ATOM 1509 CG MET A 741 -10.853 14.771 5.436 1.00 56.71 C ATOM 1510 SD MET A 741 -10.432 13.364 4.318 1.00 60.21 S ATOM 1511 CE MET A 741 -9.183 12.432 5.257 1.00 59.36 C ATOM 0 H MET A 741 -9.935 16.532 7.519 1.00 53.65 H new ATOM 0 HA MET A 741 -12.446 15.861 7.412 1.00 55.35 H new ATOM 0 HB2 MET A 741 -10.257 14.090 7.305 1.00 55.03 H new ATOM 0 HB3 MET A 741 -11.720 13.668 6.967 1.00 55.03 H new ATOM 0 HG2 MET A 741 -11.651 15.204 5.095 1.00 56.71 H new ATOM 0 HG3 MET A 741 -10.135 15.422 5.392 1.00 56.71 H new ATOM 0 HE1 MET A 741 -8.503 12.099 4.650 1.00 59.36 H new ATOM 0 HE2 MET A 741 -8.771 13.014 5.915 1.00 59.36 H new ATOM 0 HE3 MET A 741 -9.607 11.685 5.707 1.00 59.36 H new ATOM 1512 N ARG A 742 -10.844 14.911 10.016 1.00 54.62 N ATOM 1513 CA ARG A 742 -10.900 14.396 11.376 1.00 54.20 C ATOM 1514 C ARG A 742 -11.496 15.405 12.360 1.00 54.37 C ATOM 1515 O ARG A 742 -12.253 15.015 13.253 1.00 55.08 O ATOM 1516 CB ARG A 742 -9.494 13.985 11.828 1.00 54.22 C ATOM 1517 CG ARG A 742 -9.423 13.347 13.202 1.00 54.09 C ATOM 1518 CD ARG A 742 -8.015 12.872 13.520 1.00 53.99 C ATOM 1519 NE ARG A 742 -7.124 13.988 13.859 1.00 54.34 N ATOM 1520 CZ ARG A 742 -6.056 14.341 13.154 1.00 52.44 C ATOM 1521 NH1 ARG A 742 -5.714 13.671 12.062 1.00 52.33 N ATOM 1522 NH2 ARG A 742 -5.318 15.354 13.549 1.00 51.57 N ATOM 0 H ARG A 742 -10.052 15.137 9.768 1.00 54.62 H new ATOM 0 HA ARG A 742 -11.487 13.624 11.372 1.00 54.20 H new ATOM 0 HB2 ARG A 742 -9.129 13.364 11.179 1.00 54.22 H new ATOM 0 HB3 ARG A 742 -8.924 14.770 11.821 1.00 54.22 H new ATOM 0 HG2 ARG A 742 -9.710 13.986 13.873 1.00 54.09 H new ATOM 0 HG3 ARG A 742 -10.037 12.597 13.244 1.00 54.09 H new ATOM 0 HD2 ARG A 742 -8.045 12.246 14.260 1.00 53.99 H new ATOM 0 HD3 ARG A 742 -7.656 12.392 12.757 1.00 53.99 H new ATOM 0 HE ARG A 742 -7.307 14.445 14.564 1.00 54.34 H new ATOM 0 HH11 ARG A 742 -6.186 13.000 11.804 1.00 52.33 H new ATOM 0 HH12 ARG A 742 -5.020 13.907 11.612 1.00 52.33 H new ATOM 0 HH21 ARG A 742 -5.527 15.786 14.262 1.00 51.57 H new ATOM 0 HH22 ARG A 742 -4.626 15.585 13.094 1.00 51.57 H new ATOM 1523 N LEU A 743 -11.174 16.691 12.204 1.00 53.70 N ATOM 1524 CA LEU A 743 -11.590 17.698 13.194 1.00 53.58 C ATOM 1525 C LEU A 743 -12.863 18.516 12.884 1.00 53.74 C ATOM 1526 O LEU A 743 -13.498 19.021 13.813 1.00 54.03 O ATOM 1527 CB LEU A 743 -10.440 18.661 13.515 1.00 53.45 C ATOM 1528 CG LEU A 743 -9.163 18.111 14.155 1.00 52.51 C ATOM 1529 CD1 LEU A 743 -8.021 19.088 13.914 1.00 51.55 C ATOM 1530 CD2 LEU A 743 -9.342 17.813 15.650 1.00 49.65 C ATOM 0 H LEU A 743 -10.721 17.001 11.542 1.00 53.70 H new ATOM 0 HA LEU A 743 -11.830 17.152 13.959 1.00 53.58 H new ATOM 0 HB2 LEU A 743 -10.187 19.099 12.688 1.00 53.45 H new ATOM 0 HB3 LEU A 743 -10.790 19.348 14.104 1.00 53.45 H new ATOM 0 HG LEU A 743 -8.952 17.262 13.737 1.00 52.51 H new ATOM 0 HD11 LEU A 743 -7.209 18.743 14.318 1.00 51.55 H new ATOM 0 HD12 LEU A 743 -7.885 19.198 12.960 1.00 51.55 H new ATOM 0 HD13 LEU A 743 -8.240 19.946 14.310 1.00 51.55 H new ATOM 0 HD21 LEU A 743 -8.511 17.468 16.013 1.00 49.65 H new ATOM 0 HD22 LEU A 743 -9.584 18.629 16.116 1.00 49.65 H new ATOM 0 HD23 LEU A 743 -10.044 17.154 15.767 1.00 49.65 H new ATOM 1531 N CYS A 744 -13.210 18.677 11.605 1.00 53.02 N ATOM 1532 CA CYS A 744 -14.384 19.452 11.225 1.00 53.00 C ATOM 1533 C CYS A 744 -14.946 18.973 9.874 1.00 53.00 C ATOM 1534 O CYS A 744 -14.908 19.696 8.877 1.00 53.18 O ATOM 1535 CB CYS A 744 -14.088 20.962 11.215 1.00 53.07 C ATOM 1536 SG CYS A 744 -12.599 21.475 10.252 1.00 54.55 S ATOM 0 H CYS A 744 -12.775 18.343 10.943 1.00 53.02 H new ATOM 0 HA CYS A 744 -15.067 19.303 11.897 1.00 53.00 H new ATOM 0 HB2 CYS A 744 -14.861 21.425 10.856 1.00 53.07 H new ATOM 0 HB3 CYS A 744 -13.979 21.260 12.132 1.00 53.07 H new ATOM 0 HG CYS A 744 -12.472 22.667 10.315 1.00 54.55 H new ATOM 1537 N PRO A 745 -15.476 17.738 9.833 1.00 52.52 N ATOM 1538 CA PRO A 745 -15.942 17.282 8.517 1.00 52.03 C ATOM 1539 C PRO A 745 -17.132 18.087 7.958 1.00 51.83 C ATOM 1540 O PRO A 745 -17.397 18.024 6.752 1.00 51.56 O ATOM 1541 CB PRO A 745 -16.321 15.811 8.762 1.00 51.56 C ATOM 1542 CG PRO A 745 -16.520 15.706 10.227 1.00 51.17 C ATOM 1543 CD PRO A 745 -15.671 16.726 10.890 1.00 51.32 C ATOM 0 HA PRO A 745 -15.257 17.402 7.840 1.00 52.03 H new ATOM 0 HB2 PRO A 745 -17.128 15.571 8.280 1.00 51.56 H new ATOM 0 HB3 PRO A 745 -15.621 15.212 8.459 1.00 51.56 H new ATOM 0 HG2 PRO A 745 -17.453 15.846 10.452 1.00 51.17 H new ATOM 0 HG3 PRO A 745 -16.284 14.818 10.537 1.00 51.17 H new ATOM 0 HD2 PRO A 745 -16.106 17.102 11.671 1.00 51.32 H new ATOM 0 HD3 PRO A 745 -14.827 16.352 11.188 1.00 51.32 H new ATOM 1544 N GLU A 746 -17.828 18.834 8.819 1.00 51.84 N ATOM 1545 CA GLU A 746 -18.975 19.648 8.383 1.00 52.06 C ATOM 1546 C GLU A 746 -18.541 20.952 7.690 1.00 51.47 C ATOM 1547 O GLU A 746 -19.308 21.525 6.898 1.00 51.60 O ATOM 1548 CB GLU A 746 -19.933 19.944 9.543 1.00 51.61 C ATOM 1549 CG GLU A 746 -20.619 18.716 10.078 1.00 53.24 C ATOM 1550 CD GLU A 746 -21.560 18.999 11.249 1.00 53.41 C ATOM 1551 OE1 GLU A 746 -22.761 19.279 11.017 1.00 53.29 O ATOM 1552 OE2 GLU A 746 -21.097 18.897 12.412 1.00 56.36 O ATOM 0 H GLU A 746 -17.655 18.885 9.660 1.00 51.84 H new ATOM 0 HA GLU A 746 -19.451 19.116 7.726 1.00 52.06 H new ATOM 0 HB2 GLU A 746 -19.439 20.370 10.261 1.00 51.61 H new ATOM 0 HB3 GLU A 746 -20.604 20.578 9.246 1.00 51.61 H new ATOM 0 HG2 GLU A 746 -21.123 18.299 9.362 1.00 53.24 H new ATOM 0 HG3 GLU A 746 -19.946 18.077 10.361 1.00 53.24 H new ATOM 1553 N SER A 747 -17.320 21.399 7.978 1.00 50.47 N ATOM 1554 CA SER A 747 -16.761 22.597 7.369 1.00 50.40 C ATOM 1555 C SER A 747 -16.720 22.598 5.841 1.00 51.24 C ATOM 1556 O SER A 747 -16.288 21.627 5.213 1.00 50.94 O ATOM 1557 CB SER A 747 -15.361 22.882 7.886 1.00 49.97 C ATOM 1558 OG SER A 747 -14.902 24.103 7.350 1.00 48.77 O ATOM 0 H SER A 747 -16.792 21.012 8.536 1.00 50.47 H new ATOM 0 HA SER A 747 -17.381 23.295 7.634 1.00 50.40 H new ATOM 0 HB2 SER A 747 -15.366 22.924 8.855 1.00 49.97 H new ATOM 0 HB3 SER A 747 -14.761 22.162 7.637 1.00 49.97 H new ATOM 0 HG SER A 747 -14.287 23.953 6.797 1.00 48.77 H new ATOM 1559 N ARG A 748 -17.159 23.728 5.285 1.00 51.52 N ATOM 1560 CA ARG A 748 -17.217 24.003 3.853 1.00 52.42 C ATOM 1561 C ARG A 748 -15.947 24.698 3.319 1.00 52.38 C ATOM 1562 O ARG A 748 -15.783 24.844 2.102 1.00 52.31 O ATOM 1563 CB ARG A 748 -18.466 24.867 3.526 1.00 52.74 C ATOM 1564 CG ARG A 748 -19.094 25.642 4.736 1.00 55.04 C ATOM 1565 CD ARG A 748 -17.999 26.234 5.738 1.00 57.40 C ATOM 1566 NE ARG A 748 -18.285 26.031 7.171 1.00 55.26 N ATOM 1567 CZ ARG A 748 -17.425 26.282 8.158 1.00 57.14 C ATOM 1568 NH1 ARG A 748 -16.207 26.732 7.906 1.00 58.65 N ATOM 1569 NH2 ARG A 748 -17.763 26.069 9.415 1.00 59.51 N ATOM 0 H ARG A 748 -17.445 24.386 5.759 1.00 51.52 H new ATOM 0 HA ARG A 748 -17.279 23.144 3.407 1.00 52.42 H new ATOM 0 HB2 ARG A 748 -18.223 25.511 2.842 1.00 52.74 H new ATOM 0 HB3 ARG A 748 -19.146 24.291 3.144 1.00 52.74 H new ATOM 0 HG2 ARG A 748 -19.642 26.368 4.399 1.00 55.04 H new ATOM 0 HG3 ARG A 748 -19.683 25.046 5.225 1.00 55.04 H new ATOM 0 HD2 ARG A 748 -17.142 25.829 5.533 1.00 57.40 H new ATOM 0 HD3 ARG A 748 -17.910 27.186 5.572 1.00 57.40 H new ATOM 0 HE ARG A 748 -19.062 25.729 7.385 1.00 55.26 H new ATOM 0 HH11 ARG A 748 -15.958 26.868 7.094 1.00 58.65 H new ATOM 0 HH12 ARG A 748 -15.664 26.889 8.554 1.00 58.65 H new ATOM 0 HH21 ARG A 748 -18.545 25.765 9.604 1.00 59.51 H new ATOM 0 HH22 ARG A 748 -17.201 26.234 10.045 1.00 59.51 H new ATOM 1570 N LYS A 749 -15.056 25.121 4.218 1.00 52.00 N ATOM 1571 CA LYS A 749 -13.829 25.824 3.815 1.00 51.70 C ATOM 1572 C LYS A 749 -12.877 24.938 2.991 1.00 51.17 C ATOM 1573 O LYS A 749 -12.836 23.729 3.158 1.00 51.57 O ATOM 1574 CB LYS A 749 -13.100 26.417 5.032 1.00 51.80 C ATOM 1575 CG LYS A 749 -13.819 27.596 5.721 1.00 51.78 C ATOM 1576 CD LYS A 749 -12.906 28.216 6.779 1.00 52.54 C ATOM 1577 CE LYS A 749 -13.650 29.117 7.764 1.00 53.43 C ATOM 1578 NZ LYS A 749 -14.109 28.392 8.990 1.00 52.50 N ATOM 0 H LYS A 749 -15.141 25.012 5.067 1.00 52.00 H new ATOM 0 HA LYS A 749 -14.110 26.551 3.238 1.00 51.70 H new ATOM 0 HB2 LYS A 749 -12.966 25.713 5.685 1.00 51.80 H new ATOM 0 HB3 LYS A 749 -12.220 26.714 4.751 1.00 51.80 H new ATOM 0 HG2 LYS A 749 -14.065 28.265 5.063 1.00 51.78 H new ATOM 0 HG3 LYS A 749 -14.641 27.288 6.133 1.00 51.78 H new ATOM 0 HD2 LYS A 749 -12.462 27.507 7.270 1.00 52.54 H new ATOM 0 HD3 LYS A 749 -12.213 28.732 6.338 1.00 52.54 H new ATOM 0 HE2 LYS A 749 -13.070 29.849 8.026 1.00 53.43 H new ATOM 0 HE3 LYS A 749 -14.418 29.508 7.319 1.00 53.43 H new ATOM 0 HZ1 LYS A 749 -14.996 28.319 8.977 1.00 52.50 H new ATOM 0 HZ2 LYS A 749 -13.745 27.580 9.009 1.00 52.50 H new ATOM 0 HZ3 LYS A 749 -13.860 28.845 9.714 1.00 52.50 H new ATOM 1579 N SER A 750 -12.120 25.554 2.096 1.00 50.33 N ATOM 1580 CA SER A 750 -11.250 24.834 1.188 1.00 49.17 C ATOM 1581 C SER A 750 -9.847 24.617 1.792 1.00 49.06 C ATOM 1582 O SER A 750 -9.192 25.570 2.217 1.00 49.26 O ATOM 1583 CB SER A 750 -11.216 25.594 -0.142 1.00 48.39 C ATOM 1584 OG SER A 750 -10.067 25.312 -0.908 1.00 46.94 O ATOM 0 H SER A 750 -12.098 26.408 1.999 1.00 50.33 H new ATOM 0 HA SER A 750 -11.597 23.942 1.031 1.00 49.17 H new ATOM 0 HB2 SER A 750 -12.006 25.369 -0.658 1.00 48.39 H new ATOM 0 HB3 SER A 750 -11.255 26.547 0.035 1.00 48.39 H new ATOM 0 HG SER A 750 -10.094 25.749 -1.625 1.00 46.94 H new ATOM 1585 N ALA A 751 -9.390 23.364 1.831 1.00 49.04 N ATOM 1586 CA ALA A 751 -8.035 23.027 2.340 1.00 48.69 C ATOM 1587 C ALA A 751 -6.953 23.729 1.532 1.00 48.79 C ATOM 1588 O ALA A 751 -6.010 24.268 2.093 1.00 48.55 O ATOM 1589 CB ALA A 751 -7.802 21.522 2.340 1.00 48.12 C ATOM 0 H ALA A 751 -9.845 22.683 1.568 1.00 49.04 H new ATOM 0 HA ALA A 751 -7.985 23.342 3.256 1.00 48.69 H new ATOM 0 HB1 ALA A 751 -6.912 21.332 2.676 1.00 48.12 H new ATOM 0 HB2 ALA A 751 -8.460 21.092 2.908 1.00 48.12 H new ATOM 0 HB3 ALA A 751 -7.885 21.182 1.436 1.00 48.12 H new ATOM 1590 N ARG A 752 -7.100 23.739 0.208 1.00 49.09 N ATOM 1591 CA ARG A 752 -6.160 24.476 -0.633 1.00 49.22 C ATOM 1592 C ARG A 752 -6.116 25.970 -0.274 1.00 49.16 C ATOM 1593 O ARG A 752 -5.043 26.519 -0.061 1.00 49.16 O ATOM 1594 CB ARG A 752 -6.471 24.297 -2.116 1.00 48.73 C ATOM 1595 CG ARG A 752 -5.349 24.779 -2.991 1.00 48.77 C ATOM 1596 CD ARG A 752 -5.639 24.530 -4.441 1.00 52.02 C ATOM 1597 NE ARG A 752 -4.412 24.184 -5.156 1.00 54.77 N ATOM 1598 CZ ARG A 752 -4.116 22.962 -5.588 1.00 56.10 C ATOM 1599 NH1 ARG A 752 -4.969 21.947 -5.402 1.00 57.46 N ATOM 1600 NH2 ARG A 752 -2.972 22.757 -6.226 1.00 56.42 N ATOM 0 H ARG A 752 -7.727 23.332 -0.217 1.00 49.09 H new ATOM 0 HA ARG A 752 -5.283 24.101 -0.459 1.00 49.22 H new ATOM 0 HB2 ARG A 752 -6.642 23.360 -2.298 1.00 48.73 H new ATOM 0 HB3 ARG A 752 -7.282 24.781 -2.336 1.00 48.73 H new ATOM 0 HG2 ARG A 752 -5.208 25.728 -2.846 1.00 48.77 H new ATOM 0 HG3 ARG A 752 -4.527 24.329 -2.742 1.00 48.77 H new ATOM 0 HD2 ARG A 752 -6.285 23.811 -4.529 1.00 52.02 H new ATOM 0 HD3 ARG A 752 -6.039 25.320 -4.837 1.00 52.02 H new ATOM 0 HE ARG A 752 -3.844 24.812 -5.307 1.00 54.77 H new ATOM 0 HH11 ARG A 752 -5.717 22.082 -5.000 1.00 57.46 H new ATOM 0 HH12 ARG A 752 -4.769 21.160 -5.685 1.00 57.46 H new ATOM 0 HH21 ARG A 752 -2.429 23.411 -6.357 1.00 56.42 H new ATOM 0 HH22 ARG A 752 -2.772 21.970 -6.509 1.00 56.42 H new ATOM 1601 N LYS A 753 -7.281 26.610 -0.217 1.00 49.19 N ATOM 1602 CA LYS A 753 -7.371 28.025 0.149 1.00 49.49 C ATOM 1603 C LYS A 753 -6.674 28.296 1.488 1.00 49.63 C ATOM 1604 O LYS A 753 -5.890 29.232 1.593 1.00 49.47 O ATOM 1605 CB LYS A 753 -8.836 28.486 0.188 1.00 48.98 C ATOM 1606 CG LYS A 753 -9.041 29.995 0.318 1.00 48.91 C ATOM 1607 CD LYS A 753 -10.508 30.368 -0.004 1.00 49.85 C ATOM 1608 CE LYS A 753 -10.770 31.882 -0.052 1.00 48.97 C ATOM 1609 NZ LYS A 753 -9.868 32.553 -1.021 1.00 48.44 N ATOM 0 H LYS A 753 -8.038 26.240 -0.388 1.00 49.19 H new ATOM 0 HA LYS A 753 -6.911 28.540 -0.533 1.00 49.49 H new ATOM 0 HB2 LYS A 753 -9.277 28.183 -0.621 1.00 48.98 H new ATOM 0 HB3 LYS A 753 -9.278 28.049 0.933 1.00 48.98 H new ATOM 0 HG2 LYS A 753 -8.818 30.282 1.217 1.00 48.91 H new ATOM 0 HG3 LYS A 753 -8.442 30.462 -0.285 1.00 48.91 H new ATOM 0 HD2 LYS A 753 -10.751 29.979 -0.859 1.00 49.85 H new ATOM 0 HD3 LYS A 753 -11.088 29.969 0.664 1.00 49.85 H new ATOM 0 HE2 LYS A 753 -11.694 32.045 -0.300 1.00 48.97 H new ATOM 0 HE3 LYS A 753 -10.641 32.263 0.831 1.00 48.97 H new ATOM 0 HZ1 LYS A 753 -10.173 33.371 -1.194 1.00 48.44 H new ATOM 0 HZ2 LYS A 753 -9.050 32.609 -0.675 1.00 48.44 H new ATOM 0 HZ3 LYS A 753 -9.839 32.082 -1.775 1.00 48.44 H new ATOM 1610 N LEU A 754 -6.945 27.455 2.485 1.00 50.19 N ATOM 1611 CA LEU A 754 -6.385 27.613 3.823 1.00 50.98 C ATOM 1612 C LEU A 754 -4.885 27.373 3.844 1.00 51.72 C ATOM 1613 O LEU A 754 -4.137 28.053 4.558 1.00 52.00 O ATOM 1614 CB LEU A 754 -7.090 26.684 4.827 1.00 50.93 C ATOM 1615 CG LEU A 754 -8.565 26.931 5.186 1.00 50.95 C ATOM 1616 CD1 LEU A 754 -8.975 25.982 6.280 1.00 52.14 C ATOM 1617 CD2 LEU A 754 -8.822 28.357 5.641 1.00 50.89 C ATOM 0 H LEU A 754 -7.462 26.773 2.402 1.00 50.19 H new ATOM 0 HA LEU A 754 -6.539 28.533 4.088 1.00 50.98 H new ATOM 0 HB2 LEU A 754 -7.023 25.780 4.482 1.00 50.93 H new ATOM 0 HB3 LEU A 754 -6.582 26.711 5.653 1.00 50.93 H new ATOM 0 HG LEU A 754 -9.089 26.781 4.383 1.00 50.95 H new ATOM 0 HD11 LEU A 754 -9.905 26.135 6.509 1.00 52.14 H new ATOM 0 HD12 LEU A 754 -8.864 25.068 5.974 1.00 52.14 H new ATOM 0 HD13 LEU A 754 -8.421 26.131 7.062 1.00 52.14 H new ATOM 0 HD21 LEU A 754 -9.762 28.464 5.855 1.00 50.89 H new ATOM 0 HD22 LEU A 754 -8.288 28.547 6.428 1.00 50.89 H new ATOM 0 HD23 LEU A 754 -8.581 28.972 4.931 1.00 50.89 H new ATOM 1618 N TYR A 755 -4.433 26.407 3.059 1.00 52.75 N ATOM 1619 CA TYR A 755 -3.010 26.163 2.969 1.00 53.66 C ATOM 1620 C TYR A 755 -2.296 27.343 2.288 1.00 54.27 C ATOM 1621 O TYR A 755 -1.280 27.825 2.809 1.00 54.33 O ATOM 1622 CB TYR A 755 -2.720 24.831 2.293 1.00 53.55 C ATOM 1623 CG TYR A 755 -1.259 24.476 2.277 1.00 53.90 C ATOM 1624 CD1 TYR A 755 -0.609 24.030 3.435 1.00 53.95 C ATOM 1625 CD2 TYR A 755 -0.524 24.571 1.101 1.00 54.22 C ATOM 1626 CE1 TYR A 755 0.739 23.693 3.420 1.00 53.25 C ATOM 1627 CE2 TYR A 755 0.823 24.243 1.071 1.00 54.68 C ATOM 1628 CZ TYR A 755 1.445 23.807 2.232 1.00 54.79 C ATOM 1629 OH TYR A 755 2.779 23.489 2.180 1.00 55.96 O ATOM 0 H TYR A 755 -4.926 25.891 2.579 1.00 52.75 H new ATOM 0 HA TYR A 755 -2.652 26.097 3.868 1.00 53.66 H new ATOM 0 HB2 TYR A 755 -3.211 24.130 2.750 1.00 53.55 H new ATOM 0 HB3 TYR A 755 -3.049 24.860 1.381 1.00 53.55 H new ATOM 0 HD1 TYR A 755 -1.089 23.958 4.229 1.00 53.95 H new ATOM 0 HD2 TYR A 755 -0.942 24.859 0.322 1.00 54.22 H new ATOM 0 HE1 TYR A 755 1.161 23.396 4.194 1.00 53.25 H new ATOM 0 HE2 TYR A 755 1.305 24.315 0.279 1.00 54.68 H new ATOM 0 HH TYR A 755 3.065 23.607 1.399 1.00 55.96 H new ATOM 1630 N GLU A 756 -2.838 27.817 1.161 1.00 54.55 N ATOM 1631 CA GLU A 756 -2.273 28.977 0.446 1.00 55.92 C ATOM 1632 C GLU A 756 -2.314 30.228 1.345 1.00 55.32 C ATOM 1633 O GLU A 756 -1.402 31.036 1.348 1.00 54.63 O ATOM 1634 CB GLU A 756 -2.990 29.239 -0.901 1.00 55.40 C ATOM 1635 CG GLU A 756 -3.046 28.037 -1.910 1.00 57.61 C ATOM 1636 CD GLU A 756 -3.757 28.377 -3.282 1.00 59.36 C ATOM 1637 OE1 GLU A 756 -4.842 29.029 -3.289 1.00 61.83 O ATOM 1638 OE2 GLU A 756 -3.224 27.992 -4.369 1.00 62.87 O ATOM 0 H GLU A 756 -3.537 27.481 0.790 1.00 54.55 H new ATOM 0 HA GLU A 756 -1.349 28.771 0.236 1.00 55.92 H new ATOM 0 HB2 GLU A 756 -3.899 29.519 -0.712 1.00 55.40 H new ATOM 0 HB3 GLU A 756 -2.549 29.984 -1.340 1.00 55.40 H new ATOM 0 HG2 GLU A 756 -2.141 27.737 -2.091 1.00 57.61 H new ATOM 0 HG3 GLU A 756 -3.512 27.297 -1.490 1.00 57.61 H new ATOM 1639 N ARG A 757 -3.363 30.366 2.141 1.00 55.77 N ATOM 1640 CA ARG A 757 -3.464 31.513 3.030 1.00 56.60 C ATOM 1641 C ARG A 757 -2.377 31.500 4.131 1.00 56.84 C ATOM 1642 O ARG A 757 -1.798 32.541 4.445 1.00 57.09 O ATOM 1643 CB ARG A 757 -4.889 31.635 3.597 1.00 56.51 C ATOM 1644 CG ARG A 757 -5.143 32.852 4.471 1.00 58.19 C ATOM 1645 CD ARG A 757 -5.027 34.186 3.740 1.00 62.00 C ATOM 1646 NE ARG A 757 -5.385 35.283 4.653 1.00 65.92 N ATOM 1647 CZ ARG A 757 -4.862 36.512 4.635 1.00 64.87 C ATOM 1648 NH1 ARG A 757 -3.926 36.840 3.749 1.00 63.51 N ATOM 1649 NH2 ARG A 757 -5.267 37.407 5.529 1.00 64.04 N ATOM 0 H ARG A 757 -4.021 29.814 2.183 1.00 55.77 H new ATOM 0 HA ARG A 757 -3.292 32.312 2.508 1.00 56.60 H new ATOM 0 HB2 ARG A 757 -5.515 31.652 2.856 1.00 56.51 H new ATOM 0 HB3 ARG A 757 -5.084 30.838 4.115 1.00 56.51 H new ATOM 0 HG2 ARG A 757 -6.031 32.782 4.855 1.00 58.19 H new ATOM 0 HG3 ARG A 757 -4.514 32.844 5.209 1.00 58.19 H new ATOM 0 HD2 ARG A 757 -4.122 34.308 3.413 1.00 62.00 H new ATOM 0 HD3 ARG A 757 -5.612 34.193 2.966 1.00 62.00 H new ATOM 0 HE ARG A 757 -5.982 35.119 5.250 1.00 65.92 H new ATOM 0 HH11 ARG A 757 -3.651 36.258 3.179 1.00 63.51 H new ATOM 0 HH12 ARG A 757 -3.596 37.634 3.746 1.00 63.51 H new ATOM 0 HH21 ARG A 757 -5.861 37.193 6.113 1.00 64.04 H new ATOM 0 HH22 ARG A 757 -4.935 38.200 5.524 1.00 64.04 H new ATOM 1650 N SER A 758 -2.098 30.324 4.695 1.00 56.70 N ATOM 1651 CA SER A 758 -0.994 30.151 5.634 1.00 56.65 C ATOM 1652 C SER A 758 0.400 30.456 5.064 1.00 56.55 C ATOM 1653 O SER A 758 1.256 30.992 5.780 1.00 56.50 O ATOM 1654 CB SER A 758 -0.995 28.731 6.187 1.00 56.62 C ATOM 1655 OG SER A 758 -2.121 28.539 7.009 1.00 58.43 O ATOM 0 H SER A 758 -2.545 29.605 4.543 1.00 56.70 H new ATOM 0 HA SER A 758 -1.154 30.808 6.330 1.00 56.65 H new ATOM 0 HB2 SER A 758 -1.004 28.091 5.458 1.00 56.62 H new ATOM 0 HB3 SER A 758 -0.183 28.572 6.694 1.00 56.62 H new ATOM 0 HG SER A 758 -2.800 28.418 6.530 1.00 58.43 H new ATOM 1656 N HIS A 759 0.634 30.080 3.807 1.00 56.34 N ATOM 1657 CA HIS A 759 1.900 30.347 3.118 1.00 56.70 C ATOM 1658 C HIS A 759 2.079 31.864 2.979 1.00 56.47 C ATOM 1659 O HIS A 759 3.123 32.413 3.308 1.00 56.55 O ATOM 1660 CB HIS A 759 1.894 29.652 1.754 1.00 56.91 C ATOM 1661 CG HIS A 759 3.237 29.544 1.103 1.00 59.06 C ATOM 1662 ND1 HIS A 759 3.902 30.630 0.568 1.00 61.15 N ATOM 1663 CD2 HIS A 759 4.018 28.467 0.849 1.00 61.67 C ATOM 1664 CE1 HIS A 759 5.047 30.230 0.038 1.00 61.09 C ATOM 1665 NE2 HIS A 759 5.139 28.921 0.189 1.00 61.56 N ATOM 0 H HIS A 759 0.059 29.659 3.325 1.00 56.34 H new ATOM 0 HA HIS A 759 2.647 29.996 3.627 1.00 56.70 H new ATOM 0 HB2 HIS A 759 1.527 28.761 1.860 1.00 56.91 H new ATOM 0 HB3 HIS A 759 1.298 30.135 1.161 1.00 56.91 H new ATOM 0 HD2 HIS A 759 3.832 27.585 1.078 1.00 61.67 H new ATOM 0 HE1 HIS A 759 5.679 30.777 -0.371 1.00 61.09 H new ATOM 0 HE2 HIS A 759 5.793 28.432 -0.081 1.00 61.56 H new ATOM 1666 N LYS A 760 1.031 32.532 2.517 1.00 56.41 N ATOM 1667 CA LYS A 760 0.949 33.981 2.520 1.00 56.60 C ATOM 1668 C LYS A 760 1.188 34.567 3.923 1.00 56.26 C ATOM 1669 O LYS A 760 1.961 35.524 4.074 1.00 56.56 O ATOM 1670 CB LYS A 760 -0.410 34.431 1.957 1.00 56.41 C ATOM 1671 CG LYS A 760 -0.563 35.929 1.791 1.00 58.90 C ATOM 1672 CD LYS A 760 -0.828 36.644 3.130 1.00 62.68 C ATOM 1673 CE LYS A 760 -0.774 38.170 2.982 1.00 63.45 C ATOM 1674 NZ LYS A 760 -1.537 38.809 4.094 1.00 65.11 N ATOM 0 H LYS A 760 0.336 32.147 2.187 1.00 56.41 H new ATOM 0 HA LYS A 760 1.655 34.323 1.949 1.00 56.60 H new ATOM 0 HB2 LYS A 760 -0.545 34.007 1.095 1.00 56.41 H new ATOM 0 HB3 LYS A 760 -1.112 34.110 2.544 1.00 56.41 H new ATOM 0 HG2 LYS A 760 0.241 36.291 1.388 1.00 58.90 H new ATOM 0 HG3 LYS A 760 -1.294 36.111 1.180 1.00 58.90 H new ATOM 0 HD2 LYS A 760 -1.698 36.383 3.469 1.00 62.68 H new ATOM 0 HD3 LYS A 760 -0.171 36.359 3.784 1.00 62.68 H new ATOM 0 HE2 LYS A 760 0.147 38.473 2.994 1.00 63.45 H new ATOM 0 HE3 LYS A 760 -1.148 38.435 2.127 1.00 63.45 H new ATOM 0 HZ1 LYS A 760 -2.154 39.354 3.756 1.00 65.11 H new ATOM 0 HZ2 LYS A 760 -1.933 38.179 4.583 1.00 65.11 H new ATOM 0 HZ3 LYS A 760 -0.979 39.275 4.607 1.00 65.11 H new ATOM 1675 N LEU A 761 0.533 34.008 4.937 1.00 55.69 N ATOM 1676 CA LEU A 761 0.692 34.511 6.289 1.00 55.75 C ATOM 1677 C LEU A 761 2.142 34.416 6.744 1.00 56.07 C ATOM 1678 O LEU A 761 2.733 35.420 7.143 1.00 56.00 O ATOM 1679 CB LEU A 761 -0.240 33.793 7.276 1.00 55.89 C ATOM 1680 CG LEU A 761 -1.674 34.324 7.385 1.00 55.85 C ATOM 1681 CD1 LEU A 761 -2.506 33.497 8.373 1.00 55.07 C ATOM 1682 CD2 LEU A 761 -1.679 35.788 7.774 1.00 54.76 C ATOM 0 H LEU A 761 -0.004 33.341 4.860 1.00 55.69 H new ATOM 0 HA LEU A 761 0.440 35.448 6.278 1.00 55.75 H new ATOM 0 HB2 LEU A 761 -0.283 32.857 7.025 1.00 55.89 H new ATOM 0 HB3 LEU A 761 0.165 33.832 8.157 1.00 55.89 H new ATOM 0 HG LEU A 761 -2.085 34.239 6.510 1.00 55.85 H new ATOM 0 HD11 LEU A 761 -3.406 33.857 8.419 1.00 55.07 H new ATOM 0 HD12 LEU A 761 -2.542 32.575 8.073 1.00 55.07 H new ATOM 0 HD13 LEU A 761 -2.097 33.535 9.252 1.00 55.07 H new ATOM 0 HD21 LEU A 761 -2.594 36.103 7.837 1.00 54.76 H new ATOM 0 HD22 LEU A 761 -1.240 35.896 8.632 1.00 54.76 H new ATOM 0 HD23 LEU A 761 -1.206 36.303 7.102 1.00 54.76 H new ATOM 1683 N ARG A 762 2.720 33.217 6.641 1.00 56.24 N ATOM 1684 CA ARG A 762 4.103 32.979 7.049 1.00 56.56 C ATOM 1685 C ARG A 762 5.129 33.879 6.348 1.00 56.29 C ATOM 1686 O ARG A 762 6.078 34.353 6.986 1.00 56.26 O ATOM 1687 CB ARG A 762 4.485 31.516 6.842 1.00 56.94 C ATOM 1688 CG ARG A 762 5.795 31.118 7.499 1.00 58.61 C ATOM 1689 CD ARG A 762 5.955 29.618 7.561 1.00 62.62 C ATOM 1690 NE ARG A 762 6.312 29.079 6.256 1.00 67.74 N ATOM 1691 CZ ARG A 762 5.478 28.414 5.456 1.00 70.50 C ATOM 1692 NH1 ARG A 762 4.222 28.179 5.838 1.00 71.11 N ATOM 1693 NH2 ARG A 762 5.908 27.970 4.277 1.00 70.19 N ATOM 0 H ARG A 762 2.320 32.521 6.333 1.00 56.24 H new ATOM 0 HA ARG A 762 4.133 33.205 7.992 1.00 56.56 H new ATOM 0 HB2 ARG A 762 3.776 30.954 7.191 1.00 56.94 H new ATOM 0 HB3 ARG A 762 4.545 31.339 5.890 1.00 56.94 H new ATOM 0 HG2 ARG A 762 6.535 31.503 7.004 1.00 58.61 H new ATOM 0 HG3 ARG A 762 5.832 31.485 8.396 1.00 58.61 H new ATOM 0 HD2 ARG A 762 6.640 29.389 8.208 1.00 62.62 H new ATOM 0 HD3 ARG A 762 5.128 29.213 7.867 1.00 62.62 H new ATOM 0 HE ARG A 762 7.118 29.198 5.982 1.00 67.74 H new ATOM 0 HH11 ARG A 762 3.946 28.457 6.604 1.00 71.11 H new ATOM 0 HH12 ARG A 762 3.688 27.750 5.319 1.00 71.11 H new ATOM 0 HH21 ARG A 762 6.721 28.112 4.034 1.00 70.19 H new ATOM 0 HH22 ARG A 762 5.373 27.541 3.758 1.00 70.19 H new ATOM 1694 N LYS A 763 4.936 34.103 5.049 1.00 55.82 N ATOM 1695 CA LYS A 763 5.912 34.803 4.207 1.00 55.25 C ATOM 1696 C LYS A 763 5.867 36.336 4.413 1.00 54.92 C ATOM 1697 O LYS A 763 6.903 36.963 4.601 1.00 53.80 O ATOM 1698 CB LYS A 763 5.748 34.368 2.732 1.00 54.97 C ATOM 1699 CG LYS A 763 6.108 35.411 1.675 1.00 55.69 C ATOM 1700 CD LYS A 763 6.554 34.784 0.339 1.00 55.39 C ATOM 1701 CE LYS A 763 7.120 35.856 -0.603 1.00 55.17 C ATOM 1702 NZ LYS A 763 7.906 35.318 -1.763 1.00 53.35 N ATOM 0 H LYS A 763 4.230 33.852 4.627 1.00 55.82 H new ATOM 0 HA LYS A 763 6.805 34.544 4.482 1.00 55.25 H new ATOM 0 HB2 LYS A 763 6.297 33.582 2.584 1.00 54.97 H new ATOM 0 HB3 LYS A 763 4.826 34.100 2.594 1.00 54.97 H new ATOM 0 HG2 LYS A 763 5.341 35.983 1.518 1.00 55.69 H new ATOM 0 HG3 LYS A 763 6.819 35.977 2.015 1.00 55.69 H new ATOM 0 HD2 LYS A 763 7.226 34.105 0.504 1.00 55.39 H new ATOM 0 HD3 LYS A 763 5.801 34.341 -0.083 1.00 55.39 H new ATOM 0 HE2 LYS A 763 6.386 36.389 -0.945 1.00 55.17 H new ATOM 0 HE3 LYS A 763 7.689 36.452 -0.091 1.00 55.17 H new ATOM 0 HZ1 LYS A 763 8.200 35.994 -2.262 1.00 53.35 H new ATOM 0 HZ2 LYS A 763 8.599 34.849 -1.460 1.00 53.35 H new ATOM 0 HZ3 LYS A 763 7.385 34.791 -2.256 1.00 53.35 H new ATOM 1703 N ASN A 764 4.664 36.915 4.427 1.00 55.05 N ATOM 1704 CA ASN A 764 4.494 38.371 4.529 1.00 54.72 C ATOM 1705 C ASN A 764 4.282 38.911 5.933 1.00 54.57 C ATOM 1706 O ASN A 764 4.428 40.102 6.145 1.00 54.52 O ATOM 1707 CB ASN A 764 3.306 38.842 3.674 1.00 54.94 C ATOM 1708 CG ASN A 764 3.364 38.333 2.248 1.00 55.85 C ATOM 1709 OD1 ASN A 764 2.391 37.752 1.747 1.00 57.66 O ATOM 1710 ND2 ASN A 764 4.506 38.524 1.590 1.00 55.53 N ATOM 0 H ASN A 764 3.925 36.478 4.378 1.00 55.05 H new ATOM 0 HA ASN A 764 5.341 38.721 4.211 1.00 54.72 H new ATOM 0 HB2 ASN A 764 2.480 38.544 4.085 1.00 54.94 H new ATOM 0 HB3 ASN A 764 3.285 39.812 3.665 1.00 54.94 H new ATOM 0 HD21 ASN A 764 4.590 38.239 0.783 1.00 55.53 H new ATOM 0 HD22 ASN A 764 5.159 38.932 1.972 1.00 55.53 H new ATOM 1711 N ASN A 765 3.937 38.044 6.884 1.00 54.80 N ATOM 1712 CA ASN A 765 3.373 38.484 8.154 1.00 54.88 C ATOM 1713 C ASN A 765 3.963 37.816 9.380 1.00 54.89 C ATOM 1714 O ASN A 765 3.447 37.996 10.493 1.00 54.58 O ATOM 1715 CB ASN A 765 1.847 38.256 8.158 1.00 55.25 C ATOM 1716 CG ASN A 765 1.080 39.286 7.307 1.00 56.17 C ATOM 1717 OD1 ASN A 765 0.369 38.921 6.378 1.00 57.49 O ATOM 1718 ND2 ASN A 765 1.214 40.566 7.642 1.00 56.15 N ATOM 0 H ASN A 765 4.023 37.192 6.810 1.00 54.80 H new ATOM 0 HA ASN A 765 3.598 39.425 8.217 1.00 54.88 H new ATOM 0 HB2 ASN A 765 1.658 37.365 7.826 1.00 55.25 H new ATOM 0 HB3 ASN A 765 1.522 38.293 9.071 1.00 55.25 H new ATOM 0 HD21 ASN A 765 0.793 41.172 7.201 1.00 56.15 H new ATOM 0 HD22 ASN A 765 1.722 40.787 8.300 1.00 56.15 H new ATOM 1719 N HIS A 766 5.033 37.046 9.195 1.00 54.90 N ATOM 1720 CA HIS A 766 5.583 36.247 10.294 1.00 55.35 C ATOM 1721 C HIS A 766 5.964 37.106 11.490 1.00 55.08 C ATOM 1722 O HIS A 766 5.903 36.654 12.635 1.00 55.38 O ATOM 1723 CB HIS A 766 6.798 35.451 9.838 1.00 55.76 C ATOM 1724 CG HIS A 766 7.959 36.307 9.457 1.00 57.80 C ATOM 1725 ND1 HIS A 766 8.074 36.891 8.212 1.00 60.24 N ATOM 1726 CD2 HIS A 766 9.042 36.708 10.165 1.00 58.94 C ATOM 1727 CE1 HIS A 766 9.185 37.604 8.164 1.00 61.12 C ATOM 1728 NE2 HIS A 766 9.789 37.510 9.337 1.00 61.14 N ATOM 0 H HIS A 766 5.454 36.971 8.449 1.00 54.90 H new ATOM 0 HA HIS A 766 4.882 35.636 10.568 1.00 55.35 H new ATOM 0 HB2 HIS A 766 7.068 34.850 10.550 1.00 55.76 H new ATOM 0 HB3 HIS A 766 6.549 34.899 9.080 1.00 55.76 H new ATOM 0 HD1 HIS A 766 7.511 36.804 7.568 1.00 60.24 H new ATOM 0 HD2 HIS A 766 9.242 36.483 11.045 1.00 58.94 H new ATOM 0 HE1 HIS A 766 9.490 38.089 7.431 1.00 61.12 H new ATOM 1729 N HIS A 767 6.346 38.346 11.200 1.00 54.67 N ATOM 1730 CA HIS A 767 6.772 39.329 12.187 1.00 54.36 C ATOM 1731 C HIS A 767 5.725 39.705 13.251 1.00 54.59 C ATOM 1732 O HIS A 767 6.076 40.379 14.213 1.00 55.48 O ATOM 1733 CB HIS A 767 7.240 40.601 11.473 1.00 54.14 C ATOM 1734 CG HIS A 767 6.136 41.348 10.788 1.00 54.31 C ATOM 1735 ND1 HIS A 767 5.492 42.424 11.366 1.00 53.61 N ATOM 1736 CD2 HIS A 767 5.552 41.165 9.580 1.00 52.75 C ATOM 1737 CE1 HIS A 767 4.569 42.878 10.539 1.00 52.77 C ATOM 1738 NE2 HIS A 767 4.584 42.131 9.449 1.00 53.27 N ATOM 0 H HIS A 767 6.364 38.647 10.395 1.00 54.67 H new ATOM 0 HA HIS A 767 7.491 38.898 12.675 1.00 54.36 H new ATOM 0 HB2 HIS A 767 7.664 41.187 12.119 1.00 54.14 H new ATOM 0 HB3 HIS A 767 7.915 40.365 10.818 1.00 54.14 H new ATOM 0 HD2 HIS A 767 5.766 40.509 8.957 1.00 52.75 H new ATOM 0 HE1 HIS A 767 4.005 43.600 10.696 1.00 52.77 H new ATOM 0 HE2 HIS A 767 4.070 42.233 8.767 1.00 53.27 H new ATOM 1739 N LEU A 768 4.463 39.306 13.083 1.00 53.88 N ATOM 1740 CA LEU A 768 3.444 39.540 14.106 1.00 53.74 C ATOM 1741 C LEU A 768 3.314 38.352 15.062 1.00 53.78 C ATOM 1742 O LEU A 768 2.715 38.472 16.147 1.00 52.99 O ATOM 1743 CB LEU A 768 2.069 39.802 13.471 1.00 53.81 C ATOM 1744 CG LEU A 768 1.902 40.952 12.464 1.00 54.71 C ATOM 1745 CD1 LEU A 768 0.504 40.897 11.823 1.00 54.76 C ATOM 1746 CD2 LEU A 768 2.188 42.347 13.073 1.00 53.32 C ATOM 0 H LEU A 768 4.177 38.898 12.382 1.00 53.88 H new ATOM 0 HA LEU A 768 3.733 40.321 14.604 1.00 53.74 H new ATOM 0 HB2 LEU A 768 1.795 38.985 13.026 1.00 53.81 H new ATOM 0 HB3 LEU A 768 1.441 39.956 14.194 1.00 53.81 H new ATOM 0 HG LEU A 768 2.573 40.824 11.775 1.00 54.71 H new ATOM 0 HD11 LEU A 768 0.409 41.626 11.190 1.00 54.76 H new ATOM 0 HD12 LEU A 768 0.393 40.051 11.361 1.00 54.76 H new ATOM 0 HD13 LEU A 768 -0.172 40.979 12.514 1.00 54.76 H new ATOM 0 HD21 LEU A 768 2.067 43.028 12.393 1.00 53.32 H new ATOM 0 HD22 LEU A 768 1.576 42.511 13.807 1.00 53.32 H new ATOM 0 HD23 LEU A 768 3.101 42.376 13.400 1.00 53.32 H new ATOM 1747 N PHE A 769 3.840 37.198 14.648 1.00 53.56 N ATOM 1748 CA PHE A 769 3.664 35.990 15.434 1.00 53.67 C ATOM 1749 C PHE A 769 4.395 36.188 16.723 1.00 54.07 C ATOM 1750 O PHE A 769 5.524 36.661 16.737 1.00 54.54 O ATOM 1751 CB PHE A 769 4.239 34.754 14.757 1.00 52.94 C ATOM 1752 CG PHE A 769 3.661 34.463 13.414 1.00 52.64 C ATOM 1753 CD1 PHE A 769 2.406 34.974 13.041 1.00 50.98 C ATOM 1754 CD2 PHE A 769 4.354 33.636 12.524 1.00 50.45 C ATOM 1755 CE1 PHE A 769 1.874 34.693 11.804 1.00 48.74 C ATOM 1756 CE2 PHE A 769 3.824 33.344 11.281 1.00 51.29 C ATOM 1757 CZ PHE A 769 2.579 33.876 10.917 1.00 50.94 C ATOM 0 H PHE A 769 4.295 37.099 13.925 1.00 53.56 H new ATOM 0 HA PHE A 769 2.713 35.843 15.553 1.00 53.67 H new ATOM 0 HB2 PHE A 769 5.198 34.865 14.667 1.00 52.94 H new ATOM 0 HB3 PHE A 769 4.095 33.987 15.332 1.00 52.94 H new ATOM 0 HD1 PHE A 769 1.931 35.507 13.636 1.00 50.98 H new ATOM 0 HD2 PHE A 769 5.177 33.280 12.770 1.00 50.45 H new ATOM 0 HE1 PHE A 769 1.049 35.045 11.559 1.00 48.74 H new ATOM 0 HE2 PHE A 769 4.290 32.798 10.690 1.00 51.29 H new ATOM 0 HZ PHE A 769 2.221 33.684 10.081 1.00 50.94 H new ATOM 1758 N THR A 770 3.745 35.827 17.809 1.00 54.59 N ATOM 1759 CA THR A 770 4.381 35.830 19.099 1.00 55.17 C ATOM 1760 C THR A 770 5.027 34.456 19.328 1.00 55.19 C ATOM 1761 O THR A 770 5.992 34.347 20.054 1.00 54.98 O ATOM 1762 CB THR A 770 3.329 36.191 20.171 1.00 55.87 C ATOM 1763 OG1 THR A 770 3.151 37.622 20.191 1.00 56.09 O ATOM 1764 CG2 THR A 770 3.736 35.684 21.555 1.00 55.98 C ATOM 0 H THR A 770 2.923 35.574 17.817 1.00 54.59 H new ATOM 0 HA THR A 770 5.085 36.495 19.153 1.00 55.17 H new ATOM 0 HB THR A 770 2.492 35.757 19.942 1.00 55.87 H new ATOM 0 HG1 THR A 770 2.579 37.825 20.771 1.00 56.09 H new ATOM 0 HG21 THR A 770 3.055 35.927 22.202 1.00 55.98 H new ATOM 0 HG22 THR A 770 3.829 34.719 21.532 1.00 55.98 H new ATOM 0 HG23 THR A 770 4.582 36.084 21.811 1.00 55.98 H new ATOM 1765 N THR A 771 4.497 33.419 18.679 1.00 55.51 N ATOM 1766 CA THR A 771 4.955 32.048 18.878 1.00 55.94 C ATOM 1767 C THR A 771 4.388 31.148 17.780 1.00 55.64 C ATOM 1768 O THR A 771 3.371 31.473 17.193 1.00 55.27 O ATOM 1769 CB THR A 771 4.547 31.505 20.287 1.00 56.66 C ATOM 1770 OG1 THR A 771 5.051 30.174 20.462 1.00 59.96 O ATOM 1771 CG2 THR A 771 3.036 31.484 20.477 1.00 55.96 C ATOM 0 H THR A 771 3.858 33.494 18.108 1.00 55.51 H new ATOM 0 HA THR A 771 5.924 32.044 18.831 1.00 55.94 H new ATOM 0 HB THR A 771 4.930 32.105 20.946 1.00 56.66 H new ATOM 0 HG1 THR A 771 4.830 29.888 21.220 1.00 59.96 H new ATOM 0 HG21 THR A 771 2.825 31.142 21.360 1.00 55.96 H new ATOM 0 HG22 THR A 771 2.686 32.384 20.387 1.00 55.96 H new ATOM 0 HG23 THR A 771 2.633 30.912 19.805 1.00 55.96 H new ATOM 1772 N THR A 772 5.054 30.027 17.506 1.00 55.71 N ATOM 1773 CA THR A 772 4.670 29.137 16.412 1.00 55.94 C ATOM 1774 C THR A 772 4.651 27.695 16.860 1.00 56.30 C ATOM 1775 O THR A 772 5.606 27.227 17.483 1.00 56.98 O ATOM 1776 CB THR A 772 5.649 29.238 15.225 1.00 56.02 C ATOM 1777 OG1 THR A 772 5.587 30.555 14.663 1.00 56.71 O ATOM 1778 CG2 THR A 772 5.299 28.219 14.131 1.00 54.65 C ATOM 0 H THR A 772 5.741 29.761 17.950 1.00 55.71 H new ATOM 0 HA THR A 772 3.783 29.418 16.136 1.00 55.94 H new ATOM 0 HB THR A 772 6.542 29.051 15.555 1.00 56.02 H new ATOM 0 HG1 THR A 772 6.122 30.610 14.017 1.00 56.71 H new ATOM 0 HG21 THR A 772 5.928 28.303 13.397 1.00 54.65 H new ATOM 0 HG22 THR A 772 5.347 27.322 14.497 1.00 54.65 H new ATOM 0 HG23 THR A 772 4.401 28.388 13.807 1.00 54.65 H new ATOM 1779 N ILE A 773 3.572 26.992 16.537 1.00 56.36 N ATOM 1780 CA ILE A 773 3.498 25.547 16.752 1.00 56.52 C ATOM 1781 C ILE A 773 3.421 24.844 15.398 1.00 56.22 C ATOM 1782 O ILE A 773 2.579 25.188 14.552 1.00 55.87 O ATOM 1783 CB ILE A 773 2.273 25.191 17.626 1.00 56.98 C ATOM 1784 CG1 ILE A 773 2.578 25.486 19.094 1.00 57.97 C ATOM 1785 CG2 ILE A 773 1.867 23.729 17.464 1.00 56.94 C ATOM 1786 CD1 ILE A 773 1.337 25.807 19.901 1.00 59.46 C ATOM 0 H ILE A 773 2.864 27.334 16.189 1.00 56.36 H new ATOM 0 HA ILE A 773 4.293 25.249 17.222 1.00 56.52 H new ATOM 0 HB ILE A 773 1.529 25.739 17.330 1.00 56.98 H new ATOM 0 HG12 ILE A 773 3.025 24.720 19.487 1.00 57.97 H new ATOM 0 HG13 ILE A 773 3.195 26.232 19.148 1.00 57.97 H new ATOM 0 HG21 ILE A 773 1.098 23.542 18.025 1.00 56.94 H new ATOM 0 HG22 ILE A 773 1.640 23.557 16.537 1.00 56.94 H new ATOM 0 HG23 ILE A 773 2.605 23.157 17.727 1.00 56.94 H new ATOM 0 HD11 ILE A 773 1.586 25.985 20.821 1.00 59.46 H new ATOM 0 HD12 ILE A 773 0.901 26.589 19.527 1.00 59.46 H new ATOM 0 HD13 ILE A 773 0.728 25.053 19.872 1.00 59.46 H new ATOM 1787 N ASN A 774 4.308 23.879 15.186 1.00 56.22 N ATOM 1788 CA ASN A 774 4.274 23.058 13.972 1.00 56.98 C ATOM 1789 C ASN A 774 3.244 21.938 14.089 1.00 57.05 C ATOM 1790 O ASN A 774 3.274 21.196 15.062 1.00 57.78 O ATOM 1791 CB ASN A 774 5.643 22.455 13.671 1.00 56.85 C ATOM 1792 CG ASN A 774 6.639 23.473 13.133 1.00 57.86 C ATOM 1793 OD1 ASN A 774 7.831 23.207 13.102 1.00 60.50 O ATOM 1794 ND2 ASN A 774 6.160 24.629 12.702 1.00 58.55 N ATOM 0 H ASN A 774 4.941 23.680 15.733 1.00 56.22 H new ATOM 0 HA ASN A 774 4.021 23.645 13.242 1.00 56.98 H new ATOM 0 HB2 ASN A 774 6.000 22.058 14.480 1.00 56.85 H new ATOM 0 HB3 ASN A 774 5.540 21.739 13.025 1.00 56.85 H new ATOM 0 HD21 ASN A 774 6.694 25.225 12.386 1.00 58.55 H new ATOM 0 HD22 ASN A 774 5.315 24.785 12.738 1.00 58.55 H new ATOM 1795 N LEU A 775 2.339 21.832 13.114 1.00 56.51 N ATOM 1796 CA LEU A 775 1.302 20.793 13.107 1.00 56.55 C ATOM 1797 C LEU A 775 1.798 19.436 12.623 1.00 56.72 C ATOM 1798 O LEU A 775 2.436 19.335 11.563 1.00 56.49 O ATOM 1799 CB LEU A 775 0.127 21.206 12.213 1.00 56.11 C ATOM 1800 CG LEU A 775 -1.044 22.051 12.726 1.00 56.13 C ATOM 1801 CD1 LEU A 775 -0.707 22.870 13.965 1.00 55.65 C ATOM 1802 CD2 LEU A 775 -1.569 22.935 11.592 1.00 53.73 C ATOM 0 H LEU A 775 2.308 22.361 12.436 1.00 56.51 H new ATOM 0 HA LEU A 775 1.028 20.704 14.033 1.00 56.55 H new ATOM 0 HB2 LEU A 775 0.507 21.687 11.461 1.00 56.11 H new ATOM 0 HB3 LEU A 775 -0.256 20.387 11.862 1.00 56.11 H new ATOM 0 HG LEU A 775 -1.741 21.439 13.010 1.00 56.13 H new ATOM 0 HD11 LEU A 775 -1.486 23.380 14.238 1.00 55.65 H new ATOM 0 HD12 LEU A 775 -0.442 22.275 14.684 1.00 55.65 H new ATOM 0 HD13 LEU A 775 0.022 23.477 13.763 1.00 55.65 H new ATOM 0 HD21 LEU A 775 -2.310 23.470 11.916 1.00 53.73 H new ATOM 0 HD22 LEU A 775 -0.860 23.519 11.282 1.00 53.73 H new ATOM 0 HD23 LEU A 775 -1.870 22.376 10.859 1.00 53.73 H new ATOM 1803 N ASN A 776 1.496 18.392 13.395 1.00 57.08 N ATOM 1804 CA ASN A 776 1.577 17.034 12.870 1.00 57.41 C ATOM 1805 C ASN A 776 0.185 16.549 12.502 1.00 57.53 C ATOM 1806 O ASN A 776 -0.642 16.325 13.382 1.00 57.99 O ATOM 1807 CB ASN A 776 2.227 16.072 13.853 1.00 57.17 C ATOM 1808 CG ASN A 776 2.457 14.693 13.244 1.00 58.49 C ATOM 1809 OD1 ASN A 776 1.663 14.215 12.432 1.00 60.05 O ATOM 1810 ND2 ASN A 776 3.549 14.054 13.627 1.00 59.18 N ATOM 0 H ASN A 776 1.245 18.449 14.216 1.00 57.08 H new ATOM 0 HA ASN A 776 2.140 17.055 12.080 1.00 57.41 H new ATOM 0 HB2 ASN A 776 3.075 16.439 14.149 1.00 57.17 H new ATOM 0 HB3 ASN A 776 1.665 15.987 14.639 1.00 57.17 H new ATOM 0 HD21 ASN A 776 3.726 13.276 13.307 1.00 59.18 H new ATOM 0 HD22 ASN A 776 4.082 14.417 14.196 1.00 59.18 H new ATOM 1811 N SER A 777 -0.069 16.377 11.207 1.00 57.66 N ATOM 1812 CA SER A 777 -1.398 15.979 10.731 1.00 57.78 C ATOM 1813 C SER A 777 -1.821 14.580 11.187 1.00 58.42 C ATOM 1814 O SER A 777 -3.004 14.244 11.143 1.00 58.57 O ATOM 1815 CB SER A 777 -1.513 16.109 9.207 1.00 57.72 C ATOM 1816 OG SER A 777 -0.694 15.187 8.508 1.00 55.85 O ATOM 0 H SER A 777 0.514 16.485 10.584 1.00 57.66 H new ATOM 0 HA SER A 777 -2.017 16.601 11.145 1.00 57.78 H new ATOM 0 HB2 SER A 777 -2.437 15.976 8.945 1.00 57.72 H new ATOM 0 HB3 SER A 777 -1.271 17.011 8.945 1.00 57.72 H new ATOM 0 HG SER A 777 0.053 15.538 8.353 1.00 55.85 H new ATOM 1817 N MET A 778 -0.859 13.777 11.635 1.00 58.85 N ATOM 1818 CA MET A 778 -1.150 12.441 12.139 1.00 59.55 C ATOM 1819 C MET A 778 -1.970 12.454 13.430 1.00 59.51 C ATOM 1820 O MET A 778 -2.779 11.541 13.659 1.00 59.43 O ATOM 1821 CB MET A 778 0.148 11.668 12.390 1.00 59.92 C ATOM 1822 CG MET A 778 0.939 11.368 11.140 1.00 61.66 C ATOM 1823 SD MET A 778 -0.144 10.705 9.874 1.00 66.27 S ATOM 1824 CE MET A 778 0.259 8.956 9.940 1.00 63.57 C ATOM 0 H MET A 778 -0.026 13.990 11.655 1.00 58.85 H new ATOM 0 HA MET A 778 -1.680 12.005 11.453 1.00 59.55 H new ATOM 0 HB2 MET A 778 0.705 12.179 12.998 1.00 59.92 H new ATOM 0 HB3 MET A 778 -0.065 10.833 12.834 1.00 59.92 H new ATOM 0 HG2 MET A 778 1.369 12.176 10.818 1.00 61.66 H new ATOM 0 HG3 MET A 778 1.644 10.732 11.339 1.00 61.66 H new ATOM 0 HE1 MET A 778 -0.273 8.476 9.286 1.00 63.57 H new ATOM 0 HE2 MET A 778 1.201 8.833 9.742 1.00 63.57 H new ATOM 0 HE3 MET A 778 0.068 8.613 10.827 1.00 63.57 H new ATOM 1825 N ASN A 779 -1.758 13.477 14.264 1.00 59.08 N ATOM 1826 CA ASN A 779 -2.256 13.456 15.648 1.00 58.96 C ATOM 1827 C ASN A 779 -2.715 14.811 16.182 1.00 58.48 C ATOM 1828 O ASN A 779 -2.445 15.854 15.591 1.00 58.36 O ATOM 1829 CB ASN A 779 -1.188 12.859 16.576 1.00 58.97 C ATOM 1830 CG ASN A 779 -0.011 13.797 16.790 1.00 59.51 C ATOM 1831 OD1 ASN A 779 1.133 13.468 16.482 1.00 61.38 O ATOM 1832 ND2 ASN A 779 -0.290 14.972 17.310 1.00 59.44 N ATOM 0 H ASN A 779 -1.329 14.191 14.050 1.00 59.08 H new ATOM 0 HA ASN A 779 -3.051 12.900 15.634 1.00 58.96 H new ATOM 0 HB2 ASN A 779 -1.590 12.649 17.433 1.00 58.97 H new ATOM 0 HB3 ASN A 779 -0.868 12.024 16.200 1.00 58.97 H new ATOM 0 HD21 ASN A 779 0.339 15.542 17.446 1.00 59.44 H new ATOM 0 HD22 ASN A 779 -1.102 15.170 17.514 1.00 59.44 H new ATOM 1833 N ASP A 780 -3.388 14.798 17.321 1.00 58.12 N ATOM 1834 CA ASP A 780 -3.933 16.041 17.856 1.00 57.94 C ATOM 1835 C ASP A 780 -3.135 16.654 19.037 1.00 57.70 C ATOM 1836 O ASP A 780 -3.680 17.389 19.876 1.00 57.91 O ATOM 1837 CB ASP A 780 -5.441 15.901 18.101 1.00 57.59 C ATOM 1838 CG ASP A 780 -6.241 15.907 16.786 1.00 59.07 C ATOM 1839 OD1 ASP A 780 -5.917 16.732 15.883 1.00 58.43 O ATOM 1840 OD2 ASP A 780 -7.187 15.091 16.649 1.00 59.51 O ATOM 0 H ASP A 780 -3.540 14.096 17.794 1.00 58.12 H new ATOM 0 HA ASP A 780 -3.816 16.718 17.171 1.00 57.94 H new ATOM 0 HB2 ASP A 780 -5.615 15.076 18.581 1.00 57.59 H new ATOM 0 HB3 ASP A 780 -5.745 16.628 18.667 1.00 57.59 H new ATOM 1841 N GLY A 781 -1.829 16.375 19.044 1.00 57.01 N ATOM 1842 CA GLY A 781 -0.871 16.951 19.994 1.00 56.26 C ATOM 1843 C GLY A 781 -0.738 18.470 19.942 1.00 56.28 C ATOM 1844 O GLY A 781 -0.351 19.079 20.954 1.00 55.13 O ATOM 0 H GLY A 781 -1.467 15.833 18.483 1.00 57.01 H new ATOM 0 HA2 GLY A 781 -1.134 16.694 20.892 1.00 56.26 H new ATOM 0 HA3 GLY A 781 0.001 16.559 19.830 1.00 56.26 H new ATOM 1845 N TRP A 782 -1.065 19.079 18.778 1.00 55.90 N ATOM 1846 CA TRP A 782 -1.000 20.547 18.578 1.00 55.37 C ATOM 1847 C TRP A 782 -1.847 21.278 19.614 1.00 56.05 C ATOM 1848 O TRP A 782 -1.511 22.402 20.000 1.00 56.64 O ATOM 1849 CB TRP A 782 -1.469 20.956 17.170 1.00 54.99 C ATOM 1850 CG TRP A 782 -2.904 20.521 16.890 1.00 54.42 C ATOM 1851 CD1 TRP A 782 -3.309 19.330 16.361 1.00 53.35 C ATOM 1852 CD2 TRP A 782 -4.097 21.256 17.174 1.00 53.41 C ATOM 1853 NE1 TRP A 782 -4.672 19.273 16.294 1.00 52.76 N ATOM 1854 CE2 TRP A 782 -5.190 20.440 16.788 1.00 53.53 C ATOM 1855 CE3 TRP A 782 -4.355 22.524 17.723 1.00 53.26 C ATOM 1856 CZ2 TRP A 782 -6.530 20.851 16.929 1.00 53.52 C ATOM 1857 CZ3 TRP A 782 -5.692 22.940 17.862 1.00 53.31 C ATOM 1858 CH2 TRP A 782 -6.759 22.098 17.470 1.00 53.68 C ATOM 0 H TRP A 782 -1.331 18.649 18.082 1.00 55.90 H new ATOM 0 HA TRP A 782 -0.069 20.799 18.681 1.00 55.37 H new ATOM 0 HB2 TRP A 782 -1.401 21.919 17.075 1.00 54.99 H new ATOM 0 HB3 TRP A 782 -0.879 20.563 16.508 1.00 54.99 H new ATOM 0 HD1 TRP A 782 -2.736 18.651 16.084 1.00 53.35 H new ATOM 0 HE1 TRP A 782 -5.130 18.612 15.991 1.00 52.76 H new ATOM 0 HE3 TRP A 782 -3.656 23.077 17.989 1.00 53.26 H new ATOM 0 HZ2 TRP A 782 -7.233 20.302 16.667 1.00 53.52 H new ATOM 0 HZ3 TRP A 782 -5.877 23.780 18.216 1.00 53.31 H new ATOM 0 HH2 TRP A 782 -7.634 22.392 17.580 1.00 53.68 H new ATOM 1859 N TYR A 783 -2.937 20.630 20.053 1.00 55.97 N ATOM 1860 CA TYR A 783 -3.912 21.218 20.974 1.00 55.66 C ATOM 1861 C TYR A 783 -3.355 21.394 22.406 1.00 55.58 C ATOM 1862 O TYR A 783 -3.402 22.496 22.968 1.00 55.18 O ATOM 1863 CB TYR A 783 -5.256 20.437 20.947 1.00 55.89 C ATOM 1864 CG TYR A 783 -6.283 20.972 21.926 1.00 55.60 C ATOM 1865 CD1 TYR A 783 -6.831 22.245 21.752 1.00 55.92 C ATOM 1866 CD2 TYR A 783 -6.680 20.234 23.032 1.00 54.93 C ATOM 1867 CE1 TYR A 783 -7.744 22.767 22.638 1.00 55.56 C ATOM 1868 CE2 TYR A 783 -7.615 20.751 23.945 1.00 55.71 C ATOM 1869 CZ TYR A 783 -8.126 22.026 23.734 1.00 56.61 C ATOM 1870 OH TYR A 783 -9.040 22.589 24.588 1.00 57.55 O ATOM 0 H TYR A 783 -3.129 19.825 19.818 1.00 55.97 H new ATOM 0 HA TYR A 783 -4.095 22.116 20.656 1.00 55.66 H new ATOM 0 HB2 TYR A 783 -5.625 20.472 20.050 1.00 55.89 H new ATOM 0 HB3 TYR A 783 -5.084 19.504 21.147 1.00 55.89 H new ATOM 0 HD1 TYR A 783 -6.572 22.753 21.017 1.00 55.92 H new ATOM 0 HD2 TYR A 783 -6.323 19.387 23.171 1.00 54.93 H new ATOM 0 HE1 TYR A 783 -8.101 23.614 22.498 1.00 55.56 H new ATOM 0 HE2 TYR A 783 -7.887 20.248 24.678 1.00 55.71 H new ATOM 0 HH TYR A 783 -9.202 22.056 25.217 1.00 57.55 H new ATOM 1871 N GLY A 784 -2.840 20.313 22.996 1.00 55.72 N ATOM 1872 CA GLY A 784 -2.122 20.390 24.283 1.00 55.51 C ATOM 1873 C GLY A 784 -1.002 21.436 24.261 1.00 55.92 C ATOM 1874 O GLY A 784 -0.800 22.184 25.242 1.00 55.77 O ATOM 0 H GLY A 784 -2.894 19.519 22.669 1.00 55.72 H new ATOM 0 HA2 GLY A 784 -2.750 20.607 24.989 1.00 55.51 H new ATOM 0 HA3 GLY A 784 -1.746 19.521 24.494 1.00 55.51 H new ATOM 1875 N ALA A 785 -0.295 21.513 23.127 1.00 55.67 N ATOM 1876 CA ALA A 785 0.779 22.496 22.947 1.00 55.85 C ATOM 1877 C ALA A 785 0.267 23.922 22.743 1.00 56.05 C ATOM 1878 O ALA A 785 0.975 24.884 23.035 1.00 56.42 O ATOM 1879 CB ALA A 785 1.700 22.095 21.806 1.00 55.55 C ATOM 0 H ALA A 785 -0.424 21.002 22.448 1.00 55.67 H new ATOM 0 HA ALA A 785 1.282 22.497 23.777 1.00 55.85 H new ATOM 0 HB1 ALA A 785 2.400 22.759 21.707 1.00 55.55 H new ATOM 0 HB2 ALA A 785 2.098 21.232 21.999 1.00 55.55 H new ATOM 0 HB3 ALA A 785 1.190 22.038 20.983 1.00 55.55 H new ATOM 1880 N LEU A 786 -0.949 24.060 22.229 1.00 55.90 N ATOM 1881 CA LEU A 786 -1.547 25.370 22.088 1.00 55.80 C ATOM 1882 C LEU A 786 -1.809 25.934 23.482 1.00 56.31 C ATOM 1883 O LEU A 786 -1.465 27.079 23.771 1.00 55.98 O ATOM 1884 CB LEU A 786 -2.837 25.296 21.255 1.00 55.59 C ATOM 1885 CG LEU A 786 -3.574 26.612 21.000 1.00 55.60 C ATOM 1886 CD1 LEU A 786 -2.622 27.642 20.381 1.00 56.47 C ATOM 1887 CD2 LEU A 786 -4.780 26.407 20.111 1.00 54.72 C ATOM 0 H LEU A 786 -1.439 23.408 21.958 1.00 55.90 H new ATOM 0 HA LEU A 786 -0.942 25.961 21.613 1.00 55.80 H new ATOM 0 HB2 LEU A 786 -2.619 24.901 20.396 1.00 55.59 H new ATOM 0 HB3 LEU A 786 -3.449 24.689 21.700 1.00 55.59 H new ATOM 0 HG LEU A 786 -3.890 26.947 21.854 1.00 55.60 H new ATOM 0 HD11 LEU A 786 -3.100 28.471 20.224 1.00 56.47 H new ATOM 0 HD12 LEU A 786 -1.883 27.805 20.987 1.00 56.47 H new ATOM 0 HD13 LEU A 786 -2.280 27.302 19.539 1.00 56.47 H new ATOM 0 HD21 LEU A 786 -5.225 27.257 19.968 1.00 54.72 H new ATOM 0 HD22 LEU A 786 -4.495 26.044 19.258 1.00 54.72 H new ATOM 0 HD23 LEU A 786 -5.394 25.788 20.536 1.00 54.72 H new ATOM 1888 N LYS A 787 -2.405 25.106 24.343 1.00 57.22 N ATOM 1889 CA LYS A 787 -2.755 25.495 25.708 1.00 57.59 C ATOM 1890 C LYS A 787 -1.536 25.885 26.532 1.00 58.37 C ATOM 1891 O LYS A 787 -1.587 26.853 27.282 1.00 58.73 O ATOM 1892 CB LYS A 787 -3.557 24.393 26.393 1.00 57.91 C ATOM 1893 CG LYS A 787 -5.017 24.291 25.868 1.00 57.74 C ATOM 1894 CD LYS A 787 -5.844 23.294 26.641 1.00 56.67 C ATOM 1895 CE LYS A 787 -5.413 21.864 26.324 1.00 56.69 C ATOM 1896 NZ LYS A 787 -5.895 20.894 27.326 1.00 55.25 N ATOM 0 H LYS A 787 -2.619 24.296 24.148 1.00 57.22 H new ATOM 0 HA LYS A 787 -3.311 26.287 25.647 1.00 57.59 H new ATOM 0 HB2 LYS A 787 -3.110 23.543 26.259 1.00 57.91 H new ATOM 0 HB3 LYS A 787 -3.573 24.557 27.349 1.00 57.91 H new ATOM 0 HG2 LYS A 787 -5.437 25.164 25.920 1.00 57.74 H new ATOM 0 HG3 LYS A 787 -5.003 24.038 24.932 1.00 57.74 H new ATOM 0 HD2 LYS A 787 -5.751 23.460 27.592 1.00 56.67 H new ATOM 0 HD3 LYS A 787 -6.782 23.409 26.423 1.00 56.67 H new ATOM 0 HE2 LYS A 787 -5.749 21.615 25.449 1.00 56.69 H new ATOM 0 HE3 LYS A 787 -4.445 21.824 26.278 1.00 56.69 H new ATOM 0 HZ1 LYS A 787 -5.622 20.077 27.103 1.00 55.25 H new ATOM 0 HZ2 LYS A 787 -5.570 21.107 28.126 1.00 55.25 H new ATOM 0 HZ3 LYS A 787 -6.784 20.912 27.353 1.00 55.25 H new ATOM 1897 N GLU A 788 -0.430 25.166 26.371 1.00 59.20 N ATOM 1898 CA GLU A 788 0.789 25.528 27.091 1.00 60.30 C ATOM 1899 C GLU A 788 1.455 26.794 26.576 1.00 59.76 C ATOM 1900 O GLU A 788 1.904 27.621 27.382 1.00 59.90 O ATOM 1901 CB GLU A 788 1.795 24.377 27.146 1.00 60.78 C ATOM 1902 CG GLU A 788 1.586 23.454 28.344 1.00 65.28 C ATOM 1903 CD GLU A 788 1.629 24.193 29.698 1.00 70.37 C ATOM 1904 OE1 GLU A 788 2.623 24.922 29.966 1.00 70.14 O ATOM 1905 OE2 GLU A 788 0.659 24.036 30.485 1.00 71.98 O ATOM 0 H GLU A 788 -0.362 24.478 25.860 1.00 59.20 H new ATOM 0 HA GLU A 788 0.492 25.718 27.995 1.00 60.30 H new ATOM 0 HB2 GLU A 788 1.729 23.858 26.329 1.00 60.78 H new ATOM 0 HB3 GLU A 788 2.693 24.741 27.178 1.00 60.78 H new ATOM 0 HG2 GLU A 788 0.730 23.006 28.254 1.00 65.28 H new ATOM 0 HG3 GLU A 788 2.269 22.765 28.337 1.00 65.28 H new ATOM 1906 N ALA A 789 1.508 26.935 25.252 1.00 59.16 N ATOM 1907 CA ALA A 789 2.075 28.113 24.592 1.00 58.95 C ATOM 1908 C ALA A 789 1.412 29.421 25.008 1.00 59.17 C ATOM 1909 O ALA A 789 2.106 30.411 25.231 1.00 59.49 O ATOM 1910 CB ALA A 789 2.010 27.964 23.093 1.00 58.56 C ATOM 0 H ALA A 789 1.212 26.342 24.704 1.00 59.16 H new ATOM 0 HA ALA A 789 3.000 28.161 24.881 1.00 58.95 H new ATOM 0 HB1 ALA A 789 2.389 28.752 22.673 1.00 58.56 H new ATOM 0 HB2 ALA A 789 2.514 27.180 22.823 1.00 58.56 H new ATOM 0 HB3 ALA A 789 1.085 27.864 22.817 1.00 58.56 H new ATOM 1911 N ILE A 790 0.083 29.433 25.101 1.00 59.40 N ATOM 1912 CA ILE A 790 -0.636 30.645 25.486 1.00 59.93 C ATOM 1913 C ILE A 790 -0.354 31.020 26.939 1.00 60.41 C ATOM 1914 O ILE A 790 -0.116 32.191 27.226 1.00 60.23 O ATOM 1915 CB ILE A 790 -2.156 30.528 25.256 1.00 60.15 C ATOM 1916 CG1 ILE A 790 -2.453 30.367 23.756 1.00 60.29 C ATOM 1917 CG2 ILE A 790 -2.898 31.736 25.869 1.00 58.20 C ATOM 1918 CD1 ILE A 790 -3.916 29.937 23.446 1.00 60.38 C ATOM 0 H ILE A 790 -0.419 28.752 24.946 1.00 59.40 H new ATOM 0 HA ILE A 790 -0.305 31.351 24.909 1.00 59.93 H new ATOM 0 HB ILE A 790 -2.485 29.735 25.708 1.00 60.15 H new ATOM 0 HG12 ILE A 790 -2.270 31.207 23.307 1.00 60.29 H new ATOM 0 HG13 ILE A 790 -1.846 29.708 23.384 1.00 60.29 H new ATOM 0 HG21 ILE A 790 -3.851 31.643 25.714 1.00 58.20 H new ATOM 0 HG22 ILE A 790 -2.728 31.770 26.823 1.00 58.20 H new ATOM 0 HG23 ILE A 790 -2.582 32.554 25.455 1.00 58.20 H new ATOM 0 HD11 ILE A 790 -4.033 29.855 22.487 1.00 60.38 H new ATOM 0 HD12 ILE A 790 -4.099 29.083 23.868 1.00 60.38 H new ATOM 0 HD13 ILE A 790 -4.530 30.605 23.790 1.00 60.38 H new ATOM 1919 N GLN A 791 -0.382 30.027 27.836 1.00 60.96 N ATOM 1920 CA GLN A 791 -0.009 30.230 29.236 1.00 61.54 C ATOM 1921 C GLN A 791 1.432 30.747 29.323 1.00 60.99 C ATOM 1922 O GLN A 791 1.664 31.762 29.977 1.00 60.66 O ATOM 1923 CB GLN A 791 -0.278 28.974 30.111 1.00 61.77 C ATOM 1924 CG GLN A 791 0.796 28.650 31.220 1.00 66.01 C ATOM 1925 CD GLN A 791 0.443 29.111 32.649 1.00 69.62 C ATOM 1926 OE1 GLN A 791 0.217 30.298 32.910 1.00 70.97 O ATOM 1927 NE2 GLN A 791 0.429 28.160 33.583 1.00 70.56 N ATOM 0 H GLN A 791 -0.617 29.221 27.648 1.00 60.96 H new ATOM 0 HA GLN A 791 -0.583 30.914 29.614 1.00 61.54 H new ATOM 0 HB2 GLN A 791 -1.139 29.084 30.544 1.00 61.77 H new ATOM 0 HB3 GLN A 791 -0.351 28.205 29.525 1.00 61.77 H new ATOM 0 HG2 GLN A 791 0.943 27.691 31.234 1.00 66.01 H new ATOM 0 HG3 GLN A 791 1.636 29.062 30.963 1.00 66.01 H new ATOM 0 HE21 GLN A 791 0.591 27.343 33.368 1.00 70.56 H new ATOM 0 HE22 GLN A 791 0.258 28.363 34.401 1.00 70.56 H new ATOM 1928 N GLN A 792 2.373 30.088 28.634 1.00 60.78 N ATOM 1929 CA GLN A 792 3.782 30.535 28.616 1.00 60.58 C ATOM 1930 C GLN A 792 3.904 31.986 28.134 1.00 59.90 C ATOM 1931 O GLN A 792 4.547 32.804 28.805 1.00 59.56 O ATOM 1932 CB GLN A 792 4.697 29.631 27.764 1.00 61.10 C ATOM 1933 CG GLN A 792 4.812 28.146 28.149 1.00 62.99 C ATOM 1934 CD GLN A 792 4.831 27.867 29.662 1.00 68.29 C ATOM 1935 OE1 GLN A 792 5.460 28.586 30.445 1.00 68.70 O ATOM 1936 NE2 GLN A 792 4.134 26.802 30.072 1.00 69.83 N ATOM 0 H GLN A 792 2.220 29.380 28.170 1.00 60.78 H new ATOM 0 HA GLN A 792 4.084 30.473 29.536 1.00 60.58 H new ATOM 0 HB2 GLN A 792 4.387 29.676 26.846 1.00 61.10 H new ATOM 0 HB3 GLN A 792 5.589 30.012 27.781 1.00 61.10 H new ATOM 0 HG2 GLN A 792 4.068 27.665 27.754 1.00 62.99 H new ATOM 0 HG3 GLN A 792 5.623 27.786 27.757 1.00 62.99 H new ATOM 0 HE21 GLN A 792 3.707 26.322 29.501 1.00 69.83 H new ATOM 0 HE22 GLN A 792 4.113 26.597 30.907 1.00 69.83 H new ATOM 1937 N GLN A 793 3.277 32.296 26.987 1.00 58.85 N ATOM 1938 CA GLN A 793 3.234 33.670 26.440 1.00 57.71 C ATOM 1939 C GLN A 793 2.655 34.694 27.406 1.00 56.85 C ATOM 1940 O GLN A 793 3.237 35.750 27.619 1.00 56.77 O ATOM 1941 CB GLN A 793 2.489 33.736 25.102 1.00 57.87 C ATOM 1942 CG GLN A 793 3.279 33.216 23.911 1.00 59.20 C ATOM 1943 CD GLN A 793 4.730 33.729 23.898 1.00 61.70 C ATOM 1944 OE1 GLN A 793 4.976 34.940 23.981 1.00 63.88 O ATOM 1945 NE2 GLN A 793 5.689 32.810 23.798 1.00 59.32 N ATOM 0 H GLN A 793 2.864 31.717 26.503 1.00 58.85 H new ATOM 0 HA GLN A 793 4.163 33.906 26.294 1.00 57.71 H new ATOM 0 HB2 GLN A 793 1.667 33.226 25.177 1.00 57.87 H new ATOM 0 HB3 GLN A 793 2.237 34.657 24.931 1.00 57.87 H new ATOM 0 HG2 GLN A 793 3.282 32.246 23.927 1.00 59.20 H new ATOM 0 HG3 GLN A 793 2.837 33.485 23.091 1.00 59.20 H new ATOM 0 HE21 GLN A 793 5.482 31.977 23.742 1.00 59.32 H new ATOM 0 HE22 GLN A 793 6.515 33.050 23.789 1.00 59.32 H new ATOM 1946 N GLN A 794 1.519 34.376 28.010 1.00 56.28 N ATOM 1947 CA GLN A 794 0.912 35.279 28.987 1.00 55.55 C ATOM 1948 C GLN A 794 1.880 35.602 30.140 1.00 55.63 C ATOM 1949 O GLN A 794 1.796 36.662 30.753 1.00 55.12 O ATOM 1950 CB GLN A 794 -0.420 34.712 29.501 1.00 54.76 C ATOM 1951 CG GLN A 794 -1.074 35.520 30.621 1.00 52.89 C ATOM 1952 CD GLN A 794 -1.425 36.937 30.201 1.00 51.48 C ATOM 1953 OE1 GLN A 794 -1.822 37.193 29.062 1.00 52.33 O ATOM 1954 NE2 GLN A 794 -1.283 37.866 31.122 1.00 50.23 N ATOM 0 H GLN A 794 1.083 33.648 27.872 1.00 56.28 H new ATOM 0 HA GLN A 794 0.721 36.118 28.539 1.00 55.55 H new ATOM 0 HB2 GLN A 794 -1.040 34.654 28.757 1.00 54.76 H new ATOM 0 HB3 GLN A 794 -0.271 33.807 29.817 1.00 54.76 H new ATOM 0 HG2 GLN A 794 -1.879 35.065 30.913 1.00 52.89 H new ATOM 0 HG3 GLN A 794 -0.474 35.553 31.383 1.00 52.89 H new ATOM 0 HE21 GLN A 794 -1.004 37.654 31.907 1.00 50.23 H new ATOM 0 HE22 GLN A 794 -1.470 38.685 30.939 1.00 50.23 H new ATOM 1955 N ASN A 795 2.810 34.694 30.411 1.00 56.33 N ATOM 1956 CA ASN A 795 3.736 34.860 31.544 1.00 57.16 C ATOM 1957 C ASN A 795 5.068 35.533 31.234 1.00 57.16 C ATOM 1958 O ASN A 795 5.875 35.719 32.132 1.00 57.36 O ATOM 1959 CB ASN A 795 3.972 33.527 32.244 1.00 57.21 C ATOM 1960 CG ASN A 795 2.830 33.155 33.152 1.00 58.31 C ATOM 1961 OD1 ASN A 795 2.781 33.563 34.316 1.00 60.88 O ATOM 1962 ND2 ASN A 795 1.894 32.380 32.627 1.00 60.67 N ATOM 0 H ASN A 795 2.927 33.973 29.956 1.00 56.33 H new ATOM 0 HA ASN A 795 3.279 35.483 32.130 1.00 57.16 H new ATOM 0 HB2 ASN A 795 4.095 32.831 31.579 1.00 57.21 H new ATOM 0 HB3 ASN A 795 4.792 33.575 32.760 1.00 57.21 H new ATOM 0 HD21 ASN A 795 1.217 32.141 33.101 1.00 60.67 H new ATOM 0 HD22 ASN A 795 1.962 32.115 31.812 1.00 60.67 H new ATOM 1963 N GLN A 796 5.279 35.895 29.970 1.00 57.51 N ATOM 1964 CA GLN A 796 6.425 36.685 29.556 1.00 57.84 C ATOM 1965 C GLN A 796 6.150 38.168 29.799 1.00 57.85 C ATOM 1966 O GLN A 796 4.997 38.623 29.734 1.00 57.55 O ATOM 1967 CB GLN A 796 6.703 36.502 28.058 1.00 58.26 C ATOM 1968 CG GLN A 796 7.018 35.090 27.597 1.00 59.49 C ATOM 1969 CD GLN A 796 8.428 34.641 27.930 1.00 61.89 C ATOM 1970 OE1 GLN A 796 9.335 35.457 28.162 1.00 63.95 O ATOM 1971 NE2 GLN A 796 8.624 33.328 27.955 1.00 62.43 N ATOM 0 H GLN A 796 4.752 35.684 29.324 1.00 57.51 H new ATOM 0 HA GLN A 796 7.190 36.387 30.072 1.00 57.84 H new ATOM 0 HB2 GLN A 796 5.930 36.817 27.565 1.00 58.26 H new ATOM 0 HB3 GLN A 796 7.447 37.074 27.815 1.00 58.26 H new ATOM 0 HG2 GLN A 796 6.387 34.477 28.005 1.00 59.49 H new ATOM 0 HG3 GLN A 796 6.888 35.035 26.637 1.00 59.49 H new ATOM 0 HE21 GLN A 796 7.972 32.793 27.789 1.00 62.43 H new ATOM 0 HE22 GLN A 796 9.403 33.013 28.137 1.00 62.43 H new ATOM 1972 N LEU A 797 7.223 38.909 30.075 1.00 57.48 N ATOM 1973 CA LEU A 797 7.215 40.367 30.041 1.00 57.00 C ATOM 1974 C LEU A 797 6.955 40.807 28.597 1.00 56.76 C ATOM 1975 O LEU A 797 7.310 40.088 27.650 1.00 56.67 O ATOM 1976 CB LEU A 797 8.568 40.912 30.548 1.00 56.58 C ATOM 1977 CG LEU A 797 9.012 40.359 31.915 1.00 56.25 C ATOM 1978 CD1 LEU A 797 10.457 40.661 32.310 1.00 53.96 C ATOM 1979 CD2 LEU A 797 8.074 40.843 32.987 1.00 56.03 C ATOM 0 H LEU A 797 7.985 38.572 30.290 1.00 57.48 H new ATOM 0 HA LEU A 797 6.519 40.718 30.619 1.00 57.00 H new ATOM 0 HB2 LEU A 797 9.252 40.706 29.892 1.00 56.58 H new ATOM 0 HB3 LEU A 797 8.512 41.879 30.606 1.00 56.58 H new ATOM 0 HG LEU A 797 8.975 39.394 31.823 1.00 56.25 H new ATOM 0 HD11 LEU A 797 10.642 40.275 33.180 1.00 53.96 H new ATOM 0 HD12 LEU A 797 11.059 40.279 31.652 1.00 53.96 H new ATOM 0 HD13 LEU A 797 10.588 41.621 32.348 1.00 53.96 H new ATOM 0 HD21 LEU A 797 8.356 40.493 33.846 1.00 56.03 H new ATOM 0 HD22 LEU A 797 8.085 41.813 33.014 1.00 56.03 H new ATOM 0 HD23 LEU A 797 7.175 40.536 32.793 1.00 56.03 H new ATOM 1980 N VAL A 798 6.346 41.981 28.433 1.00 56.40 N ATOM 1981 CA VAL A 798 6.014 42.513 27.109 1.00 56.12 C ATOM 1982 C VAL A 798 6.840 43.742 26.780 1.00 56.20 C ATOM 1983 O VAL A 798 7.080 44.583 27.645 1.00 56.60 O ATOM 1984 CB VAL A 798 4.521 42.913 27.009 1.00 56.31 C ATOM 1985 CG1 VAL A 798 4.084 42.997 25.542 1.00 56.07 C ATOM 1986 CG2 VAL A 798 3.623 41.922 27.776 1.00 55.96 C ATOM 0 H VAL A 798 6.114 42.492 29.085 1.00 56.40 H new ATOM 0 HA VAL A 798 6.209 41.800 26.480 1.00 56.12 H new ATOM 0 HB VAL A 798 4.421 43.787 27.417 1.00 56.31 H new ATOM 0 HG11 VAL A 798 3.148 43.248 25.497 1.00 56.07 H new ATOM 0 HG12 VAL A 798 4.619 43.662 25.082 1.00 56.07 H new ATOM 0 HG13 VAL A 798 4.207 42.134 25.117 1.00 56.07 H new ATOM 0 HG21 VAL A 798 2.696 42.197 27.696 1.00 55.96 H new ATOM 0 HG22 VAL A 798 3.730 41.033 27.403 1.00 55.96 H new ATOM 0 HG23 VAL A 798 3.877 41.912 28.712 1.00 55.96 H new ATOM 1987 N TRP A 799 7.284 43.852 25.531 1.00 56.08 N ATOM 1988 CA TRP A 799 7.864 45.107 25.066 1.00 55.79 C ATOM 1989 C TRP A 799 6.734 46.095 24.731 1.00 56.11 C ATOM 1990 O TRP A 799 5.894 45.868 23.868 1.00 55.67 O ATOM 1991 CB TRP A 799 8.838 44.895 23.901 1.00 55.16 C ATOM 1992 CG TRP A 799 10.083 44.151 24.294 1.00 55.04 C ATOM 1993 CD1 TRP A 799 10.356 42.834 24.056 1.00 54.69 C ATOM 1994 CD2 TRP A 799 11.224 44.674 24.996 1.00 53.67 C ATOM 1995 NE1 TRP A 799 11.589 42.504 24.566 1.00 54.02 N ATOM 1996 CE2 TRP A 799 12.146 43.615 25.142 1.00 53.41 C ATOM 1997 CE3 TRP A 799 11.554 45.931 25.512 1.00 53.60 C ATOM 1998 CZ2 TRP A 799 13.376 43.771 25.788 1.00 53.90 C ATOM 1999 CZ3 TRP A 799 12.784 46.092 26.157 1.00 54.35 C ATOM 2000 CH2 TRP A 799 13.678 45.014 26.289 1.00 54.47 C ATOM 0 H TRP A 799 7.259 43.222 24.946 1.00 56.08 H new ATOM 0 HA TRP A 799 8.400 45.491 25.777 1.00 55.79 H new ATOM 0 HB2 TRP A 799 8.386 44.407 23.195 1.00 55.16 H new ATOM 0 HB3 TRP A 799 9.087 45.758 23.535 1.00 55.16 H new ATOM 0 HD1 TRP A 799 9.789 42.245 23.613 1.00 54.69 H new ATOM 0 HE1 TRP A 799 11.952 41.725 24.529 1.00 54.02 H new ATOM 0 HE3 TRP A 799 10.966 46.647 25.428 1.00 53.60 H new ATOM 0 HZ2 TRP A 799 13.968 43.059 25.875 1.00 53.90 H new ATOM 0 HZ3 TRP A 799 13.014 46.924 26.504 1.00 54.35 H new ATOM 0 HH2 TRP A 799 14.489 45.145 26.724 1.00 54.47 H new ATOM 2001 N VAL A 800 6.722 47.194 25.462 1.00 57.03 N ATOM 2002 CA VAL A 800 5.652 48.174 25.409 1.00 57.77 C ATOM 2003 C VAL A 800 6.285 49.510 24.983 1.00 58.27 C ATOM 2004 O VAL A 800 7.463 49.752 25.260 1.00 57.83 O ATOM 2005 CB VAL A 800 4.944 48.227 26.806 1.00 57.51 C ATOM 2006 CG1 VAL A 800 4.185 49.521 27.040 1.00 58.06 C ATOM 2007 CG2 VAL A 800 4.027 47.022 26.979 1.00 57.77 C ATOM 0 H VAL A 800 7.348 47.397 26.015 1.00 57.03 H new ATOM 0 HA VAL A 800 4.963 47.949 24.765 1.00 57.77 H new ATOM 0 HB VAL A 800 5.643 48.197 27.477 1.00 57.51 H new ATOM 0 HG11 VAL A 800 3.769 49.498 27.916 1.00 58.06 H new ATOM 0 HG12 VAL A 800 4.800 50.270 26.994 1.00 58.06 H new ATOM 0 HG13 VAL A 800 3.501 49.623 26.360 1.00 58.06 H new ATOM 0 HG21 VAL A 800 3.595 47.066 27.846 1.00 57.77 H new ATOM 0 HG22 VAL A 800 3.353 47.026 26.282 1.00 57.77 H new ATOM 0 HG23 VAL A 800 4.549 46.207 26.919 1.00 57.77 H new ATOM 2008 N SER A 801 5.521 50.350 24.282 1.00 59.25 N ATOM 2009 CA SER A 801 6.001 51.680 23.885 1.00 60.37 C ATOM 2010 C SER A 801 6.376 52.481 25.122 1.00 60.89 C ATOM 2011 O SER A 801 5.623 52.496 26.101 1.00 61.24 O ATOM 2012 CB SER A 801 4.937 52.449 23.088 1.00 60.47 C ATOM 2013 OG SER A 801 4.361 51.652 22.064 1.00 61.45 O ATOM 0 H SER A 801 4.720 50.170 24.025 1.00 59.25 H new ATOM 0 HA SER A 801 6.778 51.558 23.317 1.00 60.37 H new ATOM 0 HB2 SER A 801 4.240 52.754 23.690 1.00 60.47 H new ATOM 0 HB3 SER A 801 5.338 53.240 22.694 1.00 60.47 H new ATOM 0 HG SER A 801 4.953 51.164 21.722 1.00 61.45 H new ATOM 2014 N GLU A 802 7.540 53.123 25.084 1.00 61.17 N ATOM 2015 CA GLU A 802 7.975 53.972 26.178 1.00 61.88 C ATOM 2016 C GLU A 802 7.159 55.267 26.127 1.00 62.13 C ATOM 2017 O GLU A 802 6.562 55.586 25.090 1.00 62.22 O ATOM 2018 CB GLU A 802 9.481 54.261 26.066 1.00 61.96 C ATOM 2019 CG GLU A 802 10.191 54.514 27.403 1.00 62.05 C ATOM 2020 CD GLU A 802 11.677 54.874 27.252 1.00 62.59 C ATOM 2021 OE1 GLU A 802 12.421 54.823 28.261 1.00 62.35 O ATOM 2022 OE2 GLU A 802 12.108 55.217 26.128 1.00 64.42 O ATOM 0 H GLU A 802 8.093 53.077 24.427 1.00 61.17 H new ATOM 0 HA GLU A 802 7.830 53.528 27.028 1.00 61.88 H new ATOM 0 HB2 GLU A 802 9.909 53.511 25.624 1.00 61.96 H new ATOM 0 HB3 GLU A 802 9.607 55.036 25.496 1.00 61.96 H new ATOM 0 HG2 GLU A 802 9.738 55.233 27.870 1.00 62.05 H new ATOM 0 HG3 GLU A 802 10.113 53.722 27.957 1.00 62.05 H new ATOM 2023 N GLY A 803 7.134 56.000 27.243 1.00 62.37 N ATOM 2024 CA GLY A 803 6.333 57.223 27.374 1.00 62.30 C ATOM 2025 C GLY A 803 4.922 56.955 27.880 1.00 62.42 C ATOM 2026 O GLY A 803 4.290 55.952 27.520 1.00 62.12 O ATOM 0 H GLY A 803 7.583 55.801 27.949 1.00 62.37 H new ATOM 0 HA2 GLY A 803 6.779 57.833 27.982 1.00 62.30 H new ATOM 0 HA3 GLY A 803 6.284 57.666 26.513 1.00 62.30 H new TER 2027 GLY A 803 HETATM 2028 O HOH A 1 -6.199 35.161 8.156 1.00 45.81 O HETATM 2029 O HOH A 2 -4.649 29.290 6.915 1.00 45.22 O HETATM 2030 O HOH A 3 -7.043 20.389 -4.488 1.00 51.37 O HETATM 2031 O HOH A 4 2.552 38.623 29.006 1.00 47.52 O HETATM 2032 O HOH A 5 1.352 41.272 19.775 1.00 36.69 O HETATM 2033 O HOH A 6 -16.598 31.771 23.717 1.00 41.90 O HETATM 2034 O HOH A 7 -16.869 43.752 18.447 1.00 72.43 O HETATM 2035 O HOH A 8 15.611 38.617 11.336 1.00 59.23 O HETATM 2036 O HOH A 9 2.279 40.629 17.143 1.00 34.60 O HETATM 2037 O HOH A 10 -17.584 19.504 11.458 1.00 47.01 O HETATM 2038 O HOH A 11 -14.997 24.639 12.167 1.00 51.90 O HETATM 2039 O HOH A 12 -8.036 38.630 26.892 1.00 50.50 O HETATM 2040 O HOH A 13 -8.825 21.832 -1.292 1.00 58.16 O HETATM 2041 O HOH A 14 -0.497 17.967 15.603 1.00 53.99 O HETATM 2042 O HOH A 15 -18.051 38.741 22.460 1.00 57.06 O HETATM 2043 O HOH A 16 4.340 21.486 10.442 1.00 55.41 O HETATM 2044 O HOH A 17 -8.180 33.289 15.283 1.00 46.44 O HETATM 2045 O HOH A 18 7.588 32.443 16.225 1.00 64.87 O HETATM 2046 O HOH A 19 3.770 24.338 24.072 1.00 71.60 O HETATM 2047 O HOH A 20 -13.260 36.217 17.415 1.00 65.94 O HETATM 2048 O HOH A 21 -5.596 32.458 9.475 1.00 51.30 O HETATM 2049 O HOH A 22 27.874 58.832 20.935 1.00 67.17 O HETATM 2050 O HOH A 23 -18.160 28.857 32.152 1.00 61.36 O HETATM 2051 O HOH A 24 -8.963 21.547 26.971 1.00 54.92 O HETATM 2052 O HOH A 25 31.741 48.322 7.655 1.00 68.91 O HETATM 2053 O HOH A 26 22.053 46.199 1.029 1.00 59.23 O HETATM 2054 O HOH A 27 -18.878 19.991 20.205 1.00 67.88 O HETATM 2055 O HOH A 28 -3.946 16.707 -0.971 1.00 72.19 O HETATM 2056 O HOH A 29 27.921 46.089 24.416 1.00 51.64 O HETATM 2057 O HOH A 30 -9.786 30.799 10.267 1.00 62.68 O HETATM 2058 O HOH A 31 -10.578 21.031 0.673 1.00 47.45 O HETATM 2059 O HOH A 32 -6.940 11.458 10.640 1.00 67.31 O HETATM 2060 O HOH A 33 9.284 56.150 19.732 1.00 76.02 O HETATM 2061 O HOH A 34 7.883 26.700 10.249 1.00 75.63 O HETATM 2062 O HOH A 35 18.242 49.589 0.078 1.00 53.06 O HETATM 2063 O HOH A 36 -5.892 47.225 28.122 1.00 55.98 O HETATM 2064 O HOH A 37 17.106 33.722 20.676 1.00 59.63 O HETATM 2065 O HOH A 38 -4.832 18.632 26.261 1.00 65.72 O HETATM 2066 O HOH A 39 -14.405 50.221 20.478 1.00 60.48 O HETATM 2067 O HOH A 40 -20.599 28.020 6.030 1.00 44.05 O HETATM 2068 O HOH A 41 -7.359 32.848 11.965 1.00 50.08 O HETATM 2069 O HOH A 42 -21.623 21.885 5.663 1.00 70.63 O HETATM 2070 O HOH A 43 6.693 39.389 17.613 1.00 51.76 O HETATM 2071 O HOH A 44 5.580 44.236 14.033 1.00 63.54 O HETATM 2072 O HOH A 45 10.005 37.311 30.036 1.00 66.23 O HETATM 2073 O HOH A 46 -3.119 17.649 22.396 1.00 48.12 O HETATM 2074 O HOH A 47 -9.157 28.385 10.085 1.00 73.41 O HETATM 2075 O HOH A 48 4.407 44.871 6.082 1.00 75.91 O HETATM 2076 O HOH A 49 -10.645 44.061 15.602 1.00 69.23 O HETATM 2077 O HOH A 50 -13.939 19.255 6.094 1.00 58.53 O HETATM 2078 O HOH A 51 6.800 38.981 25.244 1.00 50.02 O HETATM 2079 O HOH A 52 6.955 46.378 35.476 1.00 77.09 O HETATM 2080 O HOH A 53 20.414 60.026 14.861 1.00 35.59 O HETATM 2081 O HOH A 54 6.712 41.333 23.563 1.00 63.78 O HETATM 2082 O HOH A 55 13.491 48.086 29.496 1.00 63.03 O HETATM 2083 O HOH A 56 -19.180 24.727 26.815 1.00 52.19 O HETATM 2084 O HOH A 57 1.715 20.265 0.225 1.00 64.64 O HETATM 2085 O HOH A 58 7.689 27.018 0.264 1.00 97.95 O HETATM 2086 O HOH A 59 -5.493 11.141 16.022 1.00 82.63 O HETATM 2087 O HOH A 60 -3.345 30.514 -5.467 1.00 53.25 O HETATM 2088 O HOH A 61 -3.066 38.087 35.315 1.00 63.22 O HETATM 2089 O HOH A 62 -18.487 28.018 20.303 1.00 72.15 O HETATM 2090 O HOH A 63 5.686 46.563 12.167 1.00 60.04 O HETATM 2091 O HOH A 64 22.486 64.717 13.276 1.00 72.42 O HETATM 2092 O HOH A 65 25.249 47.331 8.028 1.00 61.27 O HETATM 2093 O HOH A 66 27.150 56.766 13.541 1.00 60.97 O HETATM 2094 O HOH A 67 10.196 51.267 -3.332 1.00 63.91 O HETATM 2095 O HOH A 68 -15.008 30.165 15.891 1.00 71.02 O HETATM 2096 O HOH A 69 16.859 41.415 6.359 1.00 73.34 O HETATM 2097 O HOH A 70 10.625 40.481 20.381 1.00 62.61 O HETATM 2098 O HOH A 71 -10.470 23.001 32.825 1.00 76.94 O HETATM 2099 O HOH A 72 0.839 44.038 9.037 1.00 59.55 O HETATM 2100 O HOH A 73 -11.095 25.716 -3.341 1.00 63.49 O END