USER MOD reduce.3.24.130724 H: found=0, std=0, add=3556, rem=0, adj=116 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER OXIDOREDUCTASE 29-APR-15 5A1F TITLE CRYSTAL STRUCTURE OF THE CATALYTIC DOMAIN OF PLU1 IN COMPLEX WITH TITLE 2 N-OXALYLGLYCINE. COMPND MOL_ID: 1; COMPND 2 MOLECULE: LYSINE-SPECIFIC DEMETHYLASE 5B, LYSINE-SPECIFIC COMPND 3 DEMETHYLASE 5B; COMPND 4 CHAIN: A; COMPND 5 FRAGMENT: JMJC DOMAIN, RESIDUES, JMJC DOMAIN, RESIDUES; COMPND 6 SYNONYM: CANCER/TESTIS ANTIGEN 31, CT31, HISTONE DEMETHYLASE COMPND 7 JARID1B, JUMONJI/ARID DOMAIN-CONTAINING PROTEIN 1B, PLU-1, COMPND 8 RETINOBLASTOMA- BINDING PROTEIN 2 HOMOLOG 1, RBP2-H1, COMPND 9 CANCER/TESTIS ANTIGEN 31, CT31, HISTONE DEMETHYLASE JARID1B, COMPND 0 JUMONJI/ARID DOMAIN-CONTAINING PROTEIN 1B, PLU-1, COMPND 1 RETINOBLASTOMA-BINDING PROTEIN 2 HOMOLOG 1, RBP2-H1; COMPND 2 EC: 1.14.11.-, 1.14.11.-; COMPND 3 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: KDM5B, JARID1B, PLU1, RBBP2H1; SOURCE 6 EXPRESSION_SYSTEM: SPODOPTERA FRUGIPERDA; SOURCE 7 EXPRESSION_SYSTEM_COMMON: FALL ARMYWORM; SOURCE 8 EXPRESSION_SYSTEM_TAXID: 7108; SOURCE 9 EXPRESSION_SYSTEM_CELL_LINE: SF9; SOURCE 0 EXPRESSION_SYSTEM_VECTOR_TYPE: BACULOVIRUS; SOURCE 1 EXPRESSION_SYSTEM_PLASMID: PFB-LIC-BSE KEYWDS OXIDOREDUCTASE, LYSINE-SPECIFIC DEMETHYLASE 5B EXPDTA X-RAY DIFFRACTION AUTHOR V.SRIKANNATHASAN,C.JOHANSSON,C.STRAIN-DAMERELL,C.GILEADI,A.SZYKOWSKA, AUTHOR 2 K.KUPINSKA,J.KOPEC,T.KROJER,H.STEUBER,F.VON DELFT,N.A.BURGESS-BROWN, AUTHOR 3 C.H.ARROWSMITH,C.BOUNTRA,A.M.EDWARDS,U.OPPERMANN REVDAT 6 29-JUN-16 5A1F 1 JRNL REVDAT 5 01-JUN-16 5A1F 1 JRNL REVDAT 4 25-MAY-16 5A1F 1 JRNL REVDAT 3 20-MAY-15 5A1F 1 SOURCE REMARK REVDAT 2 13-MAY-15 5A1F 1 TITLE AUTHOR REVDAT 1 06-MAY-15 5A1F 0 JRNL AUTH C.JOHANSSON,S.VELUPILLAI,A.TUMBER,A.SZYKOWSKA,E.S.HOOKWAY, JRNL AUTH 2 R.P.NOWAK,C.STRAIN-DAMERELL,C.GILEADI,M.PHILPOTT, JRNL AUTH 3 N.BURGESS-BROWN,N.WU,J.KOPEC,A.NUZZI,H.STEUBER,U.EGNER, JRNL AUTH 4 V.BADOCK,S.MUNRO,N.B.LATHANGUE,S.WESTAWAY,J.BROWN, JRNL AUTH 5 N.ATHANASOU,R.PRINJHA,P.E.BRENNAN,U.OPPERMANN JRNL TITL STRUCTURAL ANALYSIS OF HUMAN KDM5B GUIDES HISTONE JRNL TITL 2 DEMETHYLASE INHIBITOR DEVELOPMENT. JRNL REF NAT.CHEM.BIOL. V. 12 539 2016 JRNL REFN ISSN 1552-4450 JRNL PMID 27214403 JRNL DOI 10.1038/NCHEMBIO.2087 REMARK 2 REMARK 2 RESOLUTION. 2.10 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.8.0107 REMARK 3 AUTHORS : MURSHUDOV,SKUBAK,LEBEDEV,PANNU, REMARK 3 STEINER,NICHOLLS,WINN,LONG,VAGIN REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.10 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 50.01 REMARK 3 DATA CUTOFF (SIGMA(F)) : NONE REMARK 3 COMPLETENESS FOR RANGE (%) : 99.77 REMARK 3 NUMBER OF REFLECTIONS : 50341 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) : 0.20060 REMARK 3 R VALUE (WORKING SET) : 0.19931 REMARK 3 FREE R VALUE : 0.22501 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.0 REMARK 3 FREE R VALUE TEST SET COUNT : 2629 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) : 2.100 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.154 REMARK 3 REFLECTION IN BIN (WORKING SET) : 3678 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 100.00 REMARK 3 BIN R VALUE (WORKING SET) : 0.302 REMARK 3 BIN FREE R VALUE SET COUNT : 174 REMARK 3 BIN FREE R VALUE : 0.325 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3637 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 62 REMARK 3 SOLVENT ATOMS : 204 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 47.600 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.41 REMARK 3 B22 (A**2) : 0.41 REMARK 3 B33 (A**2) : -1.32 REMARK 3 B12 (A**2) : 0.20 REMARK 3 B13 (A**2) : 0.00 REMARK 3 B23 (A**2) : 0.00 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.143 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.134 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.106 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 4.166 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.959 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.947 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 3797 ; 0.011 ; 0.019 REMARK 3 BOND LENGTHS OTHERS (A): 3488 ; 0.002 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 5155 ; 1.503 ; 1.960 REMARK 3 BOND ANGLES OTHERS (DEGREES): 8048 ; 0.985 ; 3.000 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 455 ; 6.391 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 176 ;35.102 ;23.523 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 608 ;15.113 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 23 ;17.544 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 550 ; 0.088 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 4224 ; 0.007 ; 0.021 REMARK 3 GENERAL PLANES OTHERS (A): 881 ; 0.002 ; 0.020 REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 1808 ; 3.070 ; 4.569 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): 1807 ; 3.064 ; 4.567 REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2258 ; 4.623 ; 6.833 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 1988 ; 3.638 ; 4.945 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE REMARK 3 RIDING POSITIONS. REMARK 3 U VALUES REFINED INDIVIDUALLY REMARK 3 SOME SIDE CHAINS REMOVED AND SOME OF THE RESIDUES HAVE REMARK 3 ALTERNATIVE CONFIRMATION. REMARK 4 REMARK 4 5A1F COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 29-APR-15. REMARK 100 THE PDBE ID CODE IS EBI-63710. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 06-MAR-15 REMARK 200 TEMPERATURE (KELVIN) : 287 REMARK 200 PH : 8 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : DIAMOND REMARK 200 BEAMLINE : I02 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.91742 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD (QUANTUM 315) REMARK 200 DETECTOR MANUFACTURER : ADSC REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : SCALA REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 52970 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.10 REMARK 200 RESOLUTION RANGE LOW (A) : 19.77 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.6 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 100.0 REMARK 200 DATA REDUNDANCY : 11.5 REMARK 200 R MERGE (I) : 0.09 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 19.14 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.10 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.18 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 11.5 REMARK 200 R MERGE FOR SHELL (I) : 0.09 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 2.42 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: CCP4I REMARK 200 STARTING MODEL: PDB ENTRY 4GIO REMARK 200 REMARK 200 REMARK: NONE REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 70.37 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 4.18 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.1M HEPES PH 8.0, 0.8M REMARK 280 POTASSIUM PHOSPHATE-DIBASIC, 0.8M SODIUM PHOSPHATE REMARK 280 MONOBASIC REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 65 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+2/3 REMARK 290 3555 -X+Y,-X,Z+1/3 REMARK 290 4555 -X,-Y,Z+1/2 REMARK 290 5555 Y,-X+Y,Z+1/6 REMARK 290 6555 X-Y,X,Z+5/6 REMARK 290 7555 Y,X,-Z+2/3 REMARK 290 8555 X-Y,-Y,-Z REMARK 290 9555 -X,-X+Y,-Z+1/3 REMARK 290 10555 -Y,-X,-Z+1/6 REMARK 290 11555 -X+Y,Y,-Z+1/2 REMARK 290 12555 X,X-Y,-Z+5/6 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 101.41933 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 50.70967 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 76.06450 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 25.35483 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 126.77417 REMARK 290 SMTRY1 7 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 7 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 101.41933 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 9 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 9 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 9 0.000000 0.000000 -1.000000 50.70967 REMARK 290 SMTRY1 10 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 10 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 10 0.000000 0.000000 -1.000000 25.35483 REMARK 290 SMTRY1 11 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 11 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 11 0.000000 0.000000 -1.000000 76.06450 REMARK 290 SMTRY1 12 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 12 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 12 0.000000 0.000000 -1.000000 126.77417 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 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 LYS A 100 REMARK 465 LEU A 101 REMARK 465 ALA A 374 REMARK 465 GLY A 443 REMARK 465 LYS A 444 REMARK 465 ILE A 445 REMARK 465 LYS A 446 REMARK 465 LEU A 447 REMARK 465 SER A 754 REMARK 465 TYR A 755 REMARK 465 ASN A 756 REMARK 465 GLU A 757 REMARK 465 TRP A 758 REMARK 465 ALA A 759 REMARK 465 LEU A 760 REMARK 465 ASN A 761 REMARK 465 VAL A 762 REMARK 465 ASN A 763 REMARK 465 GLU A 764 REMARK 465 ALA A 765 REMARK 465 LEU A 766 REMARK 465 GLU A 767 REMARK 465 ALA A 768 REMARK 465 LYS A 769 REMARK 465 ILE A 770 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 GLU A 40 CG CD OE1 OE2 REMARK 470 LEU A 81 CG CD1 CD2 REMARK 470 ARG A 86 CG CD NE CZ NH1 NH2 REMARK 470 VAL A 99 CG1 CG2 REMARK 470 GLU A 404 CG CD OE1 OE2 REMARK 470 LYS A 432 CG CD CE NZ REMARK 470 PHE A 434 CG CD1 CD2 CE1 CE2 CZ REMARK 470 ASP A 442 CG OD1 OD2 REMARK 470 GLU A 450 CG CD OE1 OE2 REMARK 470 GLU A 452 CG CD OE1 OE2 REMARK 470 GLN A 545 CG CD OE1 NE2 REMARK 470 LYS A 653 CE NZ REMARK 470 LYS A 720 CG CD CE NZ REMARK 470 LYS A 749 CE NZ REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 OE1 GLU A 515 O2 EDO A 1764 2.16 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 TRP A 70 97.09 -68.02 REMARK 500 LEU A 93 -3.19 60.77 REMARK 500 PHE A 434 -72.85 -83.70 REMARK 500 PHE A 493 -9.20 77.55 REMARK 500 ALA A 538 68.63 -152.68 REMARK 500 HIS A 550 32.55 -141.46 REMARK 500 PHE A 700 -54.96 -149.09 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE FOLLOWING SOLVENT MOLECULES LIE FARTHER THAN EXPECTED REMARK 525 FROM THE PROTEIN OR NUCLEIC ACID MOLECULE AND ARE REMARK 525 ASSOCIATED WITH A SYMMETRY RELATED MOLECULE (M=MODEL REMARK 525 NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): THESE HAVE BEEN REPOSITIONED REMARK 525 BY APPLYING THE SYMMETRY TRANSFORMATION INDICATED. REMARK 525 REMARK 525 M RES CSSEQI ORIGINAL COORDINATES SYMMETRY TRANS. DIST. REMARK 525 X Y Z REMARK 525 HOH W 88 103.660 80.163 12.483 009 765 4.16 REMARK 525 HOH W 77 109.279 74.475 18.857 009 765 4.19 REMARK 525 HOH W 117 45.653 57.170 -15.103 008 665 2.67 REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 MN A1757 MN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 ASN A 91 OD1 REMARK 620 2 THR A 416 O 114.7 REMARK 620 3 GLU A 419 O 104.2 66.3 REMARK 620 N 1 2 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 MN A1758 MN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLU A 501 OE2 REMARK 620 2 HIS A 499 NE2 100.0 REMARK 620 3 OGA A1756 O2' 170.9 88.5 REMARK 620 4 HOH A2098 O 93.0 88.7 84.0 REMARK 620 5 HIS A 587 NE2 82.1 88.4 101.5 173.7 REMARK 620 6 OGA A1756 O1 92.2 167.7 79.3 91.0 93.1 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A1754 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 692 SG REMARK 620 2 CYS A 715 SG 117.1 REMARK 620 3 HIS A 718 ND1 113.4 97.7 REMARK 620 4 CYS A 695 SG 106.9 112.5 109.0 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A1755 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 725 SG REMARK 620 2 CYS A 706 SG 103.3 REMARK 620 3 CYS A 708 SG 111.8 115.6 REMARK 620 4 CYS A 723 SG 107.3 111.5 107.2 REMARK 620 N 1 2 3 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN A1754 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN A1755 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE OGA A1756 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MN A1757 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MN A1758 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PO4 A1759 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EPE A1760 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A1761 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A1762 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A1763 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A1764 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A1765 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A1766 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A1767 DBREF 5A1F A 26 101 UNP Q9UGL1 KDM5B_HUMAN 26 101 DBREF 5A1F A 374 770 UNP Q9UGL1 KDM5B_HUMAN 374 770 SEQADV 5A1F SER A -1 UNP Q9UGL1 EXPRESSION TAG SEQADV 5A1F MET A 0 UNP Q9UGL1 EXPRESSION TAG SEQRES 1 A 475 SER MET PHE LEU PRO PRO PRO GLU CYS PRO VAL PHE GLU SEQRES 2 A 475 PRO SER TRP GLU GLU PHE ALA ASP PRO PHE ALA PHE ILE SEQRES 3 A 475 HIS LYS ILE ARG PRO ILE ALA GLU GLN THR GLY ILE CYS SEQRES 4 A 475 LYS VAL ARG PRO PRO PRO ASP TRP GLN PRO PRO PHE ALA SEQRES 5 A 475 CYS ASP VAL ASP LYS LEU HIS PHE THR PRO ARG ILE GLN SEQRES 6 A 475 ARG LEU ASN GLU LEU GLU ALA GLN THR ARG VAL LYS LEU SEQRES 7 A 475 ALA ARG ASP TYR THR LEU ARG THR PHE GLY GLU MET ALA SEQRES 8 A 475 ASP ALA PHE LYS SER ASP TYR PHE ASN MET PRO VAL HIS SEQRES 9 A 475 MET VAL PRO THR GLU LEU VAL GLU LYS GLU PHE TRP ARG SEQRES 10 A 475 LEU VAL SER THR ILE GLU GLU ASP VAL THR VAL GLU TYR SEQRES 11 A 475 GLY ALA ASP ILE ALA SER LYS GLU PHE GLY SER GLY PHE SEQRES 12 A 475 PRO VAL ARG ASP GLY LYS ILE LYS LEU SER PRO GLU GLU SEQRES 13 A 475 GLU GLU TYR LEU ASP SER GLY TRP ASN LEU ASN ASN MET SEQRES 14 A 475 PRO VAL MET GLU GLN SER VAL LEU ALA HIS ILE THR ALA SEQRES 15 A 475 ASP ILE CYS GLY MET LYS LEU PRO TRP LEU TYR VAL GLY SEQRES 16 A 475 MET CYS PHE SER SER PHE CYS TRP HIS ILE GLU ASP HIS SEQRES 17 A 475 TRP SER TYR SER ILE ASN TYR LEU HIS TRP GLY GLU PRO SEQRES 18 A 475 LYS THR TRP TYR GLY VAL PRO GLY TYR ALA ALA GLU GLN SEQRES 19 A 475 LEU GLU ASN VAL MET LYS LYS LEU ALA PRO GLU LEU PHE SEQRES 20 A 475 VAL SER GLN PRO ASP LEU LEU HIS GLN LEU VAL THR ILE SEQRES 21 A 475 MET ASN PRO ASN THR LEU MET THR HIS GLU VAL PRO VAL SEQRES 22 A 475 TYR ARG THR ASN GLN CYS ALA GLY GLU PHE VAL ILE THR SEQRES 23 A 475 PHE PRO ARG ALA TYR HIS SER GLY PHE ASN GLN GLY PHE SEQRES 24 A 475 ASN PHE ALA GLU ALA VAL ASN PHE CYS THR VAL ASP TRP SEQRES 25 A 475 LEU PRO LEU GLY ARG GLN CYS VAL GLU HIS TYR ARG LEU SEQRES 26 A 475 LEU HIS ARG TYR CYS VAL PHE SER HIS ASP GLU MET ILE SEQRES 27 A 475 CYS LYS MET ALA SER LYS ALA ASP VAL LEU ASP VAL VAL SEQRES 28 A 475 VAL ALA SER THR VAL GLN LYS ASP MET ALA ILE MET ILE SEQRES 29 A 475 GLU ASP GLU LYS ALA LEU ARG GLU THR VAL ARG LYS LEU SEQRES 30 A 475 GLY VAL ILE ASP SER GLU ARG MET ASP PHE GLU LEU LEU SEQRES 31 A 475 PRO ASP ASP GLU ARG GLN CYS VAL LYS CYS LYS THR THR SEQRES 32 A 475 CYS PHE MET SER ALA ILE SER CYS SER CYS LYS PRO GLY SEQRES 33 A 475 LEU LEU VAL CYS LEU HIS HIS VAL LYS GLU LEU CYS SER SEQRES 34 A 475 CYS PRO PRO TYR LYS TYR LYS LEU ARG TYR ARG TYR THR SEQRES 35 A 475 LEU ASP ASP LEU TYR PRO MET MET ASN ALA LEU LYS LEU SEQRES 36 A 475 ARG ALA GLU SER TYR ASN GLU TRP ALA LEU ASN VAL ASN SEQRES 37 A 475 GLU ALA LEU GLU ALA LYS ILE HET ZN A1754 1 HET ZN A1755 1 HET OGA A1756 10 HET MN A1757 1 HET MN A1758 1 HET PO4 A1759 5 HET EPE A1760 15 HET EDO A1761 4 HET EDO A1762 4 HET EDO A1763 4 HET EDO A1764 4 HET EDO A1765 4 HET EDO A1766 4 HET EDO A1767 4 HETNAM EDO 1,2-ETHANEDIOL HETNAM OGA N-OXALYLGLYCINE HETNAM EPE 4-(2-HYDROXYETHYL)-1-PIPERAZINE HETNAM 2 EPE ETHANESULFONIC ACID HETNAM MN MANGANESE (II) ION HETNAM PO4 PHOSPHATE ION HETNAM ZN ZINC ION HETSYN EDO ETHYLENE GLYCOL HETSYN EPE HEPES FORMUL 2 EDO 7(C2 H6 O2) FORMUL 3 OGA C4 H5 N O5 FORMUL 4 EPE C8 H18 N2 O4 S FORMUL 5 MN 2(MN 2+) FORMUL 6 PO4 O4 P 3- FORMUL 7 ZN 2(ZN 2+) FORMUL 8 HOH *204(H2 O) HELIX 1 1 SER A 38 ALA A 43 1 6 HELIX 2 2 ASP A 44 GLU A 57 1 14 HELIX 3 3 LEU A 379 ASN A 395 1 17 HELIX 4 4 PRO A 397 VAL A 401 5 5 HELIX 5 5 PRO A 402 THR A 416 1 15 HELIX 6 6 SER A 448 SER A 457 1 10 HELIX 7 7 ASN A 462 MET A 467 1 6 HELIX 8 8 SER A 470 ILE A 475 5 6 HELIX 9 9 ILE A 479 LEU A 484 1 6 HELIX 10 10 GLU A 501 SER A 505 5 5 HELIX 11 11 PRO A 523 TYR A 525 5 3 HELIX 12 12 ALA A 526 ALA A 538 1 13 HELIX 13 13 PRO A 539 VAL A 543 5 5 HELIX 14 14 ASP A 547 HIS A 550 5 4 HELIX 15 15 ASN A 557 HIS A 564 1 8 HELIX 16 16 TRP A 607 HIS A 622 1 16 HELIX 17 17 SER A 628 SER A 638 1 11 HELIX 18 18 LYS A 639 LEU A 643 5 5 HELIX 19 19 ASP A 644 LEU A 672 1 29 HELIX 20 20 ASP A 681 LEU A 685 5 5 HELIX 21 21 PRO A 686 ARG A 690 5 5 HELIX 22 22 HIS A 718 LEU A 722 5 5 HELIX 23 23 PRO A 726 TYR A 728 5 3 HELIX 24 24 THR A 737 GLU A 753 1 17 SHEET 1 AA 8 VAL A 34 PHE A 35 0 SHEET 2 AA 8 ILE A 61 VAL A 64 1 O LYS A 63 N PHE A 35 SHEET 3 AA 8 PHE A 578 THR A 581 -1 O PHE A 578 N VAL A 64 SHEET 4 AA 8 TYR A 506 GLY A 514 -1 O SER A 507 N THR A 581 SHEET 5 AA 8 ASN A 595 PHE A 602 -1 O PHE A 596 N HIS A 512 SHEET 6 AA 8 TRP A 486 GLY A 490 -1 O TRP A 486 N ALA A 599 SHEET 7 AA 8 THR A 422 ILE A 429 -1 O GLY A 426 N VAL A 489 SHEET 8 AA 8 ARG A 86 ARG A 89 -1 O ARG A 86 N TYR A 425 SHEET 1 AB 2 HIS A 82 PHE A 83 0 SHEET 2 AB 2 TYR A 377 THR A 378 -1 O TYR A 377 N PHE A 83 SHEET 1 AC 2 GLN A 96 THR A 97 0 SHEET 2 AC 2 LEU A 552 VAL A 553 -1 O VAL A 553 N GLN A 96 SHEET 1 AD 4 SER A 495 HIS A 499 0 SHEET 2 AD 4 HIS A 587 ASN A 591 -1 O HIS A 587 N HIS A 499 SHEET 3 AD 4 LYS A 517 GLY A 521 -1 O THR A 518 N PHE A 590 SHEET 4 AD 4 TYR A 569 GLN A 573 -1 O TYR A 569 N GLY A 521 SHEET 1 AE 3 ASP A 676 ARG A 679 0 SHEET 2 AE 3 TYR A 730 TYR A 734 1 O TYR A 730 N ASP A 676 SHEET 3 AE 3 SER A 702 CYS A 706 -1 O ALA A 703 N ARG A 733 LINK ZN ZN A1754 SG CYS A 692 1555 1555 2.22 LINK ZN ZN A1754 SG CYS A 715 1555 1555 2.23 LINK ZN ZN A1754 ND1 HIS A 718 1555 1555 2.19 LINK ZN ZN A1754 SG CYS A 695 1555 1555 2.41 LINK ZN ZN A1755 SG CYS A 723 1555 1555 2.36 LINK ZN ZN A1755 SG CYS A 708 1555 1555 2.27 LINK ZN ZN A1755 SG CYS A 706 1555 1555 2.31 LINK ZN ZN A1755 SG CYS A 725 1555 1555 2.53 LINK O2' OGA A1756 MN MN A1758 1555 1555 2.06 LINK O1 OGA A1756 MN MN A1758 1555 1555 2.20 LINK MN MN A1757 OD1 ASN A 91 1555 1555 2.62 LINK MN MN A1757 O THR A 416 1555 1555 2.76 LINK MN MN A1757 O GLU A 419 1555 1555 2.76 LINK MN MN A1758 NE2 HIS A 587 1555 1555 2.17 LINK MN MN A1758 O HOH A2098 1555 1555 1.90 LINK MN MN A1758 NE2 HIS A 499 1555 1555 2.22 LINK MN MN A1758 OE2 GLU A 501 1555 1555 2.06 SITE *** AC1 4 CYS A 692 CYS A 695 CYS A 715 HIS A 718 SITE *** AC2 4 CYS A 706 CYS A 708 CYS A 723 CYS A 725 SITE *** AC3 14 PHE A 496 HIS A 499 GLU A 501 SER A 507 SITE *** AC3 14 ASN A 509 LYS A 517 TRP A 519 HIS A 587 SITE *** AC3 14 ALA A 599 MN A1758 EDO A1765 EDO A1766 SITE *** AC3 14 HOH A2098 HOH A2203 SITE *** AC4 5 LEU A 90 ASN A 91 LEU A 413 THR A 416 SITE *** AC4 5 GLU A 419 SITE *** AC5 5 HIS A 499 GLU A 501 HIS A 587 OGA A1756 SITE *** AC5 5 HOH A2098 SITE *** AC6 4 HIS A 622 LYS A 694 HIS A 718 HOH A2143 SITE *** AC7 16 ILE A 500 TRP A 504 GLU A 531 MET A 534 SITE *** AC7 16 LEU A 541 LEU A 552 VAL A 553 ARG A 584 SITE *** AC7 16 TYR A 586 HIS A 617 TYR A 618 LEU A 621 SITE *** AC7 16 ARG A 623 HOH A2096 HOH A2101 HOH A2149 SITE *** AC8 7 ILE A 475 ALA A 477 PHE A 627 SER A 628 SITE *** AC8 7 GLU A 631 MET A 632 HOH A2184 SITE *** AC9 9 ASP A 688 GLU A 689 ARG A 690 GLN A 691 SITE *** AC9 9 VAL A 693 GLY A 711 LEU A 712 LEU A 713 SITE *** AC9 9 HOH A2204 SITE *** BC1 4 VAL A 674 ILE A 675 HOH A2167 HOH A2171 SITE *** BC2 8 ALA A 386 ASP A 387 LYS A 390 MET A 491 SITE *** BC2 8 CYS A 492 GLU A 515 GLY A 593 PHE A 594 SITE *** BC3 7 TYR A 425 SER A 494 SER A 495 LYS A 517 SITE *** BC3 7 ASN A 591 OGA A1756 HOH A2203 SITE *** BC4 6 TYR A 488 GLU A 501 ASN A 601 OGA A1756 SITE *** BC4 6 HOH A2090 HOH A2098 SITE *** BC5 6 ASP A 630 CYS A 699 PHE A 700 MET A 701 SITE *** BC5 6 SER A 702 HOH A2154 CRYST1 141.855 141.855 152.129 90.00 90.00 120.00 P 65 2 2 1 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 0.007049 0.004070 0.000000 0.00000 SCALE2 0.000000 0.008140 0.000000 0.00000 SCALE3 0.000000 0.000000 0.006573 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 499 HIS HE2 : A 499 HIS NE2 : A1758 MNMN :(H bumps) USER MOD NoAdj-H: A 587 HIS HE2 : A 587 HIS NE2 : A1758 MNMN :(H bumps) USER MOD NoAdj-H: A 718 HIS HD1 : A 718 HIS ND1 : A1754 ZNZN :(H bumps) USER MOD NoAdj-H: A1756 OGA H3 : A1756 OGA O3 : A1756 OGA C5 :(short bond) USER MOD NoAdj-H: A1756 OGA H2 : A1756 OGA O2 : A1756 OGA C1 :(short bond) USER MOD NoAdj-H: A1760 EPEHOS3 : A1760 EPE O3S : A1760 EPE S :(short bond) USER MOD Set 1.1: A 736 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 744 MET CE :methyl 170:sc= 0 (180deg=-0.118) USER MOD Set 2.1: A 634 CYS SG : rot 77:sc=0.000993 USER MOD Set 2.2: A 655 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.3: A 658 MET CE :methyl -121:sc= -0.383 (180deg=-0.546) USER MOD Set 2.4: A 701 MET CE :methyl -116:sc= -0.0635 (180deg=-1.16) USER MOD Set 3.1: A 506 TYR OH : rot 166:sc= 0 USER MOD Set 3.2: A 604 THR OG1 : rot -94:sc= 0.148 USER MOD Set 4.1: A 494 SER OG : rot -63:sc= 0.963 USER MOD Set 4.2: A 517 LYS NZ :NH3+ 173:sc= 1.55 (180deg=1.02) USER MOD Set 4.3: A 591 ASN : amide:sc= 1.49 K(o=7.2,f=-6.7!) USER MOD Set 4.4: A 595 ASN : amide:sc= 1.27 K(o=7.2,f=1.4!) USER MOD Set 4.5: A1765 EDO O2 : rot 123:sc= 1.92 USER MOD Set 5.1: A 507 SER OG : rot 169:sc= 2.25 USER MOD Set 5.2: A 581 THR OG1 : rot -92:sc= 1.42 USER MOD Set 6.1: A 63 LYS NZ :NH3+ -119:sc= 1.3 (180deg=-0.648) USER MOD Set 6.2: A 571 THR OG1 : rot 180:sc= 0 USER MOD Set 7.1: A 518 THR OG1 : rot -69:sc= 1.35 USER MOD Set 7.2: A 572 ASN : amide:sc= 1.19 K(o=3.3,f=-1.9!) USER MOD Set 7.3: A 592 GLN : amide:sc= 0.754 K(o=3.3,f=-1.7!) USER MOD Set 8.1: A 509 ASN : amide:sc= -0.152 K(o=0.38,f=-3.1!) USER MOD Set 8.2: A 573 GLN : amide:sc= 0.528 K(o=0.38,f=-3.9!) USER MOD Set 9.1: A 488 TYR OH : rot -153:sc= 1.34 USER MOD Set 9.2: A1766 EDO O1 : rot 109:sc= 1.45 USER MOD Set10.1: A 482 MET CE :methyl -135:sc= -0.0591 (180deg=-0.693) USER MOD Set10.2: A 505 SER OG : rot -82:sc= 0.0234 USER MOD Set10.3: A 601 ASN : amide:sc= 0.968 K(o=2,f=0.57) USER MOD Set10.4: A1766 EDO O2 : rot -109:sc= 1.03 USER MOD Set11.1: A 474 HIS : no HD1:sc= 0.224 K(o=0.042,f=-1.3) USER MOD Set11.2: A 636 MET CE :methyl 157:sc= -0.182 (180deg=-0.0526) USER MOD Set12.1: A 436 SER OG : rot 64:sc= 1.72 USER MOD Set12.2: A 460 ASN : amide:sc= 1.19 K(o=3.9,f=-2.5!) USER MOD Set12.3: A 462 ASN : amide:sc= 1.02 K(o=3.9,f=1.8) USER MOD Set13.1: A 378 THR OG1 : rot 180:sc= 0.26 USER MOD Set13.2: A 381 THR OG1 : rot 160:sc= 0.432 USER MOD Set14.1: A 377 TYR OH : rot -145:sc= 1.34 USER MOD Set14.2: A 385 MET CE :methyl -144:sc= -0.222 (180deg=-0.573) USER MOD Set15.1: A 88 GLN : amide:sc= 1.48 K(o=2,f=-3.2!) USER MOD Set15.2: A 96 GLN : amide:sc= 0.502 K(o=2,f=0.44) USER MOD Set15.3: A 495 SER OG : rot 180:sc= 0 USER MOD Set16.1: A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set16.2: A 408 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.037) USER MOD Single : A -1 SER N :NH3+ -126:sc= 0.176 (180deg=-1.22) USER MOD Single : A -1 SER OG : rot 180:sc= 0.0945 USER MOD Single : A 32 CYS SG : rot 61:sc= -0.99 USER MOD Single : A 38 SER OG : rot 180:sc= 0.0548 USER MOD Single : A 50 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 165:sc= 0.0494 (180deg=0.0292) USER MOD Single : A 58 GLN : amide:sc= -0.0759 X(o=-0.076,f=-0.076) USER MOD Single : A 59 THR OG1 : rot 103:sc= 0.774 USER MOD Single : A 62 CYS SG : rot -170:sc= 0 USER MOD Single : A 71 GLN : amide:sc=-0.00487 X(o=-0.0049,f=-0.036) USER MOD Single : A 76 CYS SG : rot -123:sc= 0.0383 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 HIS A: no HE2:sc=-0.00577 K(o=-0.0058,f=-0.54) USER MOD Single : A 82 HIS B: no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 84 THR OG1 : rot -71:sc= 0.0881 USER MOD Single : A 91 ASN : amide:sc= 0.912 K(o=0.91,f=-0.1) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 390 LYS NZ :NH3+ -159:sc= 1.8 (180deg=1.18) USER MOD Single : A 391 SER OG : rot 39:sc= 0.277 USER MOD Single : A 393 TYR OH : rot -15:sc= 1.26 USER MOD Single : A 395 ASN : amide:sc= -0.33 X(o=-0.33,f=-0.66) USER MOD Single : A 396 MET CE :methyl -175:sc= -1.59 (180deg=-1.61) USER MOD Single : A 399 HIS : no HD1:sc= -0.134 X(o=-0.13,f=-0.037) USER MOD Single : A 400 MET CE :methyl 147:sc= -0.441 (180deg=-1.7!) USER MOD Single : A 403 THR OG1 : rot 180:sc= 0 USER MOD Single : A 415 SER OG : rot 96:sc= 0.0504 USER MOD Single : A 416 THR OG1 : rot 75:sc= 0.463 USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 425 TYR OH : rot 180:sc= 0 USER MOD Single : A 431 SER OG : rot 180:sc= 0 USER MOD Single : A 448 SER OG : rot -96:sc= 0.0939 USER MOD Single : A 454 TYR OH : rot 180:sc= 0.535 USER MOD Single : A 457 SER OG : rot 180:sc= 0.0361 USER MOD Single : A 463 ASN : amide:sc= 1.32 K(o=1.3,f=-0.54) USER MOD Single : A 464 MET CE :methyl -147:sc= -1.11 (180deg=-1.95) USER MOD Single : A 467 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 469 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 470 SER OG : rot 180:sc= 0.0176 USER MOD Single : A 476 THR OG1 : rot 180:sc= 0 USER MOD Single : A 480 CYS SG : rot 81:sc= 0.155 USER MOD Single : A 483 LYS NZ :NH3+ -161:sc= 0.594 (180deg=0.412) USER MOD Single : A 491 MET CE :methyl -147:sc= -0.267 (180deg=-0.522) USER MOD Single : A 492 CYS SG : rot -93:sc= 0.0563 USER MOD Single : A 497 CYS SG : rot -170:sc= 0 USER MOD Single : A 503 HIS : no HE2:sc= 1.18 K(o=1.2,f=-5.3!) USER MOD Single : A 510 TYR OH : rot 180:sc= -0.313 USER MOD Single : A 512 HIS : no HD1:sc= 0.67 K(o=0.67,f=-2.5!) USER MOD Single : A 520 TYR OH : rot 25:sc= 1.56 USER MOD Single : A 525 TYR OH : rot 180:sc= 0 USER MOD Single : A 529 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 532 ASN : amide:sc= -0.0193 K(o=-0.019,f=-1.1!) USER MOD Single : A 534 MET CE :methyl -179:sc= -2.26 (180deg=-2.34) USER MOD Single : A 535 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 536 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 544 SER OG : rot 180:sc= 0.00354 USER MOD Single : A 550 HIS : no HD1:sc= -0.42 K(o=-0.42,f=-1.9) USER MOD Single : A 551 GLN : amide:sc= 0.671 K(o=0.67,f=-4!) USER MOD Single : A 554 THR OG1 : rot 54:sc= 1.13 USER MOD Single : A 556 MET CE :methyl -166:sc= -1.78 (180deg=-2.61) USER MOD Single : A 557 ASN : amide:sc= 0.555 K(o=0.56,f=-6.4!) USER MOD Single : A 559 ASN : amide:sc= 0.449 K(o=0.45,f=-4.3!) USER MOD Single : A 560 THR OG1 : rot 180:sc= 0 USER MOD Single : A 562 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 563 THR OG1 : rot 81:sc= 0.295 USER MOD Single : A 564 HIS : no HD1:sc= -0.463 K(o=-0.46,f=0.099) USER MOD Single : A 569 TYR OH : rot 180:sc= 0 USER MOD Single : A 574 CYS SG : rot 180:sc= 0 USER MOD Single : A 586 TYR OH : rot 175:sc= 1.2 USER MOD Single : A 588 SER OG : rot -123:sc= 1.15 USER MOD Single : A 603 CYS SG : rot -113:sc= 0.261 USER MOD Single : A 613 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 614 CYS SG : rot 104:sc= 0.753 USER MOD Single : A 617 HIS : no HD1:sc= 0 X(o=0,f=-0.00031) USER MOD Single : A 618 TYR OH : rot 3:sc= 1.92 USER MOD Single : A 622 HIS : no HD1:sc= 0.842 K(o=0.84,f=-3.9!) USER MOD Single : A 624 TYR OH : rot 42:sc= 0.00271 USER MOD Single : A 625 CYS SG : rot 45:sc= 1.04 USER MOD Single : A 628 SER OG : rot 83:sc= 1.58 USER MOD Single : A 629 HIS : no HD1:sc= 1.66 K(o=1.7,f=-3.1!) USER MOD Single : A 632 MET CE :methyl 172:sc= 0 (180deg=-0.0251) USER MOD Single : A 635 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 638 SER OG : rot -47:sc= 1.24 USER MOD Single : A 639 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 649 SER OG : rot 180:sc= 0 USER MOD Single : A 650 THR OG1 : rot 80:sc= 0.94 USER MOD Single : A 652 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 663 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 668 THR OG1 : rot 74:sc= 0.0169 USER MOD Single : A 671 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 677 SER OG : rot 180:sc= 0 USER MOD Single : A 680 MET CE :methyl -113:sc= -4.35! (180deg=-5.64!) USER MOD Single : A 691 GLN : amide:sc= -0.0697 K(o=-0.07,f=-1.4!) USER MOD Single : A 694 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 696 LYS NZ :NH3+ -143:sc= 0.066 (180deg=0) USER MOD Single : A 697 THR OG1 : rot 89:sc= 1.37 USER MOD Single : A 698 THR OG1 : rot 170:sc= 2.31 USER MOD Single : A 699 CYS SG : rot 180:sc= 0 USER MOD Single : A 702 SER OG : rot -100:sc= 1.34 USER MOD Single : A 705 SER OG : rot 94:sc= -0.414 USER MOD Single : A 707 SER OG : rot 180:sc= 0 USER MOD Single : A 709 LYS NZ :NH3+ -159:sc= 0.225 (180deg=0.055) USER MOD Single : A 717 HIS : no HD1:sc= -0.0702 X(o=-0.07,f=-0.44) USER MOD Single : A 724 SER OG : rot 180:sc= 0.00423 USER MOD Single : A 728 TYR OH : rot 180:sc= 0 USER MOD Single : A 729 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 730 TYR OH : rot -25:sc= 0.437 USER MOD Single : A 731 LYS NZ :NH3+ 178:sc= 0.00747 (180deg=-0.000574) USER MOD Single : A 734 TYR OH : rot 180:sc= 0 USER MOD Single : A 737 THR OG1 : rot 180:sc= 0.244 USER MOD Single : A 742 TYR OH : rot 16:sc= 0.128 USER MOD Single : A 745 MET CE :methyl -122:sc= 0 (180deg=-0.00435) USER MOD Single : A 746 ASN : amide:sc=-0.00854 X(o=-0.0085,f=0) USER MOD Single : A1760 EPE O8 : rot 44:sc= 1.9 USER MOD Single : A1761 EDO O1 : rot 93:sc= 0.801 USER MOD Single : A1761 EDO O2 : rot 160:sc= 0 USER MOD Single : A1762 EDO O1 : rot -98:sc= 1.02 USER MOD Single : A1762 EDO O2 : rot -173:sc= 1.31 USER MOD Single : A1763 EDO O1 : rot -91:sc= 1.13 USER MOD Single : A1763 EDO O2 : rot 36:sc= 1.29 USER MOD Single : A1764 EDO O1 : rot -73:sc= 1.32 USER MOD Single : A1764 EDO O2 : rot -29:sc= -0.648! USER MOD Single : A1765 EDO O1 : rot -98:sc= 1.97 USER MOD Single : A1767 EDO O1 : rot 130:sc= 1.25 USER MOD Single : A1767 EDO O2 : rot 171:sc= 2.43 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A -1 104.787 78.702 -0.864 1.00 77.77 N ATOM 2 CA SER A -1 105.039 78.081 -2.188 1.00 74.46 C ATOM 3 C SER A -1 104.559 76.646 -2.187 1.00 78.99 C ATOM 4 O SER A -1 103.688 76.285 -2.986 1.00 94.88 O ATOM 5 CB SER A -1 106.521 78.165 -2.569 1.00 74.64 C ATOM 6 OG SER A -1 107.325 78.391 -1.425 1.00 76.86 O ATOM 0 H1 SER A -1 104.322 79.453 -0.972 1.00 77.77 H new ATOM 0 H2 SER A -1 104.324 78.138 -0.354 1.00 77.77 H new ATOM 0 H3 SER A -1 105.563 78.888 -0.471 1.00 77.77 H new ATOM 0 HA SER A -1 104.540 78.575 -2.858 1.00 74.46 H new ATOM 0 HB2 SER A -1 106.794 77.342 -3.004 1.00 74.64 H new ATOM 0 HB3 SER A -1 106.654 78.881 -3.209 1.00 74.64 H new ATOM 0 HG SER A -1 108.132 78.432 -1.653 1.00 76.86 H new ATOM 7 N MET A 0 105.096 75.833 -1.277 1.00 75.15 N ATOM 8 CA MET A 0 104.666 74.442 -1.190 1.00 71.27 C ATOM 9 C MET A 0 103.286 74.374 -0.522 1.00 58.47 C ATOM 10 O MET A 0 102.339 73.995 -1.188 1.00 61.27 O ATOM 11 CB MET A 0 105.701 73.556 -0.507 1.00 77.41 C ATOM 12 CG MET A 0 105.740 72.167 -1.113 1.00 81.63 C ATOM 13 SD MET A 0 107.183 71.259 -0.554 1.00 97.83 S ATOM 14 CE MET A 0 106.753 70.851 1.144 1.00 91.90 C ATOM 0 H MET A 0 105.700 76.064 -0.710 1.00 75.15 H new ATOM 0 HA MET A 0 104.585 74.084 -2.088 1.00 71.27 H new ATOM 0 HB2 MET A 0 106.577 73.966 -0.581 1.00 77.41 H new ATOM 0 HB3 MET A 0 105.497 73.491 0.439 1.00 77.41 H new ATOM 0 HG2 MET A 0 104.935 71.682 -0.871 1.00 81.63 H new ATOM 0 HG3 MET A 0 105.751 72.233 -2.081 1.00 81.63 H new ATOM 0 HE1 MET A 0 107.477 70.350 1.550 1.00 91.90 H new ATOM 0 HE2 MET A 0 106.605 71.668 1.646 1.00 91.90 H new ATOM 0 HE3 MET A 0 105.944 70.315 1.153 1.00 91.90 H new ATOM 15 N PHE A 26 103.167 74.777 0.743 1.00 51.34 N ATOM 16 CA PHE A 26 101.850 74.908 1.410 1.00 45.46 C ATOM 17 C PHE A 26 101.659 76.314 1.956 1.00 45.47 C ATOM 18 O PHE A 26 102.463 76.790 2.743 1.00 48.90 O ATOM 19 CB PHE A 26 101.667 73.885 2.530 1.00 44.13 C ATOM 20 CG PHE A 26 100.286 73.928 3.168 1.00 41.32 C ATOM 21 CD1 PHE A 26 99.163 73.496 2.467 1.00 39.58 C ATOM 22 CD2 PHE A 26 100.107 74.434 4.441 1.00 40.32 C ATOM 23 CE1 PHE A 26 97.903 73.556 3.033 1.00 39.19 C ATOM 24 CE2 PHE A 26 98.843 74.489 5.018 1.00 39.68 C ATOM 25 CZ PHE A 26 97.738 74.044 4.312 1.00 38.42 C ATOM 0 H PHE A 26 103.836 74.983 1.243 1.00 51.34 H new ATOM 0 HA PHE A 26 101.175 74.733 0.736 1.00 45.46 H new ATOM 0 HB2 PHE A 26 101.825 72.996 2.176 1.00 44.13 H new ATOM 0 HB3 PHE A 26 102.337 74.041 3.214 1.00 44.13 H new ATOM 0 HD1 PHE A 26 99.262 73.162 1.605 1.00 39.58 H new ATOM 0 HD2 PHE A 26 100.843 74.742 4.919 1.00 40.32 H new ATOM 0 HE1 PHE A 26 97.164 73.266 2.549 1.00 39.19 H new ATOM 0 HE2 PHE A 26 98.740 74.825 5.879 1.00 39.68 H new ATOM 0 HZ PHE A 26 96.892 74.074 4.697 1.00 38.42 H new ATOM 26 N LEU A 27 100.609 76.990 1.509 1.00 41.07 N ATOM 27 CA LEU A 27 100.308 78.321 1.993 1.00 44.82 C ATOM 28 C LEU A 27 99.161 78.159 2.965 1.00 46.98 C ATOM 29 O LEU A 27 98.061 77.834 2.546 1.00 46.31 O ATOM 30 CB LEU A 27 99.939 79.241 0.846 1.00 47.34 C ATOM 31 CG LEU A 27 101.172 79.587 -0.016 1.00 53.12 C ATOM 32 CD1 LEU A 27 101.455 78.543 -1.098 1.00 53.92 C ATOM 33 CD2 LEU A 27 100.992 80.963 -0.632 1.00 54.92 C ATOM 0 H LEU A 27 100.057 76.690 0.921 1.00 41.07 H new ATOM 0 HA LEU A 27 101.075 78.726 2.426 1.00 44.82 H new ATOM 0 HB2 LEU A 27 99.264 78.817 0.293 1.00 47.34 H new ATOM 0 HB3 LEU A 27 99.548 80.057 1.196 1.00 47.34 H new ATOM 0 HG LEU A 27 101.945 79.587 0.570 1.00 53.12 H new ATOM 0 HD11 LEU A 27 102.236 78.809 -1.608 1.00 53.92 H new ATOM 0 HD12 LEU A 27 101.618 77.682 -0.682 1.00 53.92 H new ATOM 0 HD13 LEU A 27 100.690 78.476 -1.691 1.00 53.92 H new ATOM 0 HD21 LEU A 27 101.767 81.179 -1.173 1.00 54.92 H new ATOM 0 HD22 LEU A 27 100.198 80.967 -1.189 1.00 54.92 H new ATOM 0 HD23 LEU A 27 100.896 81.623 0.072 1.00 54.92 H new ATOM 34 N PRO A 28 99.420 78.339 4.273 1.00 47.18 N ATOM 35 CA PRO A 28 98.335 78.112 5.238 1.00 44.00 C ATOM 36 C PRO A 28 97.140 79.049 5.029 1.00 42.45 C ATOM 37 O PRO A 28 97.328 80.246 4.775 1.00 38.05 O ATOM 38 CB PRO A 28 99.016 78.349 6.604 1.00 47.77 C ATOM 39 CG PRO A 28 100.473 78.059 6.354 1.00 46.58 C ATOM 40 CD PRO A 28 100.707 78.597 4.958 1.00 47.86 C ATOM 0 HA PRO A 28 97.950 77.226 5.150 1.00 44.00 H new ATOM 0 HB2 PRO A 28 98.885 79.260 6.911 1.00 47.77 H new ATOM 0 HB3 PRO A 28 98.651 77.764 7.287 1.00 47.77 H new ATOM 0 HG2 PRO A 28 101.041 78.498 7.006 1.00 46.58 H new ATOM 0 HG3 PRO A 28 100.662 77.109 6.407 1.00 46.58 H new ATOM 0 HD2 PRO A 28 100.923 79.543 4.970 1.00 47.86 H new ATOM 0 HD3 PRO A 28 101.444 78.144 4.519 1.00 47.86 H new ATOM 41 N PRO A 29 95.905 78.497 5.079 1.00 37.73 N ATOM 42 CA PRO A 29 94.729 79.351 5.009 1.00 36.05 C ATOM 43 C PRO A 29 94.731 80.356 6.142 1.00 34.43 C ATOM 44 O PRO A 29 95.368 80.117 7.148 1.00 35.43 O ATOM 45 CB PRO A 29 93.579 78.368 5.210 1.00 38.27 C ATOM 46 CG PRO A 29 94.089 77.056 4.738 1.00 36.55 C ATOM 47 CD PRO A 29 95.566 77.068 4.952 1.00 39.13 C ATOM 0 HA PRO A 29 94.679 79.856 4.183 1.00 36.05 H new ATOM 0 HB2 PRO A 29 93.316 78.325 6.143 1.00 38.27 H new ATOM 0 HB3 PRO A 29 92.796 78.640 4.706 1.00 38.27 H new ATOM 0 HG2 PRO A 29 93.676 76.329 5.229 1.00 36.55 H new ATOM 0 HG3 PRO A 29 93.878 76.921 3.801 1.00 36.55 H new ATOM 0 HD2 PRO A 29 95.812 76.574 5.750 1.00 39.13 H new ATOM 0 HD3 PRO A 29 96.035 76.658 4.208 1.00 39.13 H new ATOM 48 N PRO A 30 94.000 81.451 6.005 1.00 35.65 N ATOM 49 CA PRO A 30 93.848 82.354 7.139 1.00 37.66 C ATOM 50 C PRO A 30 93.181 81.705 8.335 1.00 39.99 C ATOM 51 O PRO A 30 92.399 80.741 8.183 1.00 35.26 O ATOM 52 CB PRO A 30 92.977 83.487 6.582 1.00 38.42 C ATOM 53 CG PRO A 30 92.307 82.908 5.384 1.00 39.87 C ATOM 54 CD PRO A 30 93.240 81.898 4.822 1.00 38.55 C ATOM 0 HA PRO A 30 94.709 82.649 7.474 1.00 37.66 H new ATOM 0 HB2 PRO A 30 92.327 83.785 7.238 1.00 38.42 H new ATOM 0 HB3 PRO A 30 93.515 84.259 6.345 1.00 38.42 H new ATOM 0 HG2 PRO A 30 91.461 82.499 5.626 1.00 39.87 H new ATOM 0 HG3 PRO A 30 92.112 83.598 4.731 1.00 39.87 H new ATOM 0 HD2 PRO A 30 92.764 81.164 4.403 1.00 38.55 H new ATOM 0 HD3 PRO A 30 93.821 82.282 4.147 1.00 38.55 H new ATOM 55 N GLU A 31 93.478 82.244 9.515 1.00 39.59 N ATOM 56 CA GLU A 31 92.949 81.719 10.767 1.00 38.81 C ATOM 57 C GLU A 31 91.450 81.965 10.879 1.00 41.30 C ATOM 58 O GLU A 31 90.965 83.010 10.469 1.00 44.70 O ATOM 59 CB GLU A 31 93.664 82.347 11.977 1.00 41.88 C ATOM 60 CG GLU A 31 95.138 81.963 12.077 1.00 42.93 C ATOM 61 CD GLU A 31 95.361 80.488 12.391 1.00 42.32 C ATOM 62 OE1 GLU A 31 94.720 79.968 13.313 1.00 42.88 O ATOM 63 OE2 GLU A 31 96.193 79.834 11.732 1.00 43.72 O ATOM 0 H GLU A 31 93.993 82.926 9.610 1.00 39.59 H new ATOM 0 HA GLU A 31 93.110 80.762 10.767 1.00 38.81 H new ATOM 0 HB2 GLU A 31 93.591 83.313 11.922 1.00 41.88 H new ATOM 0 HB3 GLU A 31 93.210 82.075 12.790 1.00 41.88 H new ATOM 0 HG2 GLU A 31 95.579 82.179 11.240 1.00 42.93 H new ATOM 0 HG3 GLU A 31 95.559 82.500 12.766 1.00 42.93 H new ATOM 64 N CYS A 32 90.728 81.006 11.460 1.00 39.37 N ATOM 65 CA CYS A 32 89.305 81.180 11.730 1.00 43.73 C ATOM 66 C CYS A 32 89.163 82.012 12.998 1.00 45.43 C ATOM 67 O CYS A 32 90.136 82.157 13.736 1.00 46.76 O ATOM 68 CB CYS A 32 88.611 79.824 11.912 1.00 40.48 C ATOM 69 SG CYS A 32 88.940 79.041 13.499 1.00 38.83 S ATOM 0 H CYS A 32 91.047 80.246 11.705 1.00 39.37 H new ATOM 0 HA CYS A 32 88.884 81.628 10.980 1.00 43.73 H new ATOM 0 HB2 CYS A 32 87.654 79.945 11.814 1.00 40.48 H new ATOM 0 HB3 CYS A 32 88.896 79.227 11.202 1.00 40.48 H new ATOM 0 HG CYS A 32 88.550 79.751 14.384 1.00 38.83 H new ATOM 70 N PRO A 33 87.940 82.520 13.281 1.00 47.02 N ATOM 71 CA PRO A 33 87.696 83.303 14.495 1.00 43.15 C ATOM 72 C PRO A 33 87.927 82.506 15.753 1.00 42.26 C ATOM 73 O PRO A 33 87.646 81.307 15.778 1.00 39.81 O ATOM 74 CB PRO A 33 86.204 83.668 14.393 1.00 45.40 C ATOM 75 CG PRO A 33 85.876 83.538 12.952 1.00 46.36 C ATOM 76 CD PRO A 33 86.703 82.380 12.491 1.00 45.81 C ATOM 0 HA PRO A 33 88.294 84.064 14.550 1.00 43.15 H new ATOM 0 HB2 PRO A 33 85.659 83.074 14.932 1.00 45.40 H new ATOM 0 HB3 PRO A 33 86.040 84.570 14.711 1.00 45.40 H new ATOM 0 HG2 PRO A 33 84.930 83.374 12.817 1.00 46.36 H new ATOM 0 HG3 PRO A 33 86.096 84.347 12.464 1.00 46.36 H new ATOM 0 HD2 PRO A 33 86.262 81.533 12.662 1.00 45.81 H new ATOM 0 HD3 PRO A 33 86.879 82.421 11.538 1.00 45.81 H new ATOM 77 N VAL A 34 88.457 83.184 16.766 1.00 40.23 N ATOM 78 CA VAL A 34 88.645 82.642 18.094 1.00 41.19 C ATOM 79 C VAL A 34 87.880 83.519 19.077 1.00 42.55 C ATOM 80 O VAL A 34 87.991 84.749 19.050 1.00 44.79 O ATOM 81 CB VAL A 34 90.129 82.628 18.501 1.00 41.52 C ATOM 82 CG1 VAL A 34 90.295 81.906 19.818 1.00 39.60 C ATOM 83 CG2 VAL A 34 90.976 81.965 17.411 1.00 42.42 C ATOM 0 H VAL A 34 88.724 83.998 16.691 1.00 40.23 H new ATOM 0 HA VAL A 34 88.322 81.727 18.102 1.00 41.19 H new ATOM 0 HB VAL A 34 90.435 83.542 18.607 1.00 41.52 H new ATOM 0 HG11 VAL A 34 91.232 81.901 20.069 1.00 39.60 H new ATOM 0 HG12 VAL A 34 89.780 82.360 20.503 1.00 39.60 H new ATOM 0 HG13 VAL A 34 89.980 80.993 19.729 1.00 39.60 H new ATOM 0 HG21 VAL A 34 91.908 81.963 17.681 1.00 42.42 H new ATOM 0 HG22 VAL A 34 90.677 81.052 17.279 1.00 42.42 H new ATOM 0 HG23 VAL A 34 90.881 82.459 16.582 1.00 42.42 H new ATOM 84 N PHE A 35 87.099 82.878 19.930 1.00 43.84 N ATOM 85 CA PHE A 35 86.261 83.579 20.894 1.00 45.50 C ATOM 86 C PHE A 35 86.726 83.199 22.283 1.00 41.91 C ATOM 87 O PHE A 35 87.052 82.043 22.550 1.00 36.87 O ATOM 88 CB PHE A 35 84.767 83.219 20.721 1.00 45.08 C ATOM 89 CG PHE A 35 84.205 83.610 19.389 1.00 44.39 C ATOM 90 CD1 PHE A 35 83.894 84.932 19.122 1.00 45.95 C ATOM 91 CD2 PHE A 35 84.030 82.662 18.385 1.00 44.64 C ATOM 92 CE1 PHE A 35 83.401 85.312 17.881 1.00 49.12 C ATOM 93 CE2 PHE A 35 83.528 83.025 17.143 1.00 45.25 C ATOM 94 CZ PHE A 35 83.207 84.352 16.887 1.00 49.73 C ATOM 0 H PHE A 35 87.038 82.021 19.969 1.00 43.84 H new ATOM 0 HA PHE A 35 86.344 84.535 20.751 1.00 45.50 H new ATOM 0 HB2 PHE A 35 84.657 82.263 20.842 1.00 45.08 H new ATOM 0 HB3 PHE A 35 84.254 83.654 21.420 1.00 45.08 H new ATOM 0 HD1 PHE A 35 84.017 85.575 19.783 1.00 45.95 H new ATOM 0 HD2 PHE A 35 84.252 81.774 18.549 1.00 44.64 H new ATOM 0 HE1 PHE A 35 83.200 86.204 17.713 1.00 49.12 H new ATOM 0 HE2 PHE A 35 83.407 82.381 16.483 1.00 45.25 H new ATOM 0 HZ PHE A 35 82.865 84.599 16.058 1.00 49.73 H new ATOM 95 N GLU A 36 86.725 84.196 23.158 1.00 46.18 N ATOM 96 CA GLU A 36 87.046 84.033 24.566 1.00 51.56 C ATOM 97 C GLU A 36 85.893 84.653 25.351 1.00 53.97 C ATOM 98 O GLU A 36 85.942 85.834 25.704 1.00 54.74 O ATOM 99 CB GLU A 36 88.368 84.733 24.875 1.00 53.61 C ATOM 100 CG GLU A 36 89.548 84.208 24.063 1.00 56.67 C ATOM 101 CD GLU A 36 90.881 84.758 24.543 1.00 59.26 C ATOM 102 OE1 GLU A 36 90.877 85.724 25.328 1.00 56.93 O ATOM 103 OE2 GLU A 36 91.929 84.217 24.142 1.00 60.20 O ATOM 0 H GLU A 36 86.533 85.006 22.943 1.00 46.18 H new ATOM 0 HA GLU A 36 87.152 83.099 24.807 1.00 51.56 H new ATOM 0 HB2 GLU A 36 88.268 85.683 24.707 1.00 53.61 H new ATOM 0 HB3 GLU A 36 88.565 84.631 25.819 1.00 53.61 H new ATOM 0 HG2 GLU A 36 89.565 83.239 24.113 1.00 56.67 H new ATOM 0 HG3 GLU A 36 89.423 84.441 23.130 1.00 56.67 H new ATOM 104 N PRO A 37 84.820 83.876 25.571 1.00 55.78 N ATOM 105 CA PRO A 37 83.674 84.446 26.258 1.00 55.92 C ATOM 106 C PRO A 37 83.951 84.645 27.742 1.00 55.10 C ATOM 107 O PRO A 37 84.653 83.834 28.359 1.00 48.84 O ATOM 108 CB PRO A 37 82.597 83.376 26.071 1.00 54.31 C ATOM 109 CG PRO A 37 83.359 82.105 25.990 1.00 55.29 C ATOM 110 CD PRO A 37 84.596 82.458 25.233 1.00 54.02 C ATOM 0 HA PRO A 37 83.432 85.320 25.913 1.00 55.92 H new ATOM 0 HB2 PRO A 37 81.972 83.368 26.813 1.00 54.31 H new ATOM 0 HB3 PRO A 37 82.079 83.531 25.266 1.00 54.31 H new ATOM 0 HG2 PRO A 37 83.571 81.763 26.873 1.00 55.29 H new ATOM 0 HG3 PRO A 37 82.850 81.417 25.534 1.00 55.29 H new ATOM 0 HD2 PRO A 37 85.347 81.905 25.500 1.00 54.02 H new ATOM 0 HD3 PRO A 37 84.477 82.334 24.278 1.00 54.02 H new ATOM 111 N SER A 38 83.373 85.702 28.305 1.00 59.12 N ATOM 112 CA SER A 38 83.353 85.894 29.763 1.00 63.49 C ATOM 113 C SER A 38 82.563 84.760 30.389 1.00 58.38 C ATOM 114 O SER A 38 81.899 84.013 29.682 1.00 61.36 O ATOM 115 CB SER A 38 82.696 87.227 30.127 1.00 62.83 C ATOM 116 OG SER A 38 81.304 87.202 29.854 1.00 64.41 O ATOM 0 H SER A 38 82.983 86.327 27.861 1.00 59.12 H new ATOM 0 HA SER A 38 84.264 85.901 30.095 1.00 63.49 H new ATOM 0 HB2 SER A 38 82.841 87.416 31.067 1.00 62.83 H new ATOM 0 HB3 SER A 38 83.114 87.945 29.626 1.00 62.83 H new ATOM 0 HG SER A 38 80.964 87.941 30.062 1.00 64.41 H new ATOM 117 N TRP A 39 82.614 84.635 31.705 1.00 59.34 N ATOM 118 CA TRP A 39 81.818 83.623 32.370 1.00 62.77 C ATOM 119 C TRP A 39 80.298 83.884 32.177 1.00 63.62 C ATOM 120 O TRP A 39 79.524 82.938 32.007 1.00 62.92 O ATOM 121 CB TRP A 39 82.188 83.484 33.846 1.00 65.26 C ATOM 122 CG TRP A 39 81.749 82.163 34.353 1.00 76.44 C ATOM 123 CD1 TRP A 39 80.464 81.781 34.626 1.00 86.49 C ATOM 124 CD2 TRP A 39 82.567 81.013 34.599 1.00 78.82 C ATOM 125 NE1 TRP A 39 80.432 80.474 35.039 1.00 93.64 N ATOM 126 CE2 TRP A 39 81.708 79.974 35.036 1.00 88.64 C ATOM 127 CE3 TRP A 39 83.936 80.763 34.519 1.00 78.61 C ATOM 128 CZ2 TRP A 39 82.180 78.697 35.386 1.00 83.62 C ATOM 129 CZ3 TRP A 39 84.404 79.485 34.866 1.00 79.79 C ATOM 130 CH2 TRP A 39 83.526 78.474 35.295 1.00 80.60 C ATOM 0 H TRP A 39 83.097 85.120 32.225 1.00 59.34 H new ATOM 0 HA TRP A 39 82.023 82.773 31.950 1.00 62.77 H new ATOM 0 HB2 TRP A 39 83.147 83.580 33.958 1.00 65.26 H new ATOM 0 HB3 TRP A 39 81.770 84.192 34.361 1.00 65.26 H new ATOM 0 HD1 TRP A 39 79.718 82.330 34.543 1.00 86.49 H new ATOM 0 HE1 TRP A 39 79.725 80.038 35.264 1.00 93.64 H new ATOM 0 HE3 TRP A 39 84.526 81.427 34.242 1.00 78.61 H new ATOM 0 HZ2 TRP A 39 81.598 78.029 35.669 1.00 83.62 H new ATOM 0 HZ3 TRP A 39 85.314 79.304 34.811 1.00 79.79 H new ATOM 0 HH2 TRP A 39 83.867 77.639 35.521 1.00 80.60 H new ATOM 131 N GLU A 40 79.891 85.154 32.166 1.00 60.11 N ATOM 132 CA GLU A 40 78.499 85.522 31.908 1.00 62.21 C ATOM 133 C GLU A 40 78.046 84.976 30.534 1.00 65.52 C ATOM 134 O GLU A 40 77.028 84.292 30.455 1.00 66.01 O ATOM 135 CB GLU A 40 78.291 87.050 32.022 1.00 58.45 C ATOM 0 H GLU A 40 80.412 85.823 32.307 1.00 60.11 H new ATOM 0 HA GLU A 40 77.941 85.114 32.588 1.00 62.21 H new ATOM 136 N GLU A 41 78.831 85.238 29.485 1.00 64.27 N ATOM 137 CA GLU A 41 78.550 84.752 28.111 1.00 63.90 C ATOM 138 C GLU A 41 78.555 83.237 28.011 1.00 60.42 C ATOM 139 O GLU A 41 77.677 82.636 27.384 1.00 63.80 O ATOM 140 CB GLU A 41 79.584 85.286 27.130 1.00 63.07 C ATOM 141 CG GLU A 41 79.505 86.772 26.900 1.00 67.55 C ATOM 142 CD GLU A 41 80.687 87.290 26.112 1.00 72.78 C ATOM 143 OE1 GLU A 41 81.811 87.294 26.660 1.00 64.66 O ATOM 144 OE2 GLU A 41 80.485 87.680 24.938 1.00 83.82 O ATOM 0 H GLU A 41 79.550 85.706 29.543 1.00 64.27 H new ATOM 0 HA GLU A 41 77.663 85.077 27.892 1.00 63.90 H new ATOM 0 HB2 GLU A 41 80.470 85.066 27.458 1.00 63.07 H new ATOM 0 HB3 GLU A 41 79.475 84.831 26.280 1.00 63.07 H new ATOM 0 HG2 GLU A 41 78.685 86.981 26.426 1.00 67.55 H new ATOM 0 HG3 GLU A 41 79.463 87.228 27.755 1.00 67.55 H new ATOM 145 N PHE A 42 79.551 82.639 28.648 1.00 55.20 N ATOM 146 CA PHE A 42 79.724 81.189 28.687 1.00 55.18 C ATOM 147 C PHE A 42 78.637 80.419 29.417 1.00 58.48 C ATOM 148 O PHE A 42 78.504 79.205 29.220 1.00 65.62 O ATOM 149 CB PHE A 42 81.073 80.860 29.351 1.00 51.05 C ATOM 150 CG PHE A 42 81.569 79.467 29.088 1.00 46.67 C ATOM 151 CD1 PHE A 42 82.021 79.100 27.816 1.00 46.22 C ATOM 152 CD2 PHE A 42 81.620 78.533 30.103 1.00 44.32 C ATOM 153 CE1 PHE A 42 82.499 77.822 27.579 1.00 42.57 C ATOM 154 CE2 PHE A 42 82.091 77.264 29.863 1.00 43.78 C ATOM 155 CZ PHE A 42 82.526 76.905 28.603 1.00 41.20 C ATOM 0 H PHE A 42 80.158 83.070 29.079 1.00 55.20 H new ATOM 0 HA PHE A 42 79.680 80.904 27.761 1.00 55.18 H new ATOM 0 HB2 PHE A 42 81.738 81.493 29.038 1.00 51.05 H new ATOM 0 HB3 PHE A 42 80.989 80.987 30.309 1.00 51.05 H new ATOM 0 HD1 PHE A 42 82.000 79.720 27.123 1.00 46.22 H new ATOM 0 HD2 PHE A 42 81.333 78.764 30.957 1.00 44.32 H new ATOM 0 HE1 PHE A 42 82.800 77.585 26.732 1.00 42.57 H new ATOM 0 HE2 PHE A 42 82.117 76.643 30.555 1.00 43.78 H new ATOM 0 HZ PHE A 42 82.837 76.043 28.447 1.00 41.20 H new ATOM 156 N ALA A 43 77.897 81.091 30.293 1.00 63.40 N ATOM 157 CA ALA A 43 76.826 80.442 31.070 1.00 63.52 C ATOM 158 C ALA A 43 75.847 79.669 30.185 1.00 61.91 C ATOM 159 O ALA A 43 75.487 78.541 30.513 1.00 65.64 O ATOM 160 CB ALA A 43 76.074 81.470 31.897 1.00 66.34 C ATOM 0 H ALA A 43 77.995 81.929 30.458 1.00 63.40 H new ATOM 0 HA ALA A 43 77.254 79.801 31.658 1.00 63.52 H new ATOM 0 HB1 ALA A 43 75.373 81.029 32.402 1.00 66.34 H new ATOM 0 HB2 ALA A 43 76.688 81.905 32.509 1.00 66.34 H new ATOM 0 HB3 ALA A 43 75.680 82.133 31.309 1.00 66.34 H new ATOM 161 N ASP A 44 75.457 80.264 29.055 1.00 61.03 N ATOM 162 CA ASP A 44 74.519 79.639 28.115 1.00 59.94 C ATOM 163 C ASP A 44 75.102 79.434 26.699 1.00 48.19 C ATOM 164 O ASP A 44 75.209 80.396 25.912 1.00 46.97 O ATOM 165 CB ASP A 44 73.229 80.459 28.038 1.00 65.82 C ATOM 166 CG ASP A 44 72.182 79.826 27.120 1.00 70.28 C ATOM 167 OD1 ASP A 44 72.233 78.602 26.817 1.00 69.79 O ATOM 168 OD2 ASP A 44 71.303 80.584 26.688 1.00 81.63 O ATOM 0 H ASP A 44 75.729 81.043 28.811 1.00 61.03 H new ATOM 0 HA ASP A 44 74.333 78.753 28.464 1.00 59.94 H new ATOM 0 HB2 ASP A 44 72.857 80.555 28.929 1.00 65.82 H new ATOM 0 HB3 ASP A 44 73.436 81.352 27.719 1.00 65.82 H new ATOM 169 N PRO A 45 75.436 78.173 26.353 1.00 47.45 N ATOM 170 CA PRO A 45 76.024 77.867 25.036 1.00 48.18 C ATOM 171 C PRO A 45 75.190 78.338 23.853 1.00 50.82 C ATOM 172 O PRO A 45 75.735 78.917 22.899 1.00 46.28 O ATOM 173 CB PRO A 45 76.109 76.336 25.022 1.00 49.79 C ATOM 174 CG PRO A 45 76.049 75.922 26.431 1.00 48.89 C ATOM 175 CD PRO A 45 75.305 76.970 27.189 1.00 46.80 C ATOM 0 HA PRO A 45 76.873 78.325 24.934 1.00 48.18 H new ATOM 0 HB2 PRO A 45 75.378 75.951 24.514 1.00 49.79 H new ATOM 0 HB3 PRO A 45 76.932 76.036 24.605 1.00 49.79 H new ATOM 0 HG2 PRO A 45 75.604 75.064 26.514 1.00 48.89 H new ATOM 0 HG3 PRO A 45 76.943 75.814 26.791 1.00 48.89 H new ATOM 0 HD2 PRO A 45 74.375 76.725 27.315 1.00 46.80 H new ATOM 0 HD3 PRO A 45 75.684 77.107 28.071 1.00 46.80 H new ATOM 176 N PHE A 46 73.874 78.123 23.931 1.00 48.00 N ATOM 177 CA PHE A 46 73.006 78.379 22.785 1.00 49.41 C ATOM 178 C PHE A 46 72.863 79.865 22.531 1.00 49.35 C ATOM 179 O PHE A 46 72.922 80.322 21.372 1.00 47.54 O ATOM 180 CB PHE A 46 71.655 77.678 22.966 1.00 50.89 C ATOM 181 CG PHE A 46 71.766 76.172 22.977 1.00 49.90 C ATOM 182 CD1 PHE A 46 71.987 75.480 24.161 1.00 48.86 C ATOM 183 CD2 PHE A 46 71.659 75.442 21.790 1.00 52.77 C ATOM 184 CE1 PHE A 46 72.108 74.100 24.164 1.00 49.01 C ATOM 185 CE2 PHE A 46 71.773 74.052 21.791 1.00 51.27 C ATOM 186 CZ PHE A 46 71.996 73.381 22.976 1.00 48.97 C ATOM 0 H PHE A 46 73.470 77.832 24.632 1.00 48.00 H new ATOM 0 HA PHE A 46 73.418 78.003 21.991 1.00 49.41 H new ATOM 0 HB2 PHE A 46 71.252 77.973 23.798 1.00 50.89 H new ATOM 0 HB3 PHE A 46 71.058 77.948 22.250 1.00 50.89 H new ATOM 0 HD1 PHE A 46 72.055 75.949 24.961 1.00 48.86 H new ATOM 0 HD2 PHE A 46 71.510 75.889 20.988 1.00 52.77 H new ATOM 0 HE1 PHE A 46 72.265 73.651 24.963 1.00 49.01 H new ATOM 0 HE2 PHE A 46 71.699 73.578 20.994 1.00 51.27 H new ATOM 0 HZ PHE A 46 72.071 72.454 22.982 1.00 48.97 H new ATOM 187 N ALA A 47 72.728 80.632 23.613 1.00 49.06 N ATOM 188 CA ALA A 47 72.766 82.090 23.512 1.00 48.29 C ATOM 189 C ALA A 47 74.111 82.570 22.950 1.00 47.72 C ATOM 190 O ALA A 47 74.167 83.485 22.100 1.00 51.24 O ATOM 191 CB ALA A 47 72.504 82.732 24.872 1.00 50.03 C ATOM 0 H ALA A 47 72.614 80.330 24.410 1.00 49.06 H new ATOM 0 HA ALA A 47 72.065 82.362 22.899 1.00 48.29 H new ATOM 0 HB1 ALA A 47 72.533 83.698 24.785 1.00 50.03 H new ATOM 0 HB2 ALA A 47 71.629 82.463 25.194 1.00 50.03 H new ATOM 0 HB3 ALA A 47 73.183 82.444 25.502 1.00 50.03 H new ATOM 192 N PHE A 48 75.193 81.962 23.422 1.00 48.11 N ATOM 193 CA PHE A 48 76.530 82.313 22.914 1.00 49.00 C ATOM 194 C PHE A 48 76.694 81.951 21.430 1.00 47.84 C ATOM 195 O PHE A 48 77.134 82.773 20.606 1.00 48.13 O ATOM 196 CB PHE A 48 77.624 81.640 23.739 1.00 51.16 C ATOM 197 CG PHE A 48 79.002 82.012 23.286 1.00 56.98 C ATOM 198 CD1 PHE A 48 79.452 83.319 23.433 1.00 58.92 C ATOM 199 CD2 PHE A 48 79.823 81.086 22.660 1.00 60.68 C ATOM 200 CE1 PHE A 48 80.707 83.691 22.989 1.00 60.81 C ATOM 201 CE2 PHE A 48 81.082 81.452 22.218 1.00 60.38 C ATOM 202 CZ PHE A 48 81.519 82.756 22.387 1.00 58.56 C ATOM 0 H PHE A 48 75.184 81.351 24.028 1.00 48.11 H new ATOM 0 HA PHE A 48 76.619 83.275 22.999 1.00 49.00 H new ATOM 0 HB2 PHE A 48 77.517 81.885 24.672 1.00 51.16 H new ATOM 0 HB3 PHE A 48 77.519 80.677 23.685 1.00 51.16 H new ATOM 0 HD1 PHE A 48 78.901 83.951 23.835 1.00 58.92 H new ATOM 0 HD2 PHE A 48 79.525 80.214 22.537 1.00 60.68 H new ATOM 0 HE1 PHE A 48 81.001 84.567 23.096 1.00 60.81 H new ATOM 0 HE2 PHE A 48 81.633 80.825 21.809 1.00 60.38 H new ATOM 0 HZ PHE A 48 82.366 83.001 22.092 1.00 58.56 H new ATOM 203 N ILE A 49 76.310 80.730 21.092 1.00 48.78 N ATOM 204 CA ILE A 49 76.361 80.267 19.708 1.00 49.07 C ATOM 205 C ILE A 49 75.487 81.130 18.799 1.00 51.76 C ATOM 206 O ILE A 49 75.910 81.498 17.690 1.00 51.63 O ATOM 207 CB ILE A 49 75.990 78.777 19.617 1.00 53.26 C ATOM 208 CG1 ILE A 49 77.125 77.937 20.218 1.00 51.93 C ATOM 209 CG2 ILE A 49 75.753 78.369 18.170 1.00 56.93 C ATOM 210 CD1 ILE A 49 76.744 76.531 20.615 1.00 53.23 C ATOM 0 H ILE A 49 76.014 80.147 21.651 1.00 48.78 H new ATOM 0 HA ILE A 49 77.273 80.360 19.392 1.00 49.07 H new ATOM 0 HB ILE A 49 75.171 78.625 20.113 1.00 53.26 H new ATOM 0 HG12 ILE A 49 77.849 77.891 19.575 1.00 51.93 H new ATOM 0 HG13 ILE A 49 77.469 78.397 21.000 1.00 51.93 H new ATOM 0 HG21 ILE A 49 75.521 77.428 18.133 1.00 56.93 H new ATOM 0 HG22 ILE A 49 75.027 78.896 17.800 1.00 56.93 H new ATOM 0 HG23 ILE A 49 76.560 78.523 17.654 1.00 56.93 H new ATOM 0 HD11 ILE A 49 77.518 76.077 20.983 1.00 53.23 H new ATOM 0 HD12 ILE A 49 76.041 76.562 21.283 1.00 53.23 H new ATOM 0 HD13 ILE A 49 76.427 76.049 19.835 1.00 53.23 H new ATOM 211 N HIS A 50 74.282 81.474 19.262 1.00 53.53 N ATOM 212 CA HIS A 50 73.442 82.433 18.530 1.00 54.46 C ATOM 213 C HIS A 50 74.151 83.780 18.389 1.00 53.16 C ATOM 214 O HIS A 50 74.075 84.403 17.334 1.00 56.26 O ATOM 215 CB HIS A 50 72.054 82.634 19.197 1.00 59.13 C ATOM 216 CG HIS A 50 71.177 83.620 18.479 1.00 64.53 C ATOM 217 ND1 HIS A 50 70.574 83.342 17.268 1.00 69.09 N ATOM 218 CD2 HIS A 50 70.835 84.894 18.783 1.00 67.70 C ATOM 219 CE1 HIS A 50 69.889 84.398 16.865 1.00 70.00 C ATOM 220 NE2 HIS A 50 70.034 85.354 17.766 1.00 70.36 N ATOM 0 H HIS A 50 73.935 81.169 19.987 1.00 53.53 H new ATOM 0 HA HIS A 50 73.293 82.055 17.649 1.00 54.46 H new ATOM 0 HB2 HIS A 50 71.598 81.779 19.240 1.00 59.13 H new ATOM 0 HB3 HIS A 50 72.183 82.933 20.111 1.00 59.13 H new ATOM 0 HD2 HIS A 50 71.094 85.369 19.539 1.00 67.70 H new ATOM 0 HE1 HIS A 50 69.391 84.458 16.082 1.00 70.00 H new ATOM 0 HE2 HIS A 50 69.683 86.138 17.723 1.00 70.36 H new ATOM 221 N LYS A 51 74.823 84.232 19.448 1.00 53.87 N ATOM 222 CA LYS A 51 75.536 85.509 19.410 1.00 55.81 C ATOM 223 C LYS A 51 76.638 85.530 18.356 1.00 54.75 C ATOM 224 O LYS A 51 76.711 86.468 17.567 1.00 52.77 O ATOM 225 CB LYS A 51 76.133 85.874 20.774 1.00 61.76 C ATOM 226 CG LYS A 51 76.561 87.335 20.837 1.00 69.77 C ATOM 227 CD LYS A 51 77.406 87.678 22.057 1.00 78.04 C ATOM 228 CE LYS A 51 78.084 89.028 21.843 1.00 82.37 C ATOM 229 NZ LYS A 51 78.706 89.579 23.077 1.00 89.86 N ATOM 0 H LYS A 51 74.878 83.814 20.198 1.00 53.87 H new ATOM 0 HA LYS A 51 74.869 86.172 19.170 1.00 55.81 H new ATOM 0 HB2 LYS A 51 75.480 85.699 21.469 1.00 61.76 H new ATOM 0 HB3 LYS A 51 76.898 85.306 20.954 1.00 61.76 H new ATOM 0 HG2 LYS A 51 77.063 87.551 20.036 1.00 69.77 H new ATOM 0 HG3 LYS A 51 75.769 87.895 20.835 1.00 69.77 H new ATOM 0 HD2 LYS A 51 76.849 87.707 22.851 1.00 78.04 H new ATOM 0 HD3 LYS A 51 78.073 86.990 22.204 1.00 78.04 H new ATOM 0 HE2 LYS A 51 78.766 88.935 21.159 1.00 82.37 H new ATOM 0 HE3 LYS A 51 77.430 89.661 21.508 1.00 82.37 H new ATOM 0 HZ1 LYS A 51 79.262 90.239 22.860 1.00 89.86 H new ATOM 0 HZ2 LYS A 51 78.070 89.892 23.616 1.00 89.86 H new ATOM 0 HZ3 LYS A 51 79.158 88.936 23.494 1.00 89.86 H new ATOM 230 N ILE A 52 77.497 84.513 18.348 1.00 51.67 N ATOM 231 CA ILE A 52 78.633 84.494 17.396 1.00 52.83 C ATOM 232 C ILE A 52 78.258 84.183 15.943 1.00 53.09 C ATOM 233 O ILE A 52 79.026 84.477 15.029 1.00 52.09 O ATOM 234 CB ILE A 52 79.757 83.545 17.859 1.00 50.45 C ATOM 235 CG1 ILE A 52 79.321 82.077 17.759 1.00 53.07 C ATOM 236 CG2 ILE A 52 80.218 83.938 19.263 1.00 51.36 C ATOM 237 CD1 ILE A 52 80.158 81.103 18.560 1.00 55.72 C ATOM 0 H ILE A 52 77.451 83.832 18.871 1.00 51.67 H new ATOM 0 HA ILE A 52 78.954 85.409 17.402 1.00 52.83 H new ATOM 0 HB ILE A 52 80.520 83.635 17.266 1.00 50.45 H new ATOM 0 HG12 ILE A 52 78.399 82.007 18.052 1.00 53.07 H new ATOM 0 HG13 ILE A 52 79.343 81.810 16.827 1.00 53.07 H new ATOM 0 HG21 ILE A 52 80.925 83.339 19.551 1.00 51.36 H new ATOM 0 HG22 ILE A 52 80.551 84.849 19.251 1.00 51.36 H new ATOM 0 HG23 ILE A 52 79.471 83.875 19.878 1.00 51.36 H new ATOM 0 HD11 ILE A 52 79.813 80.204 18.439 1.00 55.72 H new ATOM 0 HD12 ILE A 52 81.078 81.140 18.255 1.00 55.72 H new ATOM 0 HD13 ILE A 52 80.120 81.340 19.500 1.00 55.72 H new ATOM 238 N ARG A 53 77.074 83.613 15.728 1.00 57.94 N ATOM 239 CA ARG A 53 76.700 83.058 14.427 1.00 57.98 C ATOM 240 C ARG A 53 76.948 83.985 13.224 1.00 57.90 C ATOM 241 O ARG A 53 77.489 83.546 12.212 1.00 57.25 O ATOM 242 CB ARG A 53 75.246 82.568 14.461 1.00 65.70 C ATOM 243 CG ARG A 53 74.754 81.952 13.159 1.00 72.94 C ATOM 244 CD ARG A 53 73.449 81.191 13.356 1.00 77.81 C ATOM 245 NE ARG A 53 72.358 82.093 13.725 1.00 80.95 N ATOM 246 CZ ARG A 53 71.731 82.931 12.896 1.00 81.90 C ATOM 247 NH1 ARG A 53 72.064 83.020 11.605 1.00 82.09 N ATOM 248 NH2 ARG A 53 70.751 83.698 13.369 1.00 83.02 N ATOM 0 H ARG A 53 76.465 83.537 16.331 1.00 57.94 H new ATOM 0 HA ARG A 53 77.299 82.310 14.281 1.00 57.98 H new ATOM 0 HB2 ARG A 53 75.155 81.912 15.170 1.00 65.70 H new ATOM 0 HB3 ARG A 53 74.671 83.315 14.689 1.00 65.70 H new ATOM 0 HG2 ARG A 53 74.625 82.650 12.498 1.00 72.94 H new ATOM 0 HG3 ARG A 53 75.430 81.351 12.809 1.00 72.94 H new ATOM 0 HD2 ARG A 53 73.220 80.720 12.539 1.00 77.81 H new ATOM 0 HD3 ARG A 53 73.565 80.520 14.047 1.00 77.81 H new ATOM 0 HE ARG A 53 72.099 82.083 14.545 1.00 80.95 H new ATOM 0 HH11 ARG A 53 72.696 82.530 11.289 1.00 82.09 H new ATOM 0 HH12 ARG A 53 71.646 83.567 11.090 1.00 82.09 H new ATOM 0 HH21 ARG A 53 70.529 83.650 14.199 1.00 83.02 H new ATOM 0 HH22 ARG A 53 70.340 84.242 12.845 1.00 83.02 H new ATOM 249 N PRO A 54 76.583 85.270 13.328 1.00 53.74 N ATOM 250 CA PRO A 54 76.848 86.140 12.193 1.00 54.57 C ATOM 251 C PRO A 54 78.315 86.172 11.744 1.00 52.23 C ATOM 252 O PRO A 54 78.570 86.294 10.554 1.00 50.70 O ATOM 253 CB PRO A 54 76.408 87.513 12.706 1.00 54.71 C ATOM 254 CG PRO A 54 75.360 87.200 13.711 1.00 53.42 C ATOM 255 CD PRO A 54 75.885 85.990 14.406 1.00 54.24 C ATOM 0 HA PRO A 54 76.380 85.832 11.401 1.00 54.57 H new ATOM 0 HB2 PRO A 54 77.148 87.998 13.103 1.00 54.71 H new ATOM 0 HB3 PRO A 54 76.059 88.065 11.989 1.00 54.71 H new ATOM 0 HG2 PRO A 54 75.228 87.936 14.329 1.00 53.42 H new ATOM 0 HG3 PRO A 54 74.504 87.026 13.290 1.00 53.42 H new ATOM 0 HD2 PRO A 54 76.486 86.224 15.130 1.00 54.24 H new ATOM 0 HD3 PRO A 54 75.171 85.458 14.790 1.00 54.24 H new ATOM 256 N ILE A 55 79.251 86.059 12.686 1.00 54.17 N ATOM 257 CA ILE A 55 80.692 86.003 12.370 1.00 55.10 C ATOM 258 C ILE A 55 81.052 84.612 11.875 1.00 49.67 C ATOM 259 O ILE A 55 81.538 84.440 10.758 1.00 54.40 O ATOM 260 CB ILE A 55 81.583 86.321 13.606 1.00 57.90 C ATOM 261 CG1 ILE A 55 81.251 87.708 14.196 1.00 61.13 C ATOM 262 CG2 ILE A 55 83.074 86.215 13.261 1.00 55.37 C ATOM 263 CD1 ILE A 55 81.473 88.881 13.261 1.00 60.55 C ATOM 0 H ILE A 55 79.075 86.012 13.527 1.00 54.17 H new ATOM 0 HA ILE A 55 80.858 86.674 11.690 1.00 55.10 H new ATOM 0 HB ILE A 55 81.387 85.655 14.284 1.00 57.90 H new ATOM 0 HG12 ILE A 55 80.323 87.709 14.478 1.00 61.13 H new ATOM 0 HG13 ILE A 55 81.789 87.842 14.992 1.00 61.13 H new ATOM 0 HG21 ILE A 55 83.604 86.418 14.048 1.00 55.37 H new ATOM 0 HG22 ILE A 55 83.274 85.315 12.961 1.00 55.37 H new ATOM 0 HG23 ILE A 55 83.289 86.846 12.556 1.00 55.37 H new ATOM 0 HD11 ILE A 55 81.239 89.706 13.715 1.00 60.55 H new ATOM 0 HD12 ILE A 55 82.405 88.911 12.996 1.00 60.55 H new ATOM 0 HD13 ILE A 55 80.916 88.777 12.473 1.00 60.55 H new ATOM 264 N ALA A 56 80.783 83.629 12.721 1.00 50.60 N ATOM 265 CA ALA A 56 81.264 82.263 12.537 1.00 53.79 C ATOM 266 C ALA A 56 80.654 81.541 11.344 1.00 54.99 C ATOM 267 O ALA A 56 81.285 80.652 10.777 1.00 53.04 O ATOM 268 CB ALA A 56 81.043 81.456 13.808 1.00 52.53 C ATOM 0 H ALA A 56 80.309 83.736 13.430 1.00 50.60 H new ATOM 0 HA ALA A 56 82.212 82.338 12.345 1.00 53.79 H new ATOM 0 HB1 ALA A 56 81.365 80.551 13.677 1.00 52.53 H new ATOM 0 HB2 ALA A 56 81.527 81.868 14.541 1.00 52.53 H new ATOM 0 HB3 ALA A 56 80.096 81.435 14.017 1.00 52.53 H new ATOM 269 N GLU A 57 79.444 81.917 10.948 1.00 55.61 N ATOM 270 CA GLU A 57 78.845 81.324 9.758 1.00 54.04 C ATOM 271 C GLU A 57 79.519 81.783 8.456 1.00 50.35 C ATOM 272 O GLU A 57 79.382 81.117 7.435 1.00 50.00 O ATOM 273 CB GLU A 57 77.320 81.538 9.732 1.00 56.53 C ATOM 274 CG GLU A 57 76.819 82.855 9.149 1.00 59.48 C ATOM 275 CD GLU A 57 75.312 83.043 9.329 1.00 64.63 C ATOM 276 OE1 GLU A 57 74.611 82.066 9.691 1.00 63.79 O ATOM 277 OE2 GLU A 57 74.831 84.178 9.101 1.00 68.20 O ATOM 0 H GLU A 57 78.959 82.505 11.347 1.00 55.61 H new ATOM 0 HA GLU A 57 79.004 80.369 9.813 1.00 54.04 H new ATOM 0 HB2 GLU A 57 76.922 80.813 9.226 1.00 56.53 H new ATOM 0 HB3 GLU A 57 76.989 81.465 10.641 1.00 56.53 H new ATOM 0 HG2 GLU A 57 77.286 83.591 9.574 1.00 59.48 H new ATOM 0 HG3 GLU A 57 77.035 82.889 8.204 1.00 59.48 H new ATOM 278 N GLN A 58 80.235 82.909 8.499 1.00 48.86 N ATOM 279 CA GLN A 58 81.051 83.364 7.374 1.00 49.94 C ATOM 280 C GLN A 58 82.340 82.567 7.205 1.00 42.99 C ATOM 281 O GLN A 58 82.960 82.653 6.152 1.00 42.47 O ATOM 282 CB GLN A 58 81.416 84.851 7.496 1.00 55.18 C ATOM 283 CG GLN A 58 80.233 85.802 7.568 1.00 62.47 C ATOM 284 CD GLN A 58 79.278 85.652 6.388 1.00 71.59 C ATOM 285 OE1 GLN A 58 79.599 86.026 5.256 1.00 76.43 O ATOM 286 NE2 GLN A 58 78.101 85.091 6.649 1.00 74.66 N ATOM 0 H GLN A 58 80.260 83.430 9.183 1.00 48.86 H new ATOM 0 HA GLN A 58 80.495 83.222 6.592 1.00 49.94 H new ATOM 0 HB2 GLN A 58 81.959 84.972 8.290 1.00 55.18 H new ATOM 0 HB3 GLN A 58 81.966 85.098 6.736 1.00 55.18 H new ATOM 0 HG2 GLN A 58 79.748 85.645 8.393 1.00 62.47 H new ATOM 0 HG3 GLN A 58 80.559 86.715 7.600 1.00 62.47 H new ATOM 0 HE21 GLN A 58 77.911 84.842 7.450 1.00 74.66 H new ATOM 0 HE22 GLN A 58 77.529 84.977 6.017 1.00 74.66 H new ATOM 287 N THR A 59 82.740 81.810 8.224 1.00 39.49 N ATOM 288 CA THR A 59 83.962 81.008 8.187 1.00 39.99 C ATOM 289 C THR A 59 83.775 79.512 8.349 1.00 40.26 C ATOM 290 O THR A 59 84.737 78.745 8.155 1.00 40.94 O ATOM 291 CB THR A 59 84.938 81.475 9.286 1.00 39.72 C ATOM 292 OG1 THR A 59 84.337 81.281 10.576 1.00 39.19 O ATOM 293 CG2 THR A 59 85.280 82.946 9.083 1.00 40.31 C ATOM 0 H THR A 59 82.306 81.747 8.964 1.00 39.49 H new ATOM 0 HA THR A 59 84.308 81.151 7.292 1.00 39.99 H new ATOM 0 HB THR A 59 85.755 80.954 9.234 1.00 39.72 H new ATOM 0 HG1 THR A 59 84.662 80.595 10.936 1.00 39.19 H new ATOM 0 HG21 THR A 59 85.894 83.234 9.777 1.00 40.31 H new ATOM 0 HG22 THR A 59 85.695 83.065 8.214 1.00 40.31 H new ATOM 0 HG23 THR A 59 84.469 83.476 9.129 1.00 40.31 H new ATOM 294 N GLY A 60 82.569 79.077 8.715 1.00 40.15 N ATOM 295 CA GLY A 60 82.247 77.647 8.808 1.00 37.42 C ATOM 296 C GLY A 60 82.567 77.071 10.158 1.00 38.77 C ATOM 297 O GLY A 60 81.720 76.445 10.788 1.00 37.20 O ATOM 0 H GLY A 60 81.915 79.598 8.916 1.00 40.15 H new ATOM 0 HA2 GLY A 60 81.304 77.518 8.620 1.00 37.42 H new ATOM 0 HA3 GLY A 60 82.741 77.163 8.128 1.00 37.42 H new ATOM 298 N ILE A 61 83.812 77.276 10.593 1.00 38.15 N ATOM 299 CA ILE A 61 84.284 76.840 11.897 1.00 34.37 C ATOM 300 C ILE A 61 84.746 78.045 12.724 1.00 34.63 C ATOM 301 O ILE A 61 85.091 79.121 12.184 1.00 37.28 O ATOM 302 CB ILE A 61 85.437 75.802 11.818 1.00 35.54 C ATOM 303 CG1 ILE A 61 86.733 76.414 11.243 1.00 37.05 C ATOM 304 CG2 ILE A 61 85.021 74.555 11.043 1.00 34.54 C ATOM 305 CD1 ILE A 61 87.854 75.407 11.107 1.00 39.77 C ATOM 0 H ILE A 61 84.412 77.679 10.127 1.00 38.15 H new ATOM 0 HA ILE A 61 83.531 76.402 12.325 1.00 34.37 H new ATOM 0 HB ILE A 61 85.630 75.530 12.729 1.00 35.54 H new ATOM 0 HG12 ILE A 61 86.544 76.799 10.373 1.00 37.05 H new ATOM 0 HG13 ILE A 61 87.025 77.139 11.817 1.00 37.05 H new ATOM 0 HG21 ILE A 61 85.762 73.930 11.013 1.00 34.54 H new ATOM 0 HG22 ILE A 61 84.264 74.138 11.483 1.00 34.54 H new ATOM 0 HG23 ILE A 61 84.772 74.804 10.139 1.00 34.54 H new ATOM 0 HD11 ILE A 61 88.640 75.844 10.743 1.00 39.77 H new ATOM 0 HD12 ILE A 61 88.065 75.038 11.979 1.00 39.77 H new ATOM 0 HD13 ILE A 61 87.577 74.693 10.512 1.00 39.77 H new ATOM 306 N CYS A 62 84.749 77.848 14.029 1.00 34.44 N ATOM 307 CA CYS A 62 85.340 78.815 14.953 1.00 36.76 C ATOM 308 C CYS A 62 85.843 78.064 16.154 1.00 35.62 C ATOM 309 O CYS A 62 85.503 76.896 16.374 1.00 37.85 O ATOM 310 CB CYS A 62 84.324 79.870 15.362 1.00 39.90 C ATOM 311 SG CYS A 62 83.020 79.189 16.401 1.00 43.61 S ATOM 0 H CYS A 62 84.411 77.155 14.410 1.00 34.44 H new ATOM 0 HA CYS A 62 86.073 79.279 14.520 1.00 36.76 H new ATOM 0 HB2 CYS A 62 84.775 80.584 15.838 1.00 39.90 H new ATOM 0 HB3 CYS A 62 83.930 80.263 14.567 1.00 39.90 H new ATOM 0 HG CYS A 62 82.149 80.003 16.536 1.00 43.61 H new ATOM 312 N LYS A 63 86.677 78.738 16.921 1.00 36.95 N ATOM 313 CA LYS A 63 87.257 78.174 18.113 1.00 37.47 C ATOM 314 C LYS A 63 86.755 78.961 19.330 1.00 38.21 C ATOM 315 O LYS A 63 86.654 80.201 19.289 1.00 36.99 O ATOM 316 CB LYS A 63 88.782 78.238 17.994 1.00 38.97 C ATOM 317 CG LYS A 63 89.511 77.400 19.026 1.00 42.66 C ATOM 318 CD LYS A 63 90.917 77.072 18.580 1.00 43.60 C ATOM 319 CE LYS A 63 91.779 78.325 18.575 1.00 45.82 C ATOM 320 NZ LYS A 63 93.167 77.964 18.233 1.00 49.83 N ATOM 0 H LYS A 63 86.924 79.546 16.760 1.00 36.95 H new ATOM 0 HA LYS A 63 86.996 77.246 18.222 1.00 37.47 H new ATOM 0 HB2 LYS A 63 89.042 77.942 17.107 1.00 38.97 H new ATOM 0 HB3 LYS A 63 89.066 79.161 18.080 1.00 38.97 H new ATOM 0 HG2 LYS A 63 89.541 77.878 19.870 1.00 42.66 H new ATOM 0 HG3 LYS A 63 89.020 76.578 19.183 1.00 42.66 H new ATOM 0 HD2 LYS A 63 91.304 76.409 19.173 1.00 43.60 H new ATOM 0 HD3 LYS A 63 90.898 76.682 17.692 1.00 43.60 H new ATOM 0 HE2 LYS A 63 91.433 78.965 17.933 1.00 45.82 H new ATOM 0 HE3 LYS A 63 91.751 78.753 19.445 1.00 45.82 H new ATOM 0 HZ1 LYS A 63 93.705 78.182 18.907 1.00 49.83 H new ATOM 0 HZ2 LYS A 63 93.218 77.088 18.084 1.00 49.83 H new ATOM 0 HZ3 LYS A 63 93.417 78.404 17.501 1.00 49.83 H new ATOM 321 N VAL A 64 86.424 78.235 20.394 1.00 36.18 N ATOM 322 CA VAL A 64 85.977 78.832 21.635 1.00 38.23 C ATOM 323 C VAL A 64 86.892 78.367 22.764 1.00 38.40 C ATOM 324 O VAL A 64 86.968 77.179 23.072 1.00 37.43 O ATOM 325 CB VAL A 64 84.505 78.472 22.000 1.00 40.56 C ATOM 326 CG1 VAL A 64 84.064 79.266 23.224 1.00 39.61 C ATOM 327 CG2 VAL A 64 83.561 78.772 20.842 1.00 40.95 C ATOM 0 H VAL A 64 86.455 77.376 20.410 1.00 36.18 H new ATOM 0 HA VAL A 64 86.013 79.794 21.516 1.00 38.23 H new ATOM 0 HB VAL A 64 84.469 77.522 22.191 1.00 40.56 H new ATOM 0 HG11 VAL A 64 83.148 79.037 23.445 1.00 39.61 H new ATOM 0 HG12 VAL A 64 84.641 79.052 23.974 1.00 39.61 H new ATOM 0 HG13 VAL A 64 84.123 80.215 23.033 1.00 39.61 H new ATOM 0 HG21 VAL A 64 82.654 78.539 21.095 1.00 40.95 H new ATOM 0 HG22 VAL A 64 83.604 79.717 20.626 1.00 40.95 H new ATOM 0 HG23 VAL A 64 83.824 78.251 20.067 1.00 40.95 H new ATOM 328 N ARG A 65 87.556 79.334 23.395 1.00 41.50 N ATOM 329 CA ARG A 65 88.346 79.077 24.602 1.00 45.12 C ATOM 330 C ARG A 65 87.467 79.333 25.801 1.00 41.05 C ATOM 331 O ARG A 65 87.003 80.448 25.991 1.00 40.06 O ATOM 332 CB ARG A 65 89.545 80.016 24.682 1.00 45.27 C ATOM 333 CG ARG A 65 90.666 79.686 23.708 1.00 49.01 C ATOM 334 CD ARG A 65 91.979 80.325 24.152 1.00 55.24 C ATOM 335 NE ARG A 65 92.400 81.374 23.237 1.00 59.64 N ATOM 336 CZ ARG A 65 93.162 81.195 22.157 1.00 62.69 C ATOM 337 NH1 ARG A 65 93.618 79.992 21.814 1.00 64.72 N ATOM 338 NH2 ARG A 65 93.481 82.246 21.402 1.00 70.32 N ATOM 0 H ARG A 65 87.562 80.155 23.138 1.00 41.50 H new ATOM 0 HA ARG A 65 88.666 78.162 24.580 1.00 45.12 H new ATOM 0 HB2 ARG A 65 89.244 80.923 24.516 1.00 45.27 H new ATOM 0 HB3 ARG A 65 89.899 79.995 25.585 1.00 45.27 H new ATOM 0 HG2 ARG A 65 90.774 78.724 23.648 1.00 49.01 H new ATOM 0 HG3 ARG A 65 90.432 80.001 22.821 1.00 49.01 H new ATOM 0 HD2 ARG A 65 91.875 80.694 25.043 1.00 55.24 H new ATOM 0 HD3 ARG A 65 92.669 79.645 24.205 1.00 55.24 H new ATOM 0 HE ARG A 65 92.136 82.175 23.406 1.00 59.64 H new ATOM 0 HH11 ARG A 65 93.423 79.305 22.294 1.00 64.72 H new ATOM 0 HH12 ARG A 65 94.108 79.902 21.113 1.00 64.72 H new ATOM 0 HH21 ARG A 65 93.196 83.029 21.613 1.00 70.32 H new ATOM 0 HH22 ARG A 65 93.972 82.141 20.704 1.00 70.32 H new ATOM 339 N PRO A 66 87.245 78.334 26.627 1.00 38.08 N ATOM 340 CA PRO A 66 86.418 78.648 27.782 1.00 43.21 C ATOM 341 C PRO A 66 87.096 79.651 28.730 1.00 49.70 C ATOM 342 O PRO A 66 88.275 79.920 28.582 1.00 44.07 O ATOM 343 CB PRO A 66 86.261 77.296 28.480 1.00 43.02 C ATOM 344 CG PRO A 66 86.561 76.285 27.428 1.00 44.24 C ATOM 345 CD PRO A 66 87.635 76.925 26.602 1.00 40.56 C ATOM 0 HA PRO A 66 85.579 79.062 27.524 1.00 43.21 H new ATOM 0 HB2 PRO A 66 86.871 77.215 29.230 1.00 43.02 H new ATOM 0 HB3 PRO A 66 85.364 77.183 28.830 1.00 43.02 H new ATOM 0 HG2 PRO A 66 86.863 75.449 27.816 1.00 44.24 H new ATOM 0 HG3 PRO A 66 85.776 76.084 26.895 1.00 44.24 H new ATOM 0 HD2 PRO A 66 88.516 76.786 26.983 1.00 40.56 H new ATOM 0 HD3 PRO A 66 87.657 76.571 25.699 1.00 40.56 H new ATOM 346 N PRO A 67 86.345 80.209 29.695 1.00 58.26 N ATOM 347 CA PRO A 67 87.020 80.991 30.736 1.00 57.77 C ATOM 348 C PRO A 67 88.071 80.148 31.468 1.00 51.90 C ATOM 349 O PRO A 67 87.872 78.941 31.651 1.00 47.23 O ATOM 350 CB PRO A 67 85.883 81.400 31.673 1.00 61.61 C ATOM 351 CG PRO A 67 84.649 81.366 30.824 1.00 61.91 C ATOM 352 CD PRO A 67 84.875 80.248 29.839 1.00 57.83 C ATOM 0 HA PRO A 67 87.504 81.753 30.381 1.00 57.77 H new ATOM 0 HB2 PRO A 67 85.810 80.790 32.424 1.00 61.61 H new ATOM 0 HB3 PRO A 67 86.032 82.285 32.041 1.00 61.61 H new ATOM 0 HG2 PRO A 67 83.858 81.204 31.362 1.00 61.91 H new ATOM 0 HG3 PRO A 67 84.514 82.212 30.369 1.00 61.91 H new ATOM 0 HD2 PRO A 67 84.526 79.405 30.169 1.00 57.83 H new ATOM 0 HD3 PRO A 67 84.437 80.424 28.991 1.00 57.83 H new ATOM 353 N PRO A 68 89.193 80.775 31.868 1.00 55.37 N ATOM 354 CA PRO A 68 90.395 79.997 32.231 1.00 57.59 C ATOM 355 C PRO A 68 90.217 79.008 33.382 1.00 55.59 C ATOM 356 O PRO A 68 90.947 78.021 33.446 1.00 57.18 O ATOM 357 CB PRO A 68 91.432 81.081 32.603 1.00 60.34 C ATOM 358 CG PRO A 68 90.874 82.376 32.092 1.00 59.51 C ATOM 359 CD PRO A 68 89.388 82.225 32.096 1.00 57.83 C ATOM 0 HA PRO A 68 90.651 79.423 31.492 1.00 57.59 H new ATOM 0 HB2 PRO A 68 91.569 81.116 33.563 1.00 60.34 H new ATOM 0 HB3 PRO A 68 92.294 80.891 32.200 1.00 60.34 H new ATOM 0 HG2 PRO A 68 91.148 83.117 32.655 1.00 59.51 H new ATOM 0 HG3 PRO A 68 91.200 82.564 31.198 1.00 59.51 H new ATOM 0 HD2 PRO A 68 89.001 82.510 32.939 1.00 57.83 H new ATOM 0 HD3 PRO A 68 88.972 82.756 31.399 1.00 57.83 H new ATOM 360 N ASP A 69 89.275 79.284 34.282 1.00 56.49 N ATOM 361 CA ASP A 69 88.954 78.361 35.390 1.00 64.22 C ATOM 362 C ASP A 69 87.917 77.280 35.048 1.00 61.07 C ATOM 363 O ASP A 69 87.758 76.348 35.836 1.00 59.88 O ATOM 364 CB ASP A 69 88.522 79.118 36.661 1.00 67.70 C ATOM 365 CG ASP A 69 87.339 80.047 36.429 1.00 76.70 C ATOM 366 OD1 ASP A 69 87.345 80.812 35.427 1.00 79.38 O ATOM 367 OD2 ASP A 69 86.407 80.022 37.261 1.00 84.63 O ATOM 0 H ASP A 69 88.804 80.003 34.275 1.00 56.49 H new ATOM 0 HA ASP A 69 89.788 77.895 35.557 1.00 64.22 H new ATOM 0 HB2 ASP A 69 88.292 78.476 37.351 1.00 67.70 H new ATOM 0 HB3 ASP A 69 89.272 79.635 36.994 1.00 67.70 H new ATOM 368 N TRP A 70 87.231 77.377 33.899 1.00 57.46 N ATOM 369 CA TRP A 70 86.391 76.249 33.422 1.00 59.24 C ATOM 370 C TRP A 70 87.309 75.079 33.028 1.00 53.46 C ATOM 371 O TRP A 70 87.875 75.050 31.935 1.00 54.82 O ATOM 372 CB TRP A 70 85.439 76.656 32.269 1.00 59.15 C ATOM 373 CG TRP A 70 84.308 75.636 32.031 1.00 65.16 C ATOM 374 CD1 TRP A 70 83.093 75.578 32.682 1.00 69.20 C ATOM 375 CD2 TRP A 70 84.304 74.541 31.097 1.00 62.19 C ATOM 376 NE1 TRP A 70 82.343 74.520 32.206 1.00 65.36 N ATOM 377 CE2 TRP A 70 83.060 73.866 31.240 1.00 64.80 C ATOM 378 CE3 TRP A 70 85.226 74.061 30.156 1.00 57.00 C ATOM 379 CZ2 TRP A 70 82.727 72.735 30.482 1.00 61.03 C ATOM 380 CZ3 TRP A 70 84.888 72.936 29.401 1.00 57.55 C ATOM 381 CH2 TRP A 70 83.649 72.288 29.570 1.00 57.88 C ATOM 0 H TRP A 70 87.233 78.068 33.387 1.00 57.46 H new ATOM 0 HA TRP A 70 85.807 75.970 34.145 1.00 59.24 H new ATOM 0 HB2 TRP A 70 85.050 77.522 32.468 1.00 59.15 H new ATOM 0 HB3 TRP A 70 85.953 76.757 31.453 1.00 59.15 H new ATOM 0 HD1 TRP A 70 82.818 76.167 33.347 1.00 69.20 H new ATOM 0 HE1 TRP A 70 81.554 74.307 32.473 1.00 65.36 H new ATOM 0 HE3 TRP A 70 86.046 74.483 30.037 1.00 57.00 H new ATOM 0 HZ2 TRP A 70 81.911 72.303 30.593 1.00 61.03 H new ATOM 0 HZ3 TRP A 70 85.492 72.608 28.775 1.00 57.55 H new ATOM 0 HH2 TRP A 70 83.452 71.541 29.052 1.00 57.88 H new ATOM 382 N GLN A 71 87.480 74.132 33.943 1.00 51.77 N ATOM 383 CA GLN A 71 88.428 73.044 33.755 1.00 53.84 C ATOM 384 C GLN A 71 87.828 71.737 34.181 1.00 53.59 C ATOM 385 O GLN A 71 88.107 71.267 35.269 1.00 53.37 O ATOM 386 CB GLN A 71 89.695 73.333 34.555 1.00 64.64 C ATOM 387 CG GLN A 71 90.400 74.589 34.071 1.00 72.02 C ATOM 388 CD GLN A 71 91.833 74.685 34.532 1.00 82.27 C ATOM 389 OE1 GLN A 71 92.650 73.791 34.270 1.00 84.64 O ATOM 390 NE2 GLN A 71 92.161 75.788 35.202 1.00 83.52 N ATOM 0 H GLN A 71 87.051 74.103 34.688 1.00 51.77 H new ATOM 0 HA GLN A 71 88.650 72.978 32.813 1.00 53.84 H new ATOM 0 HB2 GLN A 71 89.469 73.431 35.493 1.00 64.64 H new ATOM 0 HB3 GLN A 71 90.299 72.577 34.487 1.00 64.64 H new ATOM 0 HG2 GLN A 71 90.377 74.612 33.102 1.00 72.02 H new ATOM 0 HG3 GLN A 71 89.913 75.367 34.385 1.00 72.02 H new ATOM 0 HE21 GLN A 71 91.565 76.386 35.364 1.00 83.52 H new ATOM 0 HE22 GLN A 71 92.969 75.902 35.472 1.00 83.52 H new ATOM 391 N PRO A 72 86.980 71.135 33.319 1.00 56.20 N ATOM 392 CA PRO A 72 86.373 69.851 33.680 1.00 54.09 C ATOM 393 C PRO A 72 87.433 68.824 33.926 1.00 50.16 C ATOM 394 O PRO A 72 88.384 68.781 33.179 1.00 60.43 O ATOM 395 CB PRO A 72 85.572 69.463 32.430 1.00 50.82 C ATOM 396 CG PRO A 72 86.126 70.290 31.340 1.00 52.96 C ATOM 397 CD PRO A 72 86.538 71.573 31.984 1.00 53.77 C ATOM 0 HA PRO A 72 85.834 69.908 34.484 1.00 54.09 H new ATOM 0 HB2 PRO A 72 85.665 68.518 32.234 1.00 50.82 H new ATOM 0 HB3 PRO A 72 84.625 69.635 32.553 1.00 50.82 H new ATOM 0 HG2 PRO A 72 86.882 69.852 30.919 1.00 52.96 H new ATOM 0 HG3 PRO A 72 85.465 70.443 30.647 1.00 52.96 H new ATOM 0 HD2 PRO A 72 87.251 72.010 31.493 1.00 53.77 H new ATOM 0 HD3 PRO A 72 85.802 72.203 32.036 1.00 53.77 H new ATOM 398 N PRO A 73 87.277 67.992 34.954 1.00 59.04 N ATOM 399 CA PRO A 73 88.321 67.013 35.225 1.00 59.14 C ATOM 400 C PRO A 73 88.194 65.833 34.304 1.00 56.94 C ATOM 401 O PRO A 73 87.133 65.251 34.208 1.00 65.30 O ATOM 402 CB PRO A 73 88.032 66.590 36.661 1.00 61.32 C ATOM 403 CG PRO A 73 86.547 66.723 36.793 1.00 63.59 C ATOM 404 CD PRO A 73 86.119 67.822 35.851 1.00 63.42 C ATOM 0 HA PRO A 73 89.215 67.366 35.096 1.00 59.14 H new ATOM 0 HB2 PRO A 73 88.322 65.679 36.827 1.00 61.32 H new ATOM 0 HB3 PRO A 73 88.496 67.156 37.297 1.00 61.32 H new ATOM 0 HG2 PRO A 73 86.106 65.888 36.570 1.00 63.59 H new ATOM 0 HG3 PRO A 73 86.301 66.938 37.706 1.00 63.59 H new ATOM 0 HD2 PRO A 73 85.321 67.577 35.358 1.00 63.42 H new ATOM 0 HD3 PRO A 73 85.917 68.641 36.329 1.00 63.42 H new ATOM 405 N PHE A 74 89.260 65.512 33.594 1.00 61.87 N ATOM 406 CA PHE A 74 89.349 64.234 32.910 1.00 65.78 C ATOM 407 C PHE A 74 89.968 63.239 33.882 1.00 66.72 C ATOM 408 O PHE A 74 91.007 63.522 34.480 1.00 66.73 O ATOM 409 CB PHE A 74 90.220 64.309 31.644 1.00 66.40 C ATOM 410 CG PHE A 74 90.216 63.031 30.850 1.00 66.53 C ATOM 411 CD1 PHE A 74 91.034 61.965 31.219 1.00 64.58 C ATOM 412 CD2 PHE A 74 89.358 62.867 29.767 1.00 65.56 C ATOM 413 CE1 PHE A 74 91.016 60.773 30.508 1.00 67.27 C ATOM 414 CE2 PHE A 74 89.340 61.675 29.046 1.00 65.27 C ATOM 415 CZ PHE A 74 90.167 60.624 29.417 1.00 64.92 C ATOM 0 H PHE A 74 89.946 66.021 33.494 1.00 61.87 H new ATOM 0 HA PHE A 74 88.460 63.965 32.630 1.00 65.78 H new ATOM 0 HB2 PHE A 74 89.903 65.034 31.082 1.00 66.40 H new ATOM 0 HB3 PHE A 74 91.131 64.524 31.897 1.00 66.40 H new ATOM 0 HD1 PHE A 74 91.600 62.053 31.952 1.00 64.58 H new ATOM 0 HD2 PHE A 74 88.790 63.561 29.522 1.00 65.56 H new ATOM 0 HE1 PHE A 74 91.573 60.073 30.762 1.00 67.27 H new ATOM 0 HE2 PHE A 74 88.773 61.583 28.315 1.00 65.27 H new ATOM 0 HZ PHE A 74 90.153 59.826 28.939 1.00 64.92 H new ATOM 416 N ALA A 75 89.344 62.077 34.026 1.00 62.78 N ATOM 417 CA ALA A 75 89.966 60.967 34.742 1.00 63.64 C ATOM 418 C ALA A 75 89.529 59.680 34.090 1.00 62.96 C ATOM 419 O ALA A 75 88.353 59.525 33.734 1.00 60.37 O ATOM 420 CB ALA A 75 89.593 60.980 36.222 1.00 62.63 C ATOM 0 H ALA A 75 88.559 61.909 33.717 1.00 62.78 H new ATOM 0 HA ALA A 75 90.931 61.052 34.695 1.00 63.64 H new ATOM 0 HB1 ALA A 75 90.020 60.233 36.670 1.00 62.63 H new ATOM 0 HB2 ALA A 75 89.891 61.811 36.624 1.00 62.63 H new ATOM 0 HB3 ALA A 75 88.630 60.904 36.314 1.00 62.63 H new ATOM 421 N CYS A 76 90.502 58.794 33.885 1.00 67.27 N ATOM 422 CA CYS A 76 90.264 57.453 33.349 1.00 73.41 C ATOM 423 C CYS A 76 91.510 56.592 33.523 1.00 67.80 C ATOM 424 O CYS A 76 92.632 57.111 33.675 1.00 65.14 O ATOM 425 CB CYS A 76 89.921 57.489 31.856 1.00 82.22 C ATOM 426 SG CYS A 76 91.368 57.403 30.773 1.00 95.36 S ATOM 0 H CYS A 76 91.329 58.956 34.055 1.00 67.27 H new ATOM 0 HA CYS A 76 89.514 57.081 33.839 1.00 73.41 H new ATOM 0 HB2 CYS A 76 89.329 56.748 31.651 1.00 82.22 H new ATOM 0 HB3 CYS A 76 89.432 58.305 31.664 1.00 82.22 H new ATOM 0 HG CYS A 76 91.382 58.358 30.047 1.00 95.36 H new ATOM 427 N ASP A 77 91.301 55.278 33.462 1.00 59.20 N ATOM 428 CA ASP A 77 92.381 54.317 33.547 1.00 54.91 C ATOM 429 C ASP A 77 92.818 53.957 32.123 1.00 49.64 C ATOM 430 O ASP A 77 92.061 53.408 31.351 1.00 48.72 O ATOM 431 CB ASP A 77 91.959 53.071 34.332 1.00 56.92 C ATOM 432 CG ASP A 77 93.132 52.145 34.622 1.00 57.40 C ATOM 433 OD1 ASP A 77 93.751 51.641 33.675 1.00 57.15 O ATOM 434 OD2 ASP A 77 93.452 51.916 35.798 1.00 60.33 O ATOM 0 H ASP A 77 90.523 54.924 33.370 1.00 59.20 H new ATOM 0 HA ASP A 77 93.127 54.707 34.029 1.00 54.91 H new ATOM 0 HB2 ASP A 77 91.549 53.342 35.168 1.00 56.92 H new ATOM 0 HB3 ASP A 77 91.285 52.588 33.829 1.00 56.92 H new ATOM 435 N VAL A 78 94.067 54.257 31.812 1.00 44.53 N ATOM 436 CA VAL A 78 94.638 53.997 30.489 1.00 46.16 C ATOM 437 C VAL A 78 94.787 52.514 30.124 1.00 45.69 C ATOM 438 O VAL A 78 94.937 52.177 28.945 1.00 41.47 O ATOM 439 CB VAL A 78 96.016 54.698 30.327 1.00 47.33 C ATOM 440 CG1 VAL A 78 95.857 56.202 30.482 1.00 50.25 C ATOM 441 CG2 VAL A 78 97.065 54.173 31.311 1.00 46.75 C ATOM 0 H VAL A 78 94.618 54.621 32.363 1.00 44.53 H new ATOM 0 HA VAL A 78 93.987 54.368 29.873 1.00 46.16 H new ATOM 0 HB VAL A 78 96.337 54.493 29.435 1.00 47.33 H new ATOM 0 HG11 VAL A 78 96.721 56.631 30.380 1.00 50.25 H new ATOM 0 HG12 VAL A 78 95.249 56.535 29.804 1.00 50.25 H new ATOM 0 HG13 VAL A 78 95.500 56.401 31.362 1.00 50.25 H new ATOM 0 HG21 VAL A 78 97.903 54.640 31.170 1.00 46.75 H new ATOM 0 HG22 VAL A 78 96.760 54.323 32.220 1.00 46.75 H new ATOM 0 HG23 VAL A 78 97.197 53.223 31.168 1.00 46.75 H new ATOM 442 N ASP A 79 94.780 51.641 31.129 1.00 44.52 N ATOM 443 CA ASP A 79 94.874 50.191 30.916 1.00 45.73 C ATOM 444 C ASP A 79 93.519 49.509 30.731 1.00 45.76 C ATOM 445 O ASP A 79 93.440 48.454 30.115 1.00 51.69 O ATOM 446 CB ASP A 79 95.647 49.535 32.063 1.00 45.24 C ATOM 447 CG ASP A 79 97.058 50.060 32.173 1.00 47.26 C ATOM 448 OD1 ASP A 79 97.780 50.054 31.157 1.00 48.76 O ATOM 449 OD2 ASP A 79 97.452 50.509 33.263 1.00 48.35 O ATOM 0 H ASP A 79 94.721 51.870 31.956 1.00 44.52 H new ATOM 0 HA ASP A 79 95.355 50.070 30.082 1.00 45.73 H new ATOM 0 HB2 ASP A 79 95.179 49.692 32.898 1.00 45.24 H new ATOM 0 HB3 ASP A 79 95.670 48.575 31.928 1.00 45.24 H new ATOM 450 N LYS A 80 92.461 50.106 31.259 1.00 46.15 N ATOM 451 CA LYS A 80 91.129 49.517 31.173 1.00 49.77 C ATOM 452 C LYS A 80 90.313 50.044 30.002 1.00 54.09 C ATOM 453 O LYS A 80 89.329 49.411 29.626 1.00 55.16 O ATOM 454 CB LYS A 80 90.374 49.727 32.487 1.00 49.40 C ATOM 455 CG LYS A 80 90.934 48.868 33.614 1.00 50.06 C ATOM 456 CD LYS A 80 90.360 49.266 34.967 1.00 51.40 C ATOM 457 CE LYS A 80 90.908 48.375 36.084 1.00 48.19 C ATOM 458 NZ LYS A 80 90.599 48.914 37.430 1.00 45.93 N ATOM 0 H LYS A 80 92.491 50.858 31.675 1.00 46.15 H new ATOM 0 HA LYS A 80 91.254 48.568 31.015 1.00 49.77 H new ATOM 0 HB2 LYS A 80 90.422 50.662 32.740 1.00 49.40 H new ATOM 0 HB3 LYS A 80 89.436 49.516 32.357 1.00 49.40 H new ATOM 0 HG2 LYS A 80 90.734 47.935 33.440 1.00 50.06 H new ATOM 0 HG3 LYS A 80 91.900 48.952 33.635 1.00 50.06 H new ATOM 0 HD2 LYS A 80 90.577 50.193 35.153 1.00 51.40 H new ATOM 0 HD3 LYS A 80 89.393 49.200 34.943 1.00 51.40 H new ATOM 0 HE2 LYS A 80 90.532 47.485 35.999 1.00 48.19 H new ATOM 0 HE3 LYS A 80 91.869 48.288 35.985 1.00 48.19 H new ATOM 0 HZ1 LYS A 80 90.932 48.371 38.051 1.00 45.93 H new ATOM 0 HZ2 LYS A 80 90.962 49.722 37.517 1.00 45.93 H new ATOM 0 HZ3 LYS A 80 89.717 48.973 37.531 1.00 45.93 H new ATOM 459 N LEU A 81 90.695 51.197 29.443 1.00 54.97 N ATOM 460 CA LEU A 81 90.045 51.717 28.240 1.00 53.12 C ATOM 461 C LEU A 81 90.649 50.964 27.040 1.00 52.66 C ATOM 462 O LEU A 81 91.851 51.084 26.796 1.00 50.12 O ATOM 463 CB LEU A 81 90.256 53.235 28.131 1.00 53.65 C ATOM 0 H LEU A 81 91.329 51.692 29.747 1.00 54.97 H new ATOM 0 HA LEU A 81 89.086 51.576 28.267 1.00 53.12 H new ATOM 464 N HIS A 82 89.823 50.152 26.359 1.00 52.05 N ATOM 465 C HIS A 82 89.429 49.756 23.959 1.00 51.91 C ATOM 466 O HIS A 82 88.257 50.133 24.070 1.00 49.15 O ATOM 467 CA AHIS A 82 90.188 49.290 25.214 0.50 51.16 C ATOM 468 CB AHIS A 82 89.744 47.830 25.478 0.50 52.06 C ATOM 469 CG AHIS A 82 90.778 46.952 26.129 0.50 53.23 C ATOM 470 ND1AHIS A 82 91.366 45.893 25.470 0.50 53.97 N ATOM 471 CD2AHIS A 82 91.283 46.935 27.387 0.50 52.50 C ATOM 472 CE1AHIS A 82 92.213 45.282 26.279 0.50 50.75 C ATOM 473 NE2AHIS A 82 92.176 45.890 27.451 0.50 52.17 N ATOM 474 CA BHIS A 82 90.286 49.427 25.177 0.50 51.91 C ATOM 475 CB BHIS A 82 90.413 47.914 25.426 0.50 54.14 C ATOM 476 CG BHIS A 82 89.111 47.184 25.532 0.50 56.05 C ATOM 477 ND1BHIS A 82 88.341 47.192 26.676 0.50 56.78 N ATOM 478 CD2BHIS A 82 88.470 46.381 24.652 0.50 56.88 C ATOM 479 CE1BHIS A 82 87.268 46.446 26.486 0.50 56.27 C ATOM 480 NE2BHIS A 82 87.321 45.944 25.266 0.50 55.82 N ATOM 0 H AHIS A 82 88.990 50.085 26.563 0.50 52.05 H new ATOM 0 H BHIS A 82 89.000 50.012 26.567 0.50 52.05 H new ATOM 0 HA AHIS A 82 91.149 49.343 25.093 0.50 51.91 H new ATOM 0 HA BHIS A 82 91.185 49.734 24.983 0.50 51.91 H new ATOM 0 HB2AHIS A 82 88.953 47.844 26.040 0.50 54.14 H new ATOM 0 HB2BHIS A 82 90.931 47.523 24.705 0.50 54.14 H new ATOM 0 HB3AHIS A 82 89.485 47.428 24.634 0.50 54.14 H new ATOM 0 HB3BHIS A 82 90.915 47.775 26.244 0.50 54.14 H new ATOM 0 HD1AHIS A 82 91.206 45.665 24.656 0.50 56.78 H new ATOM 0 HD2AHIS A 82 91.067 47.520 28.077 0.50 56.88 H new ATOM 0 HD2BHIS A 82 88.754 46.165 23.793 0.50 56.88 H new ATOM 0 HE1AHIS A 82 92.744 44.550 26.061 0.50 56.27 H new ATOM 0 HE1BHIS A 82 86.590 46.299 27.106 0.50 56.27 H new ATOM 0 HE2BHIS A 82 86.732 45.427 24.913 0.50 55.82 H new ATOM 481 N PHE A 83 90.056 49.687 22.784 1.00 47.86 N ATOM 482 CA PHE A 83 89.351 49.966 21.521 1.00 46.66 C ATOM 483 C PHE A 83 90.073 49.371 20.334 1.00 45.25 C ATOM 484 O PHE A 83 91.260 49.030 20.413 1.00 48.52 O ATOM 485 CB PHE A 83 89.113 51.460 21.285 1.00 45.12 C ATOM 486 CG PHE A 83 90.366 52.244 21.006 1.00 43.69 C ATOM 487 CD1 PHE A 83 91.120 52.768 22.050 1.00 44.87 C ATOM 488 CD2 PHE A 83 90.799 52.452 19.699 1.00 46.49 C ATOM 489 CE1 PHE A 83 92.282 53.499 21.797 1.00 46.79 C ATOM 490 CE2 PHE A 83 91.956 53.183 19.438 1.00 48.95 C ATOM 491 CZ PHE A 83 92.700 53.706 20.491 1.00 45.86 C ATOM 0 H PHE A 83 90.886 49.482 22.692 1.00 47.86 H new ATOM 0 HA PHE A 83 88.484 49.541 21.610 1.00 46.66 H new ATOM 0 HB2 PHE A 83 88.503 51.567 20.538 1.00 45.12 H new ATOM 0 HB3 PHE A 83 88.675 51.835 22.065 1.00 45.12 H new ATOM 0 HD1 PHE A 83 90.847 52.630 22.928 1.00 44.87 H new ATOM 0 HD2 PHE A 83 90.310 52.099 18.991 1.00 46.49 H new ATOM 0 HE1 PHE A 83 92.776 53.847 22.504 1.00 46.79 H new ATOM 0 HE2 PHE A 83 92.231 53.321 18.560 1.00 48.95 H new ATOM 0 HZ PHE A 83 93.474 54.192 20.320 1.00 45.86 H new ATOM 492 N THR A 84 89.325 49.253 19.241 1.00 48.66 N ATOM 493 CA THR A 84 89.803 48.659 17.998 1.00 55.84 C ATOM 494 C THR A 84 90.043 49.817 17.044 1.00 51.90 C ATOM 495 O THR A 84 89.128 50.578 16.741 1.00 52.21 O ATOM 496 CB THR A 84 88.779 47.646 17.420 1.00 62.48 C ATOM 497 OG1 THR A 84 88.699 46.507 18.294 1.00 70.24 O ATOM 498 CG2 THR A 84 89.188 47.164 16.013 1.00 61.41 C ATOM 0 H THR A 84 88.509 49.522 19.201 1.00 48.66 H new ATOM 0 HA THR A 84 90.617 48.152 18.143 1.00 55.84 H new ATOM 0 HB THR A 84 87.920 48.092 17.353 1.00 62.48 H new ATOM 0 HG1 THR A 84 89.405 46.056 18.232 1.00 70.24 H new ATOM 0 HG21 THR A 84 88.529 46.534 15.682 1.00 61.41 H new ATOM 0 HG22 THR A 84 89.238 47.924 15.412 1.00 61.41 H new ATOM 0 HG23 THR A 84 90.054 46.730 16.058 1.00 61.41 H new ATOM 499 N PRO A 85 91.280 49.981 16.595 1.00 49.42 N ATOM 500 CA PRO A 85 91.623 51.157 15.810 1.00 51.79 C ATOM 501 C PRO A 85 91.233 50.990 14.344 1.00 50.13 C ATOM 502 O PRO A 85 91.262 49.875 13.860 1.00 51.45 O ATOM 503 CB PRO A 85 93.138 51.193 15.951 1.00 54.34 C ATOM 504 CG PRO A 85 93.497 49.736 15.924 1.00 54.88 C ATOM 505 CD PRO A 85 92.424 49.062 16.727 1.00 54.22 C ATOM 0 HA PRO A 85 91.169 51.962 16.106 1.00 51.79 H new ATOM 0 HB2 PRO A 85 93.557 51.682 15.226 1.00 54.34 H new ATOM 0 HB3 PRO A 85 93.414 51.618 16.778 1.00 54.34 H new ATOM 0 HG2 PRO A 85 93.523 49.397 15.016 1.00 54.88 H new ATOM 0 HG3 PRO A 85 94.374 49.582 16.309 1.00 54.88 H new ATOM 0 HD2 PRO A 85 92.217 48.180 16.380 1.00 54.22 H new ATOM 0 HD3 PRO A 85 92.688 48.948 17.654 1.00 54.22 H new ATOM 506 N ARG A 86 90.862 52.073 13.658 1.00 49.25 N ATOM 507 CA ARG A 86 90.765 52.068 12.195 1.00 46.39 C ATOM 508 C ARG A 86 92.146 52.367 11.603 1.00 47.94 C ATOM 509 O ARG A 86 92.919 53.127 12.195 1.00 50.15 O ATOM 510 CB ARG A 86 89.742 53.101 11.716 1.00 48.75 C ATOM 0 H ARG A 86 90.661 52.825 14.023 1.00 49.25 H new ATOM 0 HA ARG A 86 90.466 51.195 11.897 1.00 46.39 H new ATOM 511 N ILE A 87 92.452 51.762 10.455 1.00 43.76 N ATOM 512 CA ILE A 87 93.716 51.950 9.752 1.00 46.81 C ATOM 513 C ILE A 87 93.440 52.909 8.625 1.00 46.50 C ATOM 514 O ILE A 87 92.396 52.838 7.996 1.00 43.08 O ATOM 515 CB ILE A 87 94.288 50.643 9.154 1.00 53.32 C ATOM 516 CG1 ILE A 87 94.451 49.580 10.248 1.00 63.07 C ATOM 517 CG2 ILE A 87 95.626 50.909 8.466 1.00 52.81 C ATOM 518 CD1 ILE A 87 94.934 48.222 9.755 1.00 64.87 C ATOM 0 H ILE A 87 91.917 51.219 10.056 1.00 43.76 H new ATOM 0 HA ILE A 87 94.375 52.276 10.385 1.00 46.81 H new ATOM 0 HB ILE A 87 93.663 50.310 8.491 1.00 53.32 H new ATOM 0 HG12 ILE A 87 95.077 49.910 10.911 1.00 63.07 H new ATOM 0 HG13 ILE A 87 93.599 49.463 10.696 1.00 63.07 H new ATOM 0 HG21 ILE A 87 95.971 50.081 8.097 1.00 52.81 H new ATOM 0 HG22 ILE A 87 95.500 51.553 7.752 1.00 52.81 H new ATOM 0 HG23 ILE A 87 96.258 51.262 9.112 1.00 52.81 H new ATOM 0 HD11 ILE A 87 95.009 47.613 10.506 1.00 64.87 H new ATOM 0 HD12 ILE A 87 94.300 47.866 9.113 1.00 64.87 H new ATOM 0 HD13 ILE A 87 95.801 48.321 9.331 1.00 64.87 H new ATOM 519 N GLN A 88 94.392 53.791 8.360 1.00 42.28 N ATOM 520 CA GLN A 88 94.168 54.887 7.460 1.00 45.98 C ATOM 521 C GLN A 88 95.385 55.055 6.580 1.00 45.48 C ATOM 522 O GLN A 88 96.489 55.160 7.093 1.00 42.82 O ATOM 523 CB GLN A 88 93.963 56.132 8.297 1.00 48.74 C ATOM 524 CG GLN A 88 93.385 57.285 7.560 1.00 50.82 C ATOM 525 CD GLN A 88 93.053 58.422 8.488 1.00 48.89 C ATOM 526 OE1 GLN A 88 93.791 58.724 9.426 1.00 45.57 O ATOM 527 NE2 GLN A 88 91.936 59.065 8.229 1.00 48.11 N ATOM 0 H GLN A 88 95.181 53.764 8.700 1.00 42.28 H new ATOM 0 HA GLN A 88 93.393 54.727 6.899 1.00 45.98 H new ATOM 0 HB2 GLN A 88 93.381 55.914 9.042 1.00 48.74 H new ATOM 0 HB3 GLN A 88 94.816 56.399 8.673 1.00 48.74 H new ATOM 0 HG2 GLN A 88 94.014 57.588 6.887 1.00 50.82 H new ATOM 0 HG3 GLN A 88 92.583 57.003 7.092 1.00 50.82 H new ATOM 0 HE21 GLN A 88 91.446 58.825 7.564 1.00 48.11 H new ATOM 0 HE22 GLN A 88 91.695 59.726 8.724 1.00 48.11 H new ATOM 528 N ARG A 89 95.174 55.052 5.262 1.00 46.24 N ATOM 529 CA ARG A 89 96.217 55.387 4.290 1.00 49.25 C ATOM 530 C ARG A 89 96.089 56.866 3.994 1.00 46.42 C ATOM 531 O ARG A 89 94.987 57.410 3.920 1.00 53.48 O ATOM 532 CB ARG A 89 96.045 54.591 2.997 1.00 57.83 C ATOM 533 CG ARG A 89 95.896 53.084 3.202 1.00 63.50 C ATOM 534 CD ARG A 89 94.911 52.431 2.237 1.00 70.22 C ATOM 535 NE ARG A 89 95.623 51.693 1.198 1.00 79.96 N ATOM 536 CZ ARG A 89 96.126 52.213 0.078 1.00 81.84 C ATOM 537 NH1 ARG A 89 95.992 53.502 -0.208 1.00 84.42 N ATOM 538 NH2 ARG A 89 96.765 51.423 -0.778 1.00 84.40 N ATOM 0 H ARG A 89 94.417 54.854 4.905 1.00 46.24 H new ATOM 0 HA ARG A 89 97.090 55.169 4.653 1.00 49.25 H new ATOM 0 HB2 ARG A 89 95.263 54.922 2.527 1.00 57.83 H new ATOM 0 HB3 ARG A 89 96.811 54.755 2.424 1.00 57.83 H new ATOM 0 HG2 ARG A 89 96.764 52.664 3.100 1.00 63.50 H new ATOM 0 HG3 ARG A 89 95.605 52.916 4.112 1.00 63.50 H new ATOM 0 HD2 ARG A 89 94.324 51.831 2.723 1.00 70.22 H new ATOM 0 HD3 ARG A 89 94.349 53.110 1.831 1.00 70.22 H new ATOM 0 HE ARG A 89 95.727 50.848 1.319 1.00 79.96 H new ATOM 0 HH11 ARG A 89 95.573 54.022 0.335 1.00 84.42 H new ATOM 0 HH12 ARG A 89 96.324 53.818 -0.936 1.00 84.42 H new ATOM 0 HH21 ARG A 89 96.851 50.585 -0.607 1.00 84.40 H new ATOM 0 HH22 ARG A 89 97.093 51.750 -1.503 1.00 84.40 H new ATOM 539 N LEU A 90 97.215 57.521 3.810 1.00 43.07 N ATOM 540 CA LEU A 90 97.231 58.968 3.676 1.00 42.69 C ATOM 541 C LEU A 90 97.521 59.374 2.236 1.00 40.88 C ATOM 542 O LEU A 90 98.650 59.647 1.884 1.00 42.96 O ATOM 543 CB LEU A 90 98.248 59.545 4.658 1.00 43.06 C ATOM 544 CG LEU A 90 97.884 59.338 6.145 1.00 45.18 C ATOM 545 CD1 LEU A 90 99.009 59.849 7.025 1.00 43.42 C ATOM 546 CD2 LEU A 90 96.566 60.009 6.540 1.00 44.57 C ATOM 0 H LEU A 90 97.988 57.148 3.759 1.00 43.07 H new ATOM 0 HA LEU A 90 96.358 59.331 3.892 1.00 42.69 H new ATOM 0 HB2 LEU A 90 99.112 59.139 4.488 1.00 43.06 H new ATOM 0 HB3 LEU A 90 98.343 60.495 4.488 1.00 43.06 H new ATOM 0 HG LEU A 90 97.762 58.385 6.275 1.00 45.18 H new ATOM 0 HD11 LEU A 90 98.776 59.717 7.957 1.00 43.42 H new ATOM 0 HD12 LEU A 90 99.824 59.363 6.824 1.00 43.42 H new ATOM 0 HD13 LEU A 90 99.147 60.794 6.857 1.00 43.42 H new ATOM 0 HD21 LEU A 90 96.389 59.847 7.480 1.00 44.57 H new ATOM 0 HD22 LEU A 90 96.629 60.964 6.384 1.00 44.57 H new ATOM 0 HD23 LEU A 90 95.843 59.642 6.007 1.00 44.57 H new ATOM 547 N ASN A 91 96.479 59.409 1.415 1.00 42.38 N ATOM 548 CA ASN A 91 96.599 59.746 0.003 1.00 42.25 C ATOM 549 C ASN A 91 95.539 60.710 -0.407 1.00 39.90 C ATOM 550 O ASN A 91 94.361 60.419 -0.310 1.00 44.97 O ATOM 551 CB ASN A 91 96.461 58.498 -0.843 1.00 44.19 C ATOM 552 CG ASN A 91 97.616 57.550 -0.650 1.00 44.70 C ATOM 553 OD1 ASN A 91 98.775 57.939 -0.736 1.00 45.73 O ATOM 554 ND2 ASN A 91 97.306 56.300 -0.378 1.00 45.51 N ATOM 0 H ASN A 91 95.674 59.236 1.664 1.00 42.38 H new ATOM 0 HA ASN A 91 97.471 60.149 -0.131 1.00 42.25 H new ATOM 0 HB2 ASN A 91 95.633 58.046 -0.618 1.00 44.19 H new ATOM 0 HB3 ASN A 91 96.402 58.748 -1.778 1.00 44.19 H new ATOM 0 HD21 ASN A 91 97.929 55.720 -0.253 1.00 45.51 H new ATOM 0 HD22 ASN A 91 96.481 56.063 -0.325 1.00 45.51 H new ATOM 555 N GLU A 92 95.961 61.856 -0.898 1.00 38.07 N ATOM 556 CA GLU A 92 95.038 62.883 -1.314 1.00 42.10 C ATOM 557 C GLU A 92 94.131 62.347 -2.411 1.00 42.60 C ATOM 558 O GLU A 92 94.566 61.535 -3.213 1.00 42.08 O ATOM 559 CB GLU A 92 95.810 64.072 -1.841 1.00 42.86 C ATOM 560 CG GLU A 92 94.943 65.286 -2.033 1.00 47.70 C ATOM 561 CD GLU A 92 95.740 66.529 -2.327 1.00 50.29 C ATOM 562 OE1 GLU A 92 96.993 66.435 -2.382 1.00 54.80 O ATOM 563 OE2 GLU A 92 95.093 67.591 -2.488 1.00 45.87 O ATOM 0 H GLU A 92 96.790 62.060 -0.999 1.00 38.07 H new ATOM 0 HA GLU A 92 94.499 63.154 -0.554 1.00 42.10 H new ATOM 0 HB2 GLU A 92 96.528 64.286 -1.225 1.00 42.86 H new ATOM 0 HB3 GLU A 92 96.223 63.836 -2.687 1.00 42.86 H new ATOM 0 HG2 GLU A 92 94.323 65.124 -2.761 1.00 47.70 H new ATOM 0 HG3 GLU A 92 94.411 65.429 -1.234 1.00 47.70 H new ATOM 564 N LEU A 93 92.879 62.805 -2.423 1.00 40.44 N ATOM 565 CA LEU A 93 91.862 62.377 -3.383 1.00 44.79 C ATOM 566 C LEU A 93 91.490 60.880 -3.390 1.00 46.16 C ATOM 567 O LEU A 93 90.584 60.514 -4.109 1.00 50.27 O ATOM 568 CB LEU A 93 92.231 62.830 -4.799 1.00 42.92 C ATOM 569 CG LEU A 93 92.455 64.331 -4.949 1.00 45.45 C ATOM 570 CD1 LEU A 93 92.851 64.670 -6.394 1.00 48.29 C ATOM 571 CD2 LEU A 93 91.235 65.129 -4.512 1.00 43.04 C ATOM 0 H LEU A 93 92.591 63.387 -1.859 1.00 40.44 H new ATOM 0 HA LEU A 93 91.058 62.819 -3.068 1.00 44.79 H new ATOM 0 HB2 LEU A 93 93.037 62.366 -5.074 1.00 42.92 H new ATOM 0 HB3 LEU A 93 91.526 62.558 -5.407 1.00 42.92 H new ATOM 0 HG LEU A 93 93.185 64.584 -4.362 1.00 45.45 H new ATOM 0 HD11 LEU A 93 92.990 65.626 -6.476 1.00 48.29 H new ATOM 0 HD12 LEU A 93 93.670 64.204 -6.623 1.00 48.29 H new ATOM 0 HD13 LEU A 93 92.143 64.394 -6.997 1.00 48.29 H new ATOM 0 HD21 LEU A 93 91.412 66.077 -4.620 1.00 43.04 H new ATOM 0 HD22 LEU A 93 90.472 64.879 -5.056 1.00 43.04 H new ATOM 0 HD23 LEU A 93 91.042 64.941 -3.580 1.00 43.04 H new ATOM 572 N GLU A 94 92.135 60.029 -2.588 1.00 46.73 N ATOM 573 CA GLU A 94 91.747 58.613 -2.512 1.00 50.23 C ATOM 574 C GLU A 94 90.467 58.501 -1.675 1.00 52.67 C ATOM 575 O GLU A 94 90.282 59.245 -0.702 1.00 49.50 O ATOM 576 CB GLU A 94 92.867 57.749 -1.901 1.00 53.85 C ATOM 577 CG GLU A 94 92.668 56.244 -2.087 1.00 58.48 C ATOM 578 CD GLU A 94 93.594 55.356 -1.248 1.00 62.84 C ATOM 579 OE1 GLU A 94 94.599 55.824 -0.696 1.00 65.14 O ATOM 580 OE2 GLU A 94 93.313 54.146 -1.129 1.00 74.28 O ATOM 0 H GLU A 94 92.796 60.247 -2.082 1.00 46.73 H new ATOM 0 HA GLU A 94 91.590 58.281 -3.410 1.00 50.23 H new ATOM 0 HB2 GLU A 94 93.713 58.005 -2.300 1.00 53.85 H new ATOM 0 HB3 GLU A 94 92.930 57.942 -0.953 1.00 53.85 H new ATOM 0 HG2 GLU A 94 91.748 56.024 -1.870 1.00 58.48 H new ATOM 0 HG3 GLU A 94 92.798 56.028 -3.024 1.00 58.48 H new ATOM 581 N ALA A 95 89.602 57.562 -2.062 1.00 51.88 N ATOM 582 CA ALA A 95 88.311 57.348 -1.421 1.00 50.88 C ATOM 583 C ALA A 95 88.488 56.679 -0.066 1.00 51.41 C ATOM 584 O ALA A 95 89.261 55.722 0.073 1.00 48.36 O ATOM 585 CB ALA A 95 87.417 56.487 -2.296 1.00 53.00 C ATOM 0 H ALA A 95 89.755 57.024 -2.716 1.00 51.88 H new ATOM 0 HA ALA A 95 87.894 58.215 -1.295 1.00 50.88 H new ATOM 0 HB1 ALA A 95 86.563 56.355 -1.855 1.00 53.00 H new ATOM 0 HB2 ALA A 95 87.276 56.929 -3.148 1.00 53.00 H new ATOM 0 HB3 ALA A 95 87.841 55.627 -2.444 1.00 53.00 H new ATOM 586 N GLN A 96 87.794 57.221 0.933 1.00 47.95 N ATOM 587 CA GLN A 96 87.690 56.599 2.246 1.00 47.74 C ATOM 588 C GLN A 96 86.203 56.580 2.606 1.00 49.54 C ATOM 589 O GLN A 96 85.416 57.410 2.103 1.00 49.46 O ATOM 590 CB GLN A 96 88.502 57.382 3.290 1.00 47.87 C ATOM 591 CG GLN A 96 90.007 57.405 3.044 1.00 48.34 C ATOM 592 CD GLN A 96 90.771 58.155 4.137 1.00 52.54 C ATOM 593 OE1 GLN A 96 90.705 57.799 5.321 1.00 49.07 O ATOM 594 NE2 GLN A 96 91.516 59.190 3.744 1.00 51.81 N ATOM 0 H GLN A 96 87.368 57.965 0.865 1.00 47.95 H new ATOM 0 HA GLN A 96 88.052 55.699 2.233 1.00 47.74 H new ATOM 0 HB2 GLN A 96 88.177 58.296 3.315 1.00 47.87 H new ATOM 0 HB3 GLN A 96 88.336 56.998 4.165 1.00 47.87 H new ATOM 0 HG2 GLN A 96 90.336 56.494 2.991 1.00 48.34 H new ATOM 0 HG3 GLN A 96 90.185 57.821 2.186 1.00 48.34 H new ATOM 0 HE21 GLN A 96 91.540 59.412 2.913 1.00 51.81 H new ATOM 0 HE22 GLN A 96 91.972 59.635 4.321 1.00 51.81 H new ATOM 595 N THR A 97 85.807 55.635 3.451 1.00 50.64 N ATOM 596 CA THR A 97 84.402 55.568 3.872 1.00 56.90 C ATOM 597 C THR A 97 84.299 56.261 5.232 1.00 53.80 C ATOM 598 O THR A 97 85.169 56.116 6.086 1.00 48.21 O ATOM 599 CB THR A 97 83.775 54.136 3.844 1.00 59.21 C ATOM 600 OG1 THR A 97 83.358 53.749 5.158 1.00 66.40 O ATOM 601 CG2 THR A 97 84.718 53.058 3.214 1.00 57.01 C ATOM 0 H THR A 97 86.320 55.033 3.789 1.00 50.64 H new ATOM 0 HA THR A 97 83.856 56.034 3.219 1.00 56.90 H new ATOM 0 HB THR A 97 82.999 54.183 3.264 1.00 59.21 H new ATOM 0 HG1 THR A 97 83.022 52.980 5.130 1.00 66.40 H new ATOM 0 HG21 THR A 97 84.276 52.195 3.225 1.00 57.01 H new ATOM 0 HG22 THR A 97 84.924 53.304 2.299 1.00 57.01 H new ATOM 0 HG23 THR A 97 85.539 53.006 3.727 1.00 57.01 H new ATOM 602 N ARG A 98 83.236 57.025 5.422 1.00 55.79 N ATOM 603 CA ARG A 98 83.177 57.986 6.527 1.00 64.94 C ATOM 604 C ARG A 98 83.078 57.381 7.948 1.00 69.64 C ATOM 605 O ARG A 98 83.935 57.667 8.797 1.00 72.44 O ATOM 606 CB ARG A 98 82.041 58.975 6.284 1.00 67.68 C ATOM 607 CG ARG A 98 82.191 60.263 7.068 1.00 72.73 C ATOM 608 CD ARG A 98 80.998 61.168 6.851 1.00 75.65 C ATOM 609 NE ARG A 98 80.650 61.836 8.096 1.00 77.16 N ATOM 610 CZ ARG A 98 79.439 62.291 8.417 1.00 82.12 C ATOM 611 NH1 ARG A 98 78.395 62.178 7.585 1.00 83.10 N ATOM 612 NH2 ARG A 98 79.273 62.871 9.603 1.00 86.00 N ATOM 0 H ARG A 98 82.534 57.007 4.925 1.00 55.79 H new ATOM 0 HA ARG A 98 84.038 58.433 6.521 1.00 64.94 H new ATOM 0 HB2 ARG A 98 81.998 59.183 5.337 1.00 67.68 H new ATOM 0 HB3 ARG A 98 81.199 58.556 6.521 1.00 67.68 H new ATOM 0 HG2 ARG A 98 82.282 60.062 8.013 1.00 72.73 H new ATOM 0 HG3 ARG A 98 83.002 60.720 6.795 1.00 72.73 H new ATOM 0 HD2 ARG A 98 81.201 61.826 6.168 1.00 75.65 H new ATOM 0 HD3 ARG A 98 80.243 60.650 6.531 1.00 75.65 H new ATOM 0 HE ARG A 98 81.278 61.946 8.673 1.00 77.16 H new ATOM 0 HH11 ARG A 98 78.495 61.803 6.818 1.00 83.10 H new ATOM 0 HH12 ARG A 98 77.625 62.481 7.818 1.00 83.10 H new ATOM 0 HH21 ARG A 98 79.939 62.945 10.142 1.00 86.00 H new ATOM 0 HH22 ARG A 98 78.500 63.172 9.830 1.00 86.00 H new ATOM 613 N VAL A 99 82.048 56.573 8.212 1.00 72.66 N ATOM 614 CA VAL A 99 81.887 55.921 9.525 1.00 72.38 C ATOM 615 C VAL A 99 82.609 54.585 9.479 1.00 69.68 C ATOM 616 O VAL A 99 82.358 53.709 10.290 1.00 76.96 O ATOM 617 CB VAL A 99 80.406 55.729 9.912 1.00 68.39 C ATOM 0 H VAL A 99 81.428 56.387 7.646 1.00 72.66 H new ATOM 0 HA VAL A 99 82.270 56.494 10.208 1.00 72.38 H new ATOM 618 N ARG A 375 92.302 44.227 15.151 1.00 94.64 N ATOM 619 CA ARG A 375 93.159 44.141 16.328 1.00 92.96 C ATOM 620 C ARG A 375 92.636 45.047 17.488 1.00 93.17 C ATOM 621 O ARG A 375 91.481 45.487 17.434 1.00100.72 O ATOM 622 CB ARG A 375 94.606 44.431 15.912 1.00 95.28 C ATOM 623 CG ARG A 375 94.838 45.757 15.196 1.00 96.11 C ATOM 624 CD ARG A 375 96.268 46.259 15.385 1.00102.39 C ATOM 625 NE ARG A 375 96.572 46.596 16.792 1.00108.73 N ATOM 626 CZ ARG A 375 97.201 45.816 17.687 1.00106.23 C ATOM 627 NH1 ARG A 375 97.625 44.585 17.388 1.00111.96 N ATOM 628 NH2 ARG A 375 97.400 46.271 18.924 1.00 98.55 N ATOM 0 HA ARG A 375 93.136 43.242 16.692 1.00 92.96 H new ATOM 0 HB2 ARG A 375 95.163 44.410 16.706 1.00 95.28 H new ATOM 0 HB3 ARG A 375 94.908 43.713 15.334 1.00 95.28 H new ATOM 0 HG2 ARG A 375 94.655 45.650 14.249 1.00 96.11 H new ATOM 0 HG3 ARG A 375 94.215 46.420 15.532 1.00 96.11 H new ATOM 0 HD2 ARG A 375 96.889 45.580 15.077 1.00102.39 H new ATOM 0 HD3 ARG A 375 96.408 47.043 14.831 1.00102.39 H new ATOM 0 HE ARG A 375 96.320 47.371 17.066 1.00108.73 H new ATOM 0 HH11 ARG A 375 97.498 44.266 16.599 1.00111.96 H new ATOM 0 HH12 ARG A 375 98.025 44.111 17.984 1.00111.96 H new ATOM 0 HH21 ARG A 375 97.127 47.057 19.142 1.00 98.55 H new ATOM 0 HH22 ARG A 375 97.802 45.779 19.504 1.00 98.55 H new ATOM 629 N ASP A 376 93.438 45.305 18.530 1.00 75.06 N ATOM 630 CA ASP A 376 92.942 45.996 19.736 1.00 68.84 C ATOM 631 C ASP A 376 94.064 46.662 20.554 1.00 59.24 C ATOM 632 O ASP A 376 95.100 46.053 20.782 1.00 57.01 O ATOM 633 CB ASP A 376 92.178 44.992 20.611 1.00 73.75 C ATOM 634 CG ASP A 376 92.004 45.464 22.053 1.00 79.75 C ATOM 635 OD1 ASP A 376 91.022 46.180 22.340 1.00 82.13 O ATOM 636 OD2 ASP A 376 92.846 45.111 22.914 1.00 81.69 O ATOM 0 H ASP A 376 94.270 45.090 18.561 1.00 75.06 H new ATOM 0 HA ASP A 376 92.355 46.710 19.442 1.00 68.84 H new ATOM 0 HB2 ASP A 376 91.304 44.831 20.221 1.00 73.75 H new ATOM 0 HB3 ASP A 376 92.650 44.145 20.609 1.00 73.75 H new ATOM 637 N TYR A 377 93.828 47.900 21.001 1.00 52.49 N ATOM 638 CA TYR A 377 94.784 48.689 21.800 1.00 48.16 C ATOM 639 C TYR A 377 94.117 49.099 23.103 1.00 43.42 C ATOM 640 O TYR A 377 92.917 49.308 23.136 1.00 39.70 O ATOM 641 CB TYR A 377 95.150 50.011 21.085 1.00 48.38 C ATOM 642 CG TYR A 377 96.167 49.966 19.961 1.00 49.86 C ATOM 643 CD1 TYR A 377 97.540 49.914 20.220 1.00 51.83 C ATOM 644 CD2 TYR A 377 95.765 50.048 18.630 1.00 51.92 C ATOM 645 CE1 TYR A 377 98.477 49.896 19.183 1.00 51.59 C ATOM 646 CE2 TYR A 377 96.693 50.025 17.589 1.00 51.44 C ATOM 647 CZ TYR A 377 98.042 49.948 17.868 1.00 51.22 C ATOM 648 OH TYR A 377 98.927 49.929 16.828 1.00 51.00 O ATOM 0 H TYR A 377 93.092 48.316 20.846 1.00 52.49 H new ATOM 0 HA TYR A 377 95.573 48.142 21.936 1.00 48.16 H new ATOM 0 HB2 TYR A 377 94.332 50.390 20.728 1.00 48.38 H new ATOM 0 HB3 TYR A 377 95.479 50.629 21.757 1.00 48.38 H new ATOM 0 HD1 TYR A 377 97.836 49.891 21.101 1.00 51.83 H new ATOM 0 HD2 TYR A 377 94.859 50.120 18.431 1.00 51.92 H new ATOM 0 HE1 TYR A 377 99.386 49.849 19.374 1.00 51.59 H new ATOM 0 HE2 TYR A 377 96.402 50.062 16.706 1.00 51.44 H new ATOM 0 HH TYR A 377 98.639 50.414 16.206 1.00 51.00 H new ATOM 649 N THR A 378 94.905 49.277 24.159 1.00 42.34 N ATOM 650 CA THR A 378 94.462 50.077 25.297 1.00 40.75 C ATOM 651 C THR A 378 94.868 51.507 24.995 1.00 42.02 C ATOM 652 O THR A 378 95.687 51.749 24.109 1.00 39.09 O ATOM 653 CB THR A 378 95.110 49.621 26.627 1.00 42.85 C ATOM 654 OG1 THR A 378 96.519 49.892 26.621 1.00 39.45 O ATOM 655 CG2 THR A 378 94.886 48.114 26.845 1.00 40.92 C ATOM 0 H THR A 378 95.695 48.946 24.237 1.00 42.34 H new ATOM 0 HA THR A 378 93.504 49.980 25.413 1.00 40.75 H new ATOM 0 HB THR A 378 94.692 50.117 27.349 1.00 42.85 H new ATOM 0 HG1 THR A 378 96.856 49.641 27.348 1.00 39.45 H new ATOM 0 HG21 THR A 378 95.297 47.843 27.681 1.00 40.92 H new ATOM 0 HG22 THR A 378 93.934 47.930 26.878 1.00 40.92 H new ATOM 0 HG23 THR A 378 95.285 47.618 26.113 1.00 40.92 H new ATOM 656 N LEU A 379 94.338 52.458 25.747 1.00 37.50 N ATOM 657 CA LEU A 379 94.779 53.831 25.593 1.00 40.91 C ATOM 658 C LEU A 379 96.296 53.918 25.807 1.00 41.26 C ATOM 659 O LEU A 379 96.973 54.638 25.074 1.00 40.72 O ATOM 660 CB LEU A 379 94.028 54.759 26.534 1.00 41.63 C ATOM 661 CG LEU A 379 94.031 56.240 26.210 1.00 48.49 C ATOM 662 CD1 LEU A 379 93.471 56.520 24.820 1.00 50.05 C ATOM 663 CD2 LEU A 379 93.201 56.949 27.271 1.00 50.69 C ATOM 0 H LEU A 379 93.731 52.332 26.343 1.00 37.50 H new ATOM 0 HA LEU A 379 94.580 54.123 24.690 1.00 40.91 H new ATOM 0 HB2 LEU A 379 93.105 54.463 26.572 1.00 41.63 H new ATOM 0 HB3 LEU A 379 94.399 54.647 27.423 1.00 41.63 H new ATOM 0 HG LEU A 379 94.944 56.567 26.211 1.00 48.49 H new ATOM 0 HD11 LEU A 379 93.489 57.475 24.650 1.00 50.05 H new ATOM 0 HD12 LEU A 379 94.010 56.063 24.156 1.00 50.05 H new ATOM 0 HD13 LEU A 379 92.557 56.200 24.769 1.00 50.05 H new ATOM 0 HD21 LEU A 379 93.186 57.901 27.087 1.00 50.69 H new ATOM 0 HD22 LEU A 379 92.295 56.603 27.258 1.00 50.69 H new ATOM 0 HD23 LEU A 379 93.593 56.795 28.145 1.00 50.69 H new ATOM 664 N ARG A 380 96.835 53.153 26.761 1.00 36.98 N ATOM 665 CA ARG A 380 98.267 53.155 26.975 1.00 38.19 C ATOM 666 C ARG A 380 99.033 52.662 25.768 1.00 36.05 C ATOM 667 O ARG A 380 99.941 53.347 25.319 1.00 35.27 O ATOM 668 CB ARG A 380 98.692 52.327 28.185 1.00 41.77 C ATOM 669 CG ARG A 380 100.171 52.546 28.521 1.00 39.37 C ATOM 670 CD ARG A 380 100.679 51.561 29.540 1.00 40.22 C ATOM 671 NE ARG A 380 99.980 51.716 30.799 1.00 40.11 N ATOM 672 CZ ARG A 380 100.276 52.601 31.746 1.00 42.76 C ATOM 673 NH1 ARG A 380 101.290 53.459 31.615 1.00 45.11 N ATOM 674 NH2 ARG A 380 99.534 52.625 32.843 1.00 44.13 N ATOM 0 H ARG A 380 96.389 52.636 27.284 1.00 36.98 H new ATOM 0 HA ARG A 380 98.485 54.086 27.139 1.00 38.19 H new ATOM 0 HB2 ARG A 380 98.146 52.566 28.950 1.00 41.77 H new ATOM 0 HB3 ARG A 380 98.535 51.387 28.007 1.00 41.77 H new ATOM 0 HG2 ARG A 380 100.699 52.471 27.711 1.00 39.37 H new ATOM 0 HG3 ARG A 380 100.294 53.448 28.857 1.00 39.37 H new ATOM 0 HD2 ARG A 380 100.561 50.657 29.209 1.00 40.22 H new ATOM 0 HD3 ARG A 380 101.631 51.691 29.675 1.00 40.22 H new ATOM 0 HE ARG A 380 99.316 51.190 30.947 1.00 40.11 H new ATOM 0 HH11 ARG A 380 101.773 53.449 30.903 1.00 45.11 H new ATOM 0 HH12 ARG A 380 101.461 54.022 32.242 1.00 45.11 H new ATOM 0 HH21 ARG A 380 98.878 52.076 32.930 1.00 44.13 H new ATOM 0 HH22 ARG A 380 99.708 53.190 33.468 1.00 44.13 H new ATOM 675 N THR A 381 98.683 51.483 25.252 1.00 35.39 N ATOM 676 CA THR A 381 99.453 50.866 24.167 1.00 35.42 C ATOM 677 C THR A 381 99.306 51.681 22.877 1.00 37.36 C ATOM 678 O THR A 381 100.243 51.780 22.088 1.00 39.37 O ATOM 679 CB THR A 381 99.063 49.372 23.931 1.00 39.06 C ATOM 680 OG1 THR A 381 97.667 49.276 23.646 1.00 39.71 O ATOM 681 CG2 THR A 381 99.376 48.511 25.158 1.00 39.24 C ATOM 0 H THR A 381 98.005 51.024 25.515 1.00 35.39 H new ATOM 0 HA THR A 381 100.385 50.870 24.437 1.00 35.42 H new ATOM 0 HB THR A 381 99.585 49.046 23.181 1.00 39.06 H new ATOM 0 HG1 THR A 381 97.509 48.547 23.259 1.00 39.71 H new ATOM 0 HG21 THR A 381 99.123 47.591 24.981 1.00 39.24 H new ATOM 0 HG22 THR A 381 100.326 48.554 25.350 1.00 39.24 H new ATOM 0 HG23 THR A 381 98.877 48.842 25.921 1.00 39.24 H new ATOM 682 N PHE A 382 98.141 52.289 22.676 1.00 37.15 N ATOM 683 CA PHE A 382 97.977 53.196 21.566 1.00 37.37 C ATOM 684 C PHE A 382 98.892 54.394 21.697 1.00 36.66 C ATOM 685 O PHE A 382 99.506 54.800 20.724 1.00 39.21 O ATOM 686 CB PHE A 382 96.541 53.675 21.421 1.00 38.00 C ATOM 687 CG PHE A 382 96.310 54.464 20.164 1.00 38.15 C ATOM 688 CD1 PHE A 382 95.986 53.825 18.981 1.00 41.08 C ATOM 689 CD2 PHE A 382 96.431 55.843 20.162 1.00 36.61 C ATOM 690 CE1 PHE A 382 95.775 54.562 17.817 1.00 41.52 C ATOM 691 CE2 PHE A 382 96.224 56.582 19.011 1.00 37.66 C ATOM 692 CZ PHE A 382 95.902 55.946 17.836 1.00 36.83 C ATOM 0 H PHE A 382 97.444 52.187 23.169 1.00 37.15 H new ATOM 0 HA PHE A 382 98.214 52.695 20.770 1.00 37.37 H new ATOM 0 HB2 PHE A 382 95.947 52.908 21.429 1.00 38.00 H new ATOM 0 HB3 PHE A 382 96.309 54.222 22.188 1.00 38.00 H new ATOM 0 HD1 PHE A 382 95.908 52.898 18.962 1.00 41.08 H new ATOM 0 HD2 PHE A 382 96.656 56.282 20.951 1.00 36.61 H new ATOM 0 HE1 PHE A 382 95.549 54.127 17.027 1.00 41.52 H new ATOM 0 HE2 PHE A 382 96.303 57.508 19.032 1.00 37.66 H new ATOM 0 HZ PHE A 382 95.770 56.439 17.058 1.00 36.83 H new ATOM 693 N GLY A 383 98.939 54.975 22.886 1.00 36.50 N ATOM 694 CA GLY A 383 99.759 56.130 23.158 1.00 35.87 C ATOM 695 C GLY A 383 101.230 55.859 22.935 1.00 37.24 C ATOM 696 O GLY A 383 101.917 56.686 22.350 1.00 35.49 O ATOM 0 H GLY A 383 98.487 54.701 23.564 1.00 36.50 H new ATOM 0 HA2 GLY A 383 99.478 56.864 22.589 1.00 35.87 H new ATOM 0 HA3 GLY A 383 99.620 56.413 24.075 1.00 35.87 H new ATOM 697 N GLU A 384 101.695 54.703 23.386 1.00 37.75 N ATOM 698 CA GLU A 384 103.082 54.272 23.168 1.00 44.25 C ATOM 699 C GLU A 384 103.395 54.150 21.674 1.00 42.86 C ATOM 700 O GLU A 384 104.417 54.639 21.215 1.00 43.48 O ATOM 701 CB GLU A 384 103.379 52.958 23.911 1.00 44.10 C ATOM 702 CG GLU A 384 103.502 53.170 25.431 1.00 50.71 C ATOM 703 CD GLU A 384 103.392 51.904 26.320 1.00 54.32 C ATOM 704 OE1 GLU A 384 103.071 50.801 25.835 1.00 56.54 O ATOM 705 OE2 GLU A 384 103.611 52.026 27.551 1.00 61.25 O ATOM 0 H GLU A 384 101.219 54.140 23.829 1.00 37.75 H new ATOM 0 HA GLU A 384 103.665 54.955 23.535 1.00 44.25 H new ATOM 0 HB2 GLU A 384 102.672 52.319 23.731 1.00 44.10 H new ATOM 0 HB3 GLU A 384 104.202 52.574 23.571 1.00 44.10 H new ATOM 0 HG2 GLU A 384 104.356 53.593 25.610 1.00 50.71 H new ATOM 0 HG3 GLU A 384 102.813 53.795 25.707 1.00 50.71 H new ATOM 706 N MET A 385 102.485 53.540 20.922 1.00 41.55 N ATOM 707 CA MET A 385 102.620 53.427 19.466 1.00 41.51 C ATOM 708 C MET A 385 102.617 54.826 18.831 1.00 40.52 C ATOM 709 O MET A 385 103.461 55.144 17.993 1.00 40.58 O ATOM 710 CB MET A 385 101.496 52.514 18.904 1.00 42.36 C ATOM 711 CG MET A 385 101.399 52.389 17.384 1.00 41.40 C ATOM 712 SD MET A 385 100.640 53.809 16.559 1.00 43.74 S ATOM 713 CE MET A 385 98.958 53.768 17.165 1.00 45.97 C ATOM 0 H MET A 385 101.771 53.179 21.238 1.00 41.55 H new ATOM 0 HA MET A 385 103.467 53.013 19.240 1.00 41.51 H new ATOM 0 HB2 MET A 385 101.617 51.625 19.272 1.00 42.36 H new ATOM 0 HB3 MET A 385 100.646 52.844 19.234 1.00 42.36 H new ATOM 0 HG2 MET A 385 102.290 52.259 17.024 1.00 41.40 H new ATOM 0 HG3 MET A 385 100.888 51.593 17.169 1.00 41.40 H new ATOM 0 HE1 MET A 385 98.353 54.045 16.459 1.00 45.97 H new ATOM 0 HE2 MET A 385 98.737 52.866 17.445 1.00 45.97 H new ATOM 0 HE3 MET A 385 98.871 54.371 17.920 1.00 45.97 H new ATOM 714 N ALA A 386 101.699 55.678 19.269 1.00 36.94 N ATOM 715 CA ALA A 386 101.551 56.999 18.683 1.00 37.34 C ATOM 716 C ALA A 386 102.812 57.864 18.881 1.00 38.56 C ATOM 717 O ALA A 386 103.298 58.486 17.935 1.00 36.59 O ATOM 718 CB ALA A 386 100.329 57.692 19.240 1.00 36.51 C ATOM 0 H ALA A 386 101.150 55.508 19.908 1.00 36.94 H new ATOM 0 HA ALA A 386 101.433 56.882 17.727 1.00 37.34 H new ATOM 0 HB1 ALA A 386 100.245 58.571 18.839 1.00 36.51 H new ATOM 0 HB2 ALA A 386 99.539 57.167 19.037 1.00 36.51 H new ATOM 0 HB3 ALA A 386 100.418 57.783 20.202 1.00 36.51 H new ATOM 719 N ASP A 387 103.326 57.901 20.103 1.00 39.60 N ATOM 720 CA ASP A 387 104.531 58.692 20.427 1.00 40.00 C ATOM 721 C ASP A 387 105.774 58.198 19.698 1.00 37.25 C ATOM 722 O ASP A 387 106.530 59.003 19.155 1.00 39.38 O ATOM 723 CB ASP A 387 104.825 58.707 21.930 1.00 40.98 C ATOM 724 CG ASP A 387 103.801 59.487 22.751 1.00 44.05 C ATOM 725 OD1 ASP A 387 102.971 60.236 22.197 1.00 45.86 O ATOM 726 OD2 ASP A 387 103.844 59.360 23.996 1.00 49.45 O ATOM 0 H ASP A 387 102.995 57.474 20.772 1.00 39.60 H new ATOM 0 HA ASP A 387 104.327 59.592 20.127 1.00 40.00 H new ATOM 0 HB2 ASP A 387 104.858 57.793 22.254 1.00 40.98 H new ATOM 0 HB3 ASP A 387 105.704 59.091 22.075 1.00 40.98 H new ATOM 727 N ALA A 388 105.983 56.893 19.723 1.00 36.17 N ATOM 728 CA ALA A 388 107.072 56.240 18.992 1.00 39.54 C ATOM 729 C ALA A 388 107.008 56.557 17.497 1.00 42.19 C ATOM 730 O ALA A 388 108.026 56.902 16.895 1.00 44.01 O ATOM 731 CB ALA A 388 107.011 54.733 19.200 1.00 39.91 C ATOM 0 H ALA A 388 105.492 56.347 20.170 1.00 36.17 H new ATOM 0 HA ALA A 388 107.910 56.582 19.339 1.00 39.54 H new ATOM 0 HB1 ALA A 388 107.735 54.309 18.713 1.00 39.91 H new ATOM 0 HB2 ALA A 388 107.097 54.533 20.145 1.00 39.91 H new ATOM 0 HB3 ALA A 388 106.162 54.395 18.875 1.00 39.91 H new ATOM 732 N PHE A 389 105.812 56.471 16.910 1.00 40.97 N ATOM 733 CA PHE A 389 105.630 56.790 15.500 1.00 39.42 C ATOM 734 C PHE A 389 106.106 58.192 15.167 1.00 40.14 C ATOM 735 O PHE A 389 106.909 58.372 14.245 1.00 41.86 O ATOM 736 CB PHE A 389 104.162 56.625 15.055 1.00 41.61 C ATOM 737 CG PHE A 389 103.906 57.129 13.669 1.00 38.60 C ATOM 738 CD1 PHE A 389 104.153 56.319 12.574 1.00 37.84 C ATOM 739 CD2 PHE A 389 103.484 58.439 13.458 1.00 37.50 C ATOM 740 CE1 PHE A 389 103.952 56.792 11.287 1.00 37.87 C ATOM 741 CE2 PHE A 389 103.277 58.917 12.180 1.00 37.76 C ATOM 742 CZ PHE A 389 103.516 58.086 11.088 1.00 39.16 C ATOM 0 H PHE A 389 105.094 56.229 17.316 1.00 40.97 H new ATOM 0 HA PHE A 389 106.175 56.154 15.011 1.00 39.42 H new ATOM 0 HB2 PHE A 389 103.919 55.687 15.102 1.00 41.61 H new ATOM 0 HB3 PHE A 389 103.587 57.098 15.676 1.00 41.61 H new ATOM 0 HD1 PHE A 389 104.457 55.449 12.703 1.00 37.84 H new ATOM 0 HD2 PHE A 389 103.340 58.998 14.187 1.00 37.50 H new ATOM 0 HE1 PHE A 389 104.111 56.237 10.558 1.00 37.87 H new ATOM 0 HE2 PHE A 389 102.980 59.788 12.049 1.00 37.76 H new ATOM 0 HZ PHE A 389 103.382 58.403 10.224 1.00 39.16 H new ATOM 743 N LYS A 390 105.614 59.187 15.903 1.00 36.96 N ATOM 744 CA LYS A 390 105.956 60.566 15.596 1.00 36.83 C ATOM 745 C LYS A 390 107.414 60.847 15.891 1.00 40.22 C ATOM 746 O LYS A 390 108.085 61.598 15.149 1.00 39.25 O ATOM 747 CB LYS A 390 105.093 61.529 16.379 1.00 35.47 C ATOM 748 CG LYS A 390 105.377 63.010 16.163 1.00 34.69 C ATOM 749 CD LYS A 390 104.398 63.904 16.913 1.00 36.21 C ATOM 750 CE LYS A 390 104.835 65.340 16.852 1.00 35.64 C ATOM 751 NZ LYS A 390 103.818 66.328 17.277 1.00 36.87 N ATOM 0 H LYS A 390 105.088 59.084 16.575 1.00 36.96 H new ATOM 0 HA LYS A 390 105.795 60.695 14.648 1.00 36.83 H new ATOM 0 HB2 LYS A 390 104.165 61.360 16.154 1.00 35.47 H new ATOM 0 HB3 LYS A 390 105.196 61.333 17.323 1.00 35.47 H new ATOM 0 HG2 LYS A 390 106.281 63.209 16.453 1.00 34.69 H new ATOM 0 HG3 LYS A 390 105.333 63.210 15.215 1.00 34.69 H new ATOM 0 HD2 LYS A 390 103.512 63.814 16.529 1.00 36.21 H new ATOM 0 HD3 LYS A 390 104.336 63.619 17.838 1.00 36.21 H new ATOM 0 HE2 LYS A 390 105.622 65.447 17.409 1.00 35.64 H new ATOM 0 HE3 LYS A 390 105.102 65.543 15.942 1.00 35.64 H new ATOM 0 HZ1 LYS A 390 104.019 67.126 16.938 1.00 36.87 H new ATOM 0 HZ2 LYS A 390 103.017 66.075 16.983 1.00 36.87 H new ATOM 0 HZ3 LYS A 390 103.806 66.378 18.166 1.00 36.87 H new ATOM 752 N SER A 391 107.887 60.270 16.985 1.00 40.53 N ATOM 753 CA SER A 391 109.267 60.472 17.406 1.00 46.63 C ATOM 754 C SER A 391 110.257 59.922 16.373 1.00 43.06 C ATOM 755 O SER A 391 111.248 60.566 16.080 1.00 43.89 O ATOM 756 CB SER A 391 109.523 59.821 18.761 1.00 47.57 C ATOM 757 OG SER A 391 110.807 60.194 19.186 1.00 57.28 O ATOM 0 H SER A 391 107.426 59.757 17.499 1.00 40.53 H new ATOM 0 HA SER A 391 109.405 61.429 17.483 1.00 46.63 H new ATOM 0 HB2 SER A 391 108.856 60.106 19.405 1.00 47.57 H new ATOM 0 HB3 SER A 391 109.456 58.856 18.692 1.00 47.57 H new ATOM 0 HG SER A 391 110.948 60.996 18.982 1.00 57.28 H new ATOM 758 N ASP A 392 109.965 58.748 15.829 1.00 40.46 N ATOM 759 CA ASP A 392 110.760 58.161 14.747 1.00 44.63 C ATOM 760 C ASP A 392 110.610 58.829 13.406 1.00 44.91 C ATOM 761 O ASP A 392 111.565 58.849 12.646 1.00 44.99 O ATOM 762 CB ASP A 392 110.420 56.687 14.550 1.00 46.40 C ATOM 763 CG ASP A 392 110.771 55.862 15.747 1.00 50.29 C ATOM 764 OD1 ASP A 392 111.516 56.369 16.622 1.00 53.67 O ATOM 765 OD2 ASP A 392 110.284 54.722 15.824 1.00 50.64 O ATOM 0 H ASP A 392 109.298 58.264 16.075 1.00 40.46 H new ATOM 0 HA ASP A 392 111.674 58.290 15.044 1.00 44.63 H new ATOM 0 HB2 ASP A 392 109.472 56.597 14.364 1.00 46.40 H new ATOM 0 HB3 ASP A 392 110.895 56.348 13.775 1.00 46.40 H new ATOM 766 N TYR A 393 109.418 59.323 13.097 1.00 40.64 N ATOM 767 CA TYR A 393 109.189 60.018 11.858 1.00 37.87 C ATOM 768 C TYR A 393 110.053 61.255 11.741 1.00 38.16 C ATOM 769 O TYR A 393 110.555 61.556 10.669 1.00 35.74 O ATOM 770 CB TYR A 393 107.716 60.453 11.728 1.00 38.61 C ATOM 771 CG TYR A 393 107.305 60.803 10.329 1.00 34.94 C ATOM 772 CD1 TYR A 393 107.467 62.078 9.841 1.00 34.82 C ATOM 773 CD2 TYR A 393 106.742 59.843 9.488 1.00 36.20 C ATOM 774 CE1 TYR A 393 107.085 62.405 8.542 1.00 34.66 C ATOM 775 CE2 TYR A 393 106.352 60.155 8.189 1.00 34.96 C ATOM 776 CZ TYR A 393 106.516 61.442 7.723 1.00 35.48 C ATOM 777 OH TYR A 393 106.123 61.763 6.431 1.00 35.40 O ATOM 0 H TYR A 393 108.726 59.261 13.604 1.00 40.64 H new ATOM 0 HA TYR A 393 109.417 59.395 11.151 1.00 37.87 H new ATOM 0 HB2 TYR A 393 107.147 59.738 12.053 1.00 38.61 H new ATOM 0 HB3 TYR A 393 107.563 61.220 12.302 1.00 38.61 H new ATOM 0 HD1 TYR A 393 107.838 62.733 10.387 1.00 34.82 H new ATOM 0 HD2 TYR A 393 106.625 58.976 9.802 1.00 36.20 H new ATOM 0 HE1 TYR A 393 107.212 63.270 8.224 1.00 34.66 H new ATOM 0 HE2 TYR A 393 105.984 59.501 7.640 1.00 34.96 H new ATOM 0 HH TYR A 393 106.094 62.598 6.346 1.00 35.40 H new ATOM 778 N PHE A 394 110.168 62.013 12.819 1.00 35.64 N ATOM 779 CA PHE A 394 110.885 63.256 12.771 1.00 37.27 C ATOM 780 C PHE A 394 112.281 63.175 13.391 1.00 36.81 C ATOM 781 O PHE A 394 113.023 64.153 13.322 1.00 37.48 O ATOM 782 CB PHE A 394 110.076 64.344 13.466 1.00 38.03 C ATOM 783 CG PHE A 394 108.860 64.783 12.695 1.00 39.39 C ATOM 784 CD1 PHE A 394 108.975 65.706 11.661 1.00 40.87 C ATOM 785 CD2 PHE A 394 107.600 64.282 13.011 1.00 39.91 C ATOM 786 CE1 PHE A 394 107.857 66.129 10.943 1.00 42.62 C ATOM 787 CE2 PHE A 394 106.472 64.697 12.301 1.00 41.13 C ATOM 788 CZ PHE A 394 106.602 65.624 11.264 1.00 40.69 C ATOM 0 H PHE A 394 109.834 61.818 13.587 1.00 35.64 H new ATOM 0 HA PHE A 394 111.008 63.470 11.833 1.00 37.27 H new ATOM 0 HB2 PHE A 394 109.797 64.021 14.337 1.00 38.03 H new ATOM 0 HB3 PHE A 394 110.647 65.113 13.618 1.00 38.03 H new ATOM 0 HD1 PHE A 394 109.813 66.047 11.445 1.00 40.87 H new ATOM 0 HD2 PHE A 394 107.509 63.665 13.701 1.00 39.91 H new ATOM 0 HE1 PHE A 394 107.950 66.746 10.253 1.00 42.62 H new ATOM 0 HE2 PHE A 394 105.634 64.356 12.518 1.00 41.13 H new ATOM 0 HZ PHE A 394 105.852 65.902 10.790 1.00 40.69 H new ATOM 789 N ASN A 395 112.611 62.046 14.007 1.00 35.25 N ATOM 790 CA ASN A 395 113.815 61.902 14.823 1.00 41.67 C ATOM 791 C ASN A 395 114.000 63.050 15.815 1.00 43.68 C ATOM 792 O ASN A 395 115.086 63.631 15.926 1.00 40.02 O ATOM 793 CB ASN A 395 115.071 61.752 13.939 1.00 42.11 C ATOM 794 CG ASN A 395 116.307 61.379 14.751 1.00 42.56 C ATOM 795 OD1 ASN A 395 116.227 60.559 15.660 1.00 41.94 O ATOM 796 ND2 ASN A 395 117.446 61.987 14.432 1.00 43.29 N ATOM 0 H ASN A 395 112.136 61.330 13.963 1.00 35.25 H new ATOM 0 HA ASN A 395 113.695 61.092 15.342 1.00 41.67 H new ATOM 0 HB2 ASN A 395 114.911 61.072 13.266 1.00 42.11 H new ATOM 0 HB3 ASN A 395 115.234 62.584 13.468 1.00 42.11 H new ATOM 0 HD21 ASN A 395 118.165 61.810 14.870 1.00 43.29 H new ATOM 0 HD22 ASN A 395 117.464 62.557 13.788 1.00 43.29 H new ATOM 797 N MET A 396 112.917 63.372 16.515 1.00 47.31 N ATOM 798 CA MET A 396 112.894 64.404 17.540 1.00 49.77 C ATOM 799 C MET A 396 111.967 63.949 18.658 1.00 51.26 C ATOM 800 O MET A 396 111.128 63.087 18.432 1.00 50.37 O ATOM 801 CB MET A 396 112.334 65.691 16.968 1.00 54.49 C ATOM 802 CG MET A 396 113.360 66.606 16.339 1.00 62.54 C ATOM 803 SD MET A 396 112.520 68.159 15.981 1.00 73.30 S ATOM 804 CE MET A 396 111.544 67.675 14.571 1.00 70.22 C ATOM 0 H MET A 396 112.157 62.985 16.403 1.00 47.31 H new ATOM 0 HA MET A 396 113.796 64.553 17.865 1.00 49.77 H new ATOM 0 HB2 MET A 396 111.665 65.469 16.301 1.00 54.49 H new ATOM 0 HB3 MET A 396 111.880 66.174 17.676 1.00 54.49 H new ATOM 0 HG2 MET A 396 114.108 66.750 16.940 1.00 62.54 H new ATOM 0 HG3 MET A 396 113.719 66.214 15.528 1.00 62.54 H new ATOM 0 HE1 MET A 396 111.085 68.451 14.213 1.00 70.22 H new ATOM 0 HE2 MET A 396 112.123 67.300 13.890 1.00 70.22 H new ATOM 0 HE3 MET A 396 110.891 67.010 14.842 1.00 70.22 H new ATOM 805 N PRO A 397 112.107 64.534 19.861 1.00 52.39 N ATOM 806 CA PRO A 397 111.035 64.430 20.884 1.00 54.89 C ATOM 807 C PRO A 397 109.749 65.160 20.458 1.00 53.81 C ATOM 808 O PRO A 397 109.833 66.214 19.818 1.00 54.69 O ATOM 809 CB PRO A 397 111.657 65.104 22.127 1.00 51.16 C ATOM 810 CG PRO A 397 113.130 65.096 21.875 1.00 51.36 C ATOM 811 CD PRO A 397 113.294 65.232 20.388 1.00 51.10 C ATOM 0 HA PRO A 397 110.764 63.511 21.035 1.00 54.89 H new ATOM 0 HB2 PRO A 397 111.325 66.008 22.239 1.00 51.16 H new ATOM 0 HB3 PRO A 397 111.437 64.618 22.937 1.00 51.16 H new ATOM 0 HG2 PRO A 397 113.566 65.826 22.341 1.00 51.36 H new ATOM 0 HG3 PRO A 397 113.533 64.274 22.195 1.00 51.36 H new ATOM 0 HD2 PRO A 397 113.316 66.162 20.112 1.00 51.10 H new ATOM 0 HD3 PRO A 397 114.118 64.824 20.078 1.00 51.10 H new ATOM 812 N VAL A 398 108.581 64.635 20.844 1.00 59.37 N ATOM 813 CA VAL A 398 107.275 65.080 20.279 1.00 56.19 C ATOM 814 C VAL A 398 106.913 66.580 20.419 1.00 58.69 C ATOM 815 O VAL A 398 106.379 67.195 19.469 1.00 54.57 O ATOM 816 CB VAL A 398 106.100 64.232 20.795 1.00 63.04 C ATOM 817 CG1 VAL A 398 106.259 62.754 20.397 1.00 63.85 C ATOM 818 CG2 VAL A 398 105.898 64.415 22.313 1.00 69.17 C ATOM 0 H VAL A 398 108.512 64.015 21.436 1.00 59.37 H new ATOM 0 HA VAL A 398 107.418 64.940 19.330 1.00 56.19 H new ATOM 0 HB VAL A 398 105.291 64.551 20.366 1.00 63.04 H new ATOM 0 HG11 VAL A 398 105.506 62.245 20.735 1.00 63.85 H new ATOM 0 HG12 VAL A 398 106.291 62.681 19.430 1.00 63.85 H new ATOM 0 HG13 VAL A 398 107.081 62.404 20.775 1.00 63.85 H new ATOM 0 HG21 VAL A 398 105.152 63.870 22.608 1.00 69.17 H new ATOM 0 HG22 VAL A 398 106.703 64.143 22.782 1.00 69.17 H new ATOM 0 HG23 VAL A 398 105.712 65.347 22.505 1.00 69.17 H new ATOM 819 N HIS A 399 107.192 67.157 21.583 1.00 51.10 N ATOM 820 CA HIS A 399 106.872 68.559 21.870 1.00 52.19 C ATOM 821 C HIS A 399 107.763 69.545 21.191 1.00 58.56 C ATOM 822 O HIS A 399 107.519 70.764 21.258 1.00 56.14 O ATOM 823 CB HIS A 399 107.027 68.863 23.354 1.00 65.23 C ATOM 824 CG HIS A 399 105.828 68.534 24.162 1.00 73.40 C ATOM 825 ND1 HIS A 399 105.889 68.351 25.528 1.00 78.51 N ATOM 826 CD2 HIS A 399 104.537 68.353 23.807 1.00 76.57 C ATOM 827 CE1 HIS A 399 104.684 68.076 25.981 1.00 66.83 C ATOM 828 NE2 HIS A 399 103.850 68.065 24.955 1.00 85.90 N ATOM 0 H HIS A 399 107.575 66.747 22.235 1.00 51.10 H new ATOM 0 HA HIS A 399 105.962 68.654 21.549 1.00 52.19 H new ATOM 0 HB2 HIS A 399 107.785 68.367 23.700 1.00 65.23 H new ATOM 0 HB3 HIS A 399 107.231 69.805 23.463 1.00 65.23 H new ATOM 0 HD2 HIS A 399 104.184 68.413 22.949 1.00 76.57 H new ATOM 0 HE1 HIS A 399 104.458 67.917 26.869 1.00 66.83 H new ATOM 0 HE2 HIS A 399 103.007 67.902 25.002 1.00 85.90 H new ATOM 829 N MET A 400 108.843 69.035 20.615 1.00 55.39 N ATOM 830 CA MET A 400 109.761 69.861 19.910 1.00 54.89 C ATOM 831 C MET A 400 109.361 69.993 18.461 1.00 49.21 C ATOM 832 O MET A 400 109.796 70.946 17.809 1.00 56.06 O ATOM 833 CB MET A 400 111.147 69.280 20.049 1.00 58.75 C ATOM 834 CG MET A 400 111.521 69.124 21.512 1.00 64.06 C ATOM 835 SD MET A 400 113.292 69.028 21.746 1.00 64.05 S ATOM 836 CE MET A 400 113.814 70.538 20.926 1.00 59.64 C ATOM 0 H MET A 400 109.050 68.201 20.630 1.00 55.39 H new ATOM 0 HA MET A 400 109.753 70.754 20.289 1.00 54.89 H new ATOM 0 HB2 MET A 400 111.187 68.418 19.607 1.00 58.75 H new ATOM 0 HB3 MET A 400 111.790 69.856 19.606 1.00 58.75 H new ATOM 0 HG2 MET A 400 111.169 69.874 22.016 1.00 64.06 H new ATOM 0 HG3 MET A 400 111.105 68.323 21.868 1.00 64.06 H new ATOM 0 HE1 MET A 400 114.596 70.897 21.375 1.00 59.64 H new ATOM 0 HE2 MET A 400 114.033 70.345 20.001 1.00 59.64 H new ATOM 0 HE3 MET A 400 113.096 71.189 20.959 1.00 59.64 H new ATOM 837 N VAL A 401 108.505 69.094 17.965 1.00 44.49 N ATOM 838 CA VAL A 401 108.109 69.150 16.548 1.00 41.28 C ATOM 839 C VAL A 401 107.132 70.299 16.335 1.00 39.80 C ATOM 840 O VAL A 401 106.008 70.234 16.806 1.00 40.48 O ATOM 841 CB VAL A 401 107.473 67.855 16.042 1.00 40.57 C ATOM 842 CG1 VAL A 401 107.314 67.923 14.518 1.00 39.09 C ATOM 843 CG2 VAL A 401 108.326 66.662 16.438 1.00 43.16 C ATOM 0 H VAL A 401 108.148 68.456 18.418 1.00 44.49 H new ATOM 0 HA VAL A 401 108.924 69.285 16.040 1.00 41.28 H new ATOM 0 HB VAL A 401 106.597 67.749 16.445 1.00 40.57 H new ATOM 0 HG11 VAL A 401 106.910 67.101 14.198 1.00 39.09 H new ATOM 0 HG12 VAL A 401 106.746 68.674 14.285 1.00 39.09 H new ATOM 0 HG13 VAL A 401 108.185 68.037 14.106 1.00 39.09 H new ATOM 0 HG21 VAL A 401 107.914 65.847 16.112 1.00 43.16 H new ATOM 0 HG22 VAL A 401 109.211 66.754 16.051 1.00 43.16 H new ATOM 0 HG23 VAL A 401 108.399 66.623 17.404 1.00 43.16 H new ATOM 844 N PRO A 402 107.544 71.332 15.606 1.00 38.81 N ATOM 845 CA PRO A 402 106.637 72.457 15.405 1.00 39.34 C ATOM 846 C PRO A 402 105.359 72.118 14.620 1.00 40.32 C ATOM 847 O PRO A 402 105.387 71.311 13.688 1.00 37.06 O ATOM 848 CB PRO A 402 107.489 73.474 14.607 1.00 40.20 C ATOM 849 CG PRO A 402 108.917 73.025 14.783 1.00 40.68 C ATOM 850 CD PRO A 402 108.840 71.540 14.922 1.00 40.76 C ATOM 0 HA PRO A 402 106.309 72.779 16.259 1.00 39.34 H new ATOM 0 HB2 PRO A 402 107.238 73.482 13.670 1.00 40.20 H new ATOM 0 HB3 PRO A 402 107.362 74.375 14.942 1.00 40.20 H new ATOM 0 HG2 PRO A 402 109.462 73.279 14.021 1.00 40.68 H new ATOM 0 HG3 PRO A 402 109.319 73.431 15.567 1.00 40.68 H new ATOM 0 HD2 PRO A 402 108.865 71.097 14.059 1.00 40.76 H new ATOM 0 HD3 PRO A 402 109.580 71.190 15.442 1.00 40.76 H new ATOM 851 N THR A 403 104.268 72.790 14.973 1.00 39.30 N ATOM 852 CA THR A 403 102.971 72.512 14.374 1.00 39.75 C ATOM 853 C THR A 403 102.943 72.894 12.891 1.00 36.83 C ATOM 854 O THR A 403 102.326 72.197 12.084 1.00 34.87 O ATOM 855 CB THR A 403 101.818 73.217 15.145 1.00 40.58 C ATOM 856 OG1 THR A 403 101.988 74.626 15.090 1.00 44.11 O ATOM 857 CG2 THR A 403 101.771 72.789 16.601 1.00 41.98 C ATOM 0 H THR A 403 104.260 73.416 15.563 1.00 39.30 H new ATOM 0 HA THR A 403 102.830 71.555 14.440 1.00 39.75 H new ATOM 0 HB THR A 403 100.986 72.959 14.719 1.00 40.58 H new ATOM 0 HG1 THR A 403 101.362 75.000 15.507 1.00 44.11 H new ATOM 0 HG21 THR A 403 101.043 73.247 17.050 1.00 41.98 H new ATOM 0 HG22 THR A 403 101.631 71.831 16.652 1.00 41.98 H new ATOM 0 HG23 THR A 403 102.610 73.016 17.032 1.00 41.98 H new ATOM 858 N GLU A 404 103.606 74.000 12.542 1.00 36.15 N ATOM 859 CA GLU A 404 103.772 74.414 11.146 1.00 38.47 C ATOM 860 C GLU A 404 104.501 73.358 10.303 1.00 38.96 C ATOM 861 O GLU A 404 104.210 73.188 9.110 1.00 40.36 O ATOM 862 CB GLU A 404 104.478 75.796 11.052 1.00 40.29 C ATOM 0 H GLU A 404 103.973 74.532 13.110 1.00 36.15 H new ATOM 0 HA GLU A 404 102.882 74.503 10.772 1.00 38.47 H new ATOM 863 N LEU A 405 105.432 72.636 10.915 1.00 39.64 N ATOM 864 CA LEU A 405 106.162 71.572 10.214 1.00 39.18 C ATOM 865 C LEU A 405 105.334 70.320 10.024 1.00 36.89 C ATOM 866 O LEU A 405 105.419 69.672 8.973 1.00 36.16 O ATOM 867 CB LEU A 405 107.446 71.179 10.961 1.00 40.12 C ATOM 868 CG LEU A 405 108.262 69.998 10.373 1.00 43.24 C ATOM 869 CD1 LEU A 405 108.703 70.303 8.944 1.00 44.84 C ATOM 870 CD2 LEU A 405 109.468 69.661 11.249 1.00 45.90 C ATOM 0 H LEU A 405 105.660 72.743 11.737 1.00 39.64 H new ATOM 0 HA LEU A 405 106.379 71.944 9.345 1.00 39.18 H new ATOM 0 HB2 LEU A 405 108.024 71.957 10.999 1.00 40.12 H new ATOM 0 HB3 LEU A 405 107.208 70.957 11.875 1.00 40.12 H new ATOM 0 HG LEU A 405 107.682 69.220 10.356 1.00 43.24 H new ATOM 0 HD11 LEU A 405 109.211 69.554 8.595 1.00 44.84 H new ATOM 0 HD12 LEU A 405 107.922 70.450 8.388 1.00 44.84 H new ATOM 0 HD13 LEU A 405 109.257 71.099 8.939 1.00 44.84 H new ATOM 0 HD21 LEU A 405 109.957 68.921 10.856 1.00 45.90 H new ATOM 0 HD22 LEU A 405 110.049 70.435 11.311 1.00 45.90 H new ATOM 0 HD23 LEU A 405 109.164 69.413 12.136 1.00 45.90 H new ATOM 871 N VAL A 406 104.618 69.901 11.062 1.00 34.98 N ATOM 872 CA VAL A 406 103.723 68.728 10.910 1.00 35.24 C ATOM 873 C VAL A 406 102.682 68.992 9.798 1.00 30.33 C ATOM 874 O VAL A 406 102.409 68.123 9.009 1.00 32.32 O ATOM 875 CB VAL A 406 103.025 68.353 12.231 1.00 37.27 C ATOM 876 CG1 VAL A 406 102.061 67.198 12.019 1.00 38.69 C ATOM 877 CG2 VAL A 406 104.055 67.939 13.282 1.00 39.15 C ATOM 0 H VAL A 406 104.625 70.260 11.843 1.00 34.98 H new ATOM 0 HA VAL A 406 104.274 67.971 10.656 1.00 35.24 H new ATOM 0 HB VAL A 406 102.537 69.133 12.538 1.00 37.27 H new ATOM 0 HG11 VAL A 406 101.632 66.976 12.860 1.00 38.69 H new ATOM 0 HG12 VAL A 406 101.387 67.454 11.370 1.00 38.69 H new ATOM 0 HG13 VAL A 406 102.548 66.426 11.692 1.00 38.69 H new ATOM 0 HG21 VAL A 406 103.600 67.706 14.107 1.00 39.15 H new ATOM 0 HG22 VAL A 406 104.555 67.172 12.961 1.00 39.15 H new ATOM 0 HG23 VAL A 406 104.664 68.676 13.446 1.00 39.15 H new ATOM 878 N GLU A 407 102.125 70.198 9.767 1.00 32.69 N ATOM 879 CA GLU A 407 101.166 70.633 8.737 1.00 34.58 C ATOM 880 C GLU A 407 101.763 70.612 7.330 1.00 36.75 C ATOM 881 O GLU A 407 101.167 70.044 6.411 1.00 34.58 O ATOM 882 CB GLU A 407 100.661 72.049 9.040 1.00 34.47 C ATOM 883 CG GLU A 407 99.594 72.527 8.060 1.00 34.87 C ATOM 884 CD GLU A 407 99.050 73.902 8.385 1.00 38.81 C ATOM 885 OE1 GLU A 407 99.882 74.818 8.558 1.00 40.83 O ATOM 886 OE2 GLU A 407 97.792 74.114 8.428 1.00 36.34 O ATOM 0 H GLU A 407 102.293 70.804 10.354 1.00 32.69 H new ATOM 0 HA GLU A 407 100.432 70.000 8.761 1.00 34.58 H new ATOM 0 HB2 GLU A 407 100.299 72.072 9.940 1.00 34.47 H new ATOM 0 HB3 GLU A 407 101.410 72.665 9.020 1.00 34.47 H new ATOM 0 HG2 GLU A 407 99.968 72.538 7.165 1.00 34.87 H new ATOM 0 HG3 GLU A 407 98.862 71.890 8.054 1.00 34.87 H new ATOM 887 N LYS A 408 102.935 71.236 7.169 1.00 36.61 N ATOM 888 CA LYS A 408 103.674 71.198 5.886 1.00 39.46 C ATOM 889 C LYS A 408 103.882 69.775 5.460 1.00 34.97 C ATOM 890 O LYS A 408 103.612 69.418 4.343 1.00 35.24 O ATOM 891 CB LYS A 408 105.062 71.868 5.996 1.00 47.47 C ATOM 892 CG LYS A 408 105.083 73.353 5.680 1.00 57.25 C ATOM 893 CD LYS A 408 106.416 74.039 6.028 1.00 66.03 C ATOM 894 CE LYS A 408 107.638 73.378 5.389 1.00 70.52 C ATOM 895 NZ LYS A 408 107.496 73.170 3.918 1.00 73.80 N ATOM 0 H LYS A 408 103.325 71.689 7.788 1.00 36.61 H new ATOM 0 HA LYS A 408 103.140 71.684 5.238 1.00 39.46 H new ATOM 0 HB2 LYS A 408 105.399 71.738 6.896 1.00 47.47 H new ATOM 0 HB3 LYS A 408 105.674 71.414 5.396 1.00 47.47 H new ATOM 0 HG2 LYS A 408 104.901 73.477 4.735 1.00 57.25 H new ATOM 0 HG3 LYS A 408 104.367 73.790 6.167 1.00 57.25 H new ATOM 0 HD2 LYS A 408 106.376 74.966 5.746 1.00 66.03 H new ATOM 0 HD3 LYS A 408 106.527 74.041 6.992 1.00 66.03 H new ATOM 0 HE2 LYS A 408 108.420 73.927 5.558 1.00 70.52 H new ATOM 0 HE3 LYS A 408 107.795 72.522 5.817 1.00 70.52 H new ATOM 0 HZ1 LYS A 408 108.263 72.865 3.586 1.00 73.80 H new ATOM 0 HZ2 LYS A 408 106.850 72.578 3.763 1.00 73.80 H new ATOM 0 HZ3 LYS A 408 107.290 73.943 3.527 1.00 73.80 H new ATOM 896 N GLU A 409 104.354 68.957 6.384 1.00 34.48 N ATOM 897 CA GLU A 409 104.664 67.576 6.097 1.00 35.34 C ATOM 898 C GLU A 409 103.469 66.707 5.827 1.00 35.91 C ATOM 899 O GLU A 409 103.563 65.773 5.024 1.00 34.26 O ATOM 900 CB GLU A 409 105.467 66.978 7.250 1.00 36.33 C ATOM 901 CG GLU A 409 105.788 65.507 7.127 1.00 37.90 C ATOM 902 CD GLU A 409 106.598 65.143 5.878 1.00 40.71 C ATOM 903 OE1 GLU A 409 107.031 66.052 5.143 1.00 40.56 O ATOM 904 OE2 GLU A 409 106.830 63.929 5.644 1.00 40.15 O ATOM 0 H GLU A 409 104.503 69.191 7.198 1.00 34.48 H new ATOM 0 HA GLU A 409 105.179 67.591 5.275 1.00 35.34 H new ATOM 0 HB2 GLU A 409 106.300 67.469 7.332 1.00 36.33 H new ATOM 0 HB3 GLU A 409 104.973 67.117 8.073 1.00 36.33 H new ATOM 0 HG2 GLU A 409 106.282 65.227 7.913 1.00 37.90 H new ATOM 0 HG3 GLU A 409 104.958 65.005 7.120 1.00 37.90 H new ATOM 905 N PHE A 410 102.356 66.977 6.511 1.00 35.69 N ATOM 906 CA PHE A 410 101.100 66.287 6.197 1.00 31.88 C ATOM 907 C PHE A 410 100.753 66.467 4.734 1.00 28.86 C ATOM 908 O PHE A 410 100.525 65.504 4.030 1.00 33.15 O ATOM 909 CB PHE A 410 99.923 66.784 7.074 1.00 32.74 C ATOM 910 CG PHE A 410 98.626 66.075 6.791 1.00 32.16 C ATOM 911 CD1 PHE A 410 98.409 64.782 7.265 1.00 32.64 C ATOM 912 CD2 PHE A 410 97.641 66.681 6.029 1.00 32.73 C ATOM 913 CE1 PHE A 410 97.228 64.115 6.994 1.00 31.88 C ATOM 914 CE2 PHE A 410 96.451 66.028 5.768 1.00 32.46 C ATOM 915 CZ PHE A 410 96.244 64.739 6.240 1.00 30.84 C ATOM 0 H PHE A 410 102.305 67.548 7.152 1.00 35.69 H new ATOM 0 HA PHE A 410 101.237 65.346 6.389 1.00 31.88 H new ATOM 0 HB2 PHE A 410 100.152 66.664 8.009 1.00 32.74 H new ATOM 0 HB3 PHE A 410 99.801 67.736 6.931 1.00 32.74 H new ATOM 0 HD1 PHE A 410 99.067 64.362 7.770 1.00 32.64 H new ATOM 0 HD2 PHE A 410 97.782 67.535 5.690 1.00 32.73 H new ATOM 0 HE1 PHE A 410 97.094 63.253 7.315 1.00 31.88 H new ATOM 0 HE2 PHE A 410 95.787 66.453 5.275 1.00 32.46 H new ATOM 0 HZ PHE A 410 95.449 64.295 6.052 1.00 30.84 H new ATOM 916 N TRP A 411 100.726 67.700 4.273 1.00 32.12 N ATOM 917 CA TRP A 411 100.343 67.979 2.897 1.00 33.23 C ATOM 918 C TRP A 411 101.329 67.479 1.830 1.00 36.31 C ATOM 919 O TRP A 411 100.907 67.140 0.743 1.00 38.86 O ATOM 920 CB TRP A 411 100.001 69.446 2.736 1.00 34.47 C ATOM 921 CG TRP A 411 98.753 69.754 3.516 1.00 35.26 C ATOM 922 CD1 TRP A 411 98.640 70.553 4.606 1.00 35.74 C ATOM 923 CD2 TRP A 411 97.462 69.194 3.290 1.00 32.51 C ATOM 924 NE1 TRP A 411 97.350 70.533 5.076 1.00 36.02 N ATOM 925 CE2 TRP A 411 96.604 69.707 4.279 1.00 33.74 C ATOM 926 CE3 TRP A 411 96.945 68.314 2.340 1.00 33.60 C ATOM 927 CZ2 TRP A 411 95.241 69.370 4.345 1.00 33.05 C ATOM 928 CZ3 TRP A 411 95.578 67.972 2.410 1.00 33.76 C ATOM 929 CH2 TRP A 411 94.756 68.501 3.400 1.00 32.91 C ATOM 0 H TRP A 411 100.926 68.395 4.738 1.00 32.12 H new ATOM 0 HA TRP A 411 99.548 67.450 2.727 1.00 33.23 H new ATOM 0 HB2 TRP A 411 100.735 69.996 3.050 1.00 34.47 H new ATOM 0 HB3 TRP A 411 99.869 69.657 1.798 1.00 34.47 H new ATOM 0 HD1 TRP A 411 99.336 71.043 4.981 1.00 35.74 H new ATOM 0 HE1 TRP A 411 97.059 70.968 5.759 1.00 36.02 H new ATOM 0 HE3 TRP A 411 97.490 67.960 1.674 1.00 33.60 H new ATOM 0 HZ2 TRP A 411 94.688 69.723 5.005 1.00 33.05 H new ATOM 0 HZ3 TRP A 411 95.221 67.384 1.785 1.00 33.76 H new ATOM 0 HH2 TRP A 411 93.858 68.260 3.422 1.00 32.91 H new ATOM 930 N ARG A 412 102.616 67.390 2.152 1.00 39.10 N ATOM 931 CA ARG A 412 103.602 66.800 1.249 1.00 38.84 C ATOM 932 C ARG A 412 103.345 65.319 1.164 1.00 38.90 C ATOM 933 O ARG A 412 103.200 64.757 0.091 1.00 42.31 O ATOM 934 CB ARG A 412 105.029 67.061 1.765 1.00 42.17 C ATOM 935 CG ARG A 412 106.138 66.598 0.824 1.00 43.09 C ATOM 936 CD ARG A 412 107.472 66.527 1.546 1.00 46.29 C ATOM 937 NE ARG A 412 107.499 65.397 2.468 1.00 45.00 N ATOM 938 CZ ARG A 412 107.683 64.126 2.126 1.00 44.72 C ATOM 939 NH1 ARG A 412 107.908 63.774 0.858 1.00 45.78 N ATOM 940 NH2 ARG A 412 107.667 63.194 3.068 1.00 42.72 N ATOM 0 H ARG A 412 102.942 67.669 2.897 1.00 39.10 H new ATOM 0 HA ARG A 412 103.522 67.202 0.370 1.00 38.84 H new ATOM 0 HB2 ARG A 412 105.133 68.012 1.926 1.00 42.17 H new ATOM 0 HB3 ARG A 412 105.138 66.615 2.619 1.00 42.17 H new ATOM 0 HG2 ARG A 412 105.916 65.726 0.462 1.00 43.09 H new ATOM 0 HG3 ARG A 412 106.205 67.208 0.073 1.00 43.09 H new ATOM 0 HD2 ARG A 412 108.191 66.441 0.900 1.00 46.29 H new ATOM 0 HD3 ARG A 412 107.626 67.352 2.033 1.00 46.29 H new ATOM 0 HE ARG A 412 107.386 65.568 3.303 1.00 45.00 H new ATOM 0 HH11 ARG A 412 107.936 64.375 0.243 1.00 45.78 H new ATOM 0 HH12 ARG A 412 108.025 62.946 0.656 1.00 45.78 H new ATOM 0 HH21 ARG A 412 107.539 63.415 3.889 1.00 42.72 H new ATOM 0 HH22 ARG A 412 107.785 62.368 2.858 1.00 42.72 H new ATOM 941 N LEU A 413 103.273 64.697 2.325 1.00 38.85 N ATOM 942 CA LEU A 413 103.029 63.278 2.472 1.00 40.22 C ATOM 943 C LEU A 413 101.789 62.741 1.730 1.00 42.17 C ATOM 944 O LEU A 413 101.857 61.695 1.092 1.00 40.98 O ATOM 945 CB LEU A 413 102.889 63.011 3.962 1.00 48.73 C ATOM 946 CG LEU A 413 102.422 61.697 4.513 1.00 56.28 C ATOM 947 CD1 LEU A 413 103.320 60.609 3.945 1.00 62.85 C ATOM 948 CD2 LEU A 413 102.508 61.794 6.030 1.00 58.42 C ATOM 0 H LEU A 413 103.368 65.104 3.076 1.00 38.85 H new ATOM 0 HA LEU A 413 103.775 62.810 2.065 1.00 40.22 H new ATOM 0 HB2 LEU A 413 103.759 63.182 4.356 1.00 48.73 H new ATOM 0 HB3 LEU A 413 102.284 63.686 4.308 1.00 48.73 H new ATOM 0 HG LEU A 413 101.508 61.483 4.269 1.00 56.28 H new ATOM 0 HD11 LEU A 413 103.039 59.746 4.287 1.00 62.85 H new ATOM 0 HD12 LEU A 413 103.257 60.609 2.977 1.00 62.85 H new ATOM 0 HD13 LEU A 413 104.238 60.777 4.208 1.00 62.85 H new ATOM 0 HD21 LEU A 413 102.213 60.959 6.425 1.00 58.42 H new ATOM 0 HD22 LEU A 413 103.426 61.968 6.292 1.00 58.42 H new ATOM 0 HD23 LEU A 413 101.941 62.517 6.341 1.00 58.42 H new ATOM 949 N VAL A 414 100.656 63.437 1.832 1.00 38.63 N ATOM 950 CA VAL A 414 99.434 62.967 1.173 1.00 39.55 C ATOM 951 C VAL A 414 99.473 63.113 -0.365 1.00 40.94 C ATOM 952 O VAL A 414 98.733 62.418 -1.071 1.00 38.39 O ATOM 953 CB VAL A 414 98.142 63.620 1.737 1.00 37.67 C ATOM 954 CG1 VAL A 414 98.006 63.336 3.235 1.00 39.12 C ATOM 955 CG2 VAL A 414 98.061 65.112 1.436 1.00 38.48 C ATOM 0 H VAL A 414 100.573 64.172 2.270 1.00 38.63 H new ATOM 0 HA VAL A 414 99.403 62.020 1.380 1.00 39.55 H new ATOM 0 HB VAL A 414 97.389 63.213 1.281 1.00 37.67 H new ATOM 0 HG11 VAL A 414 97.196 63.750 3.571 1.00 39.12 H new ATOM 0 HG12 VAL A 414 97.963 62.378 3.380 1.00 39.12 H new ATOM 0 HG13 VAL A 414 98.773 63.700 3.704 1.00 39.12 H new ATOM 0 HG21 VAL A 414 97.240 65.473 1.807 1.00 38.48 H new ATOM 0 HG22 VAL A 414 98.821 65.564 1.834 1.00 38.48 H new ATOM 0 HG23 VAL A 414 98.070 65.250 0.476 1.00 38.48 H new ATOM 956 N SER A 415 100.305 64.030 -0.856 1.00 45.68 N ATOM 957 CA SER A 415 100.511 64.279 -2.293 1.00 50.44 C ATOM 958 C SER A 415 101.442 63.322 -3.014 1.00 55.39 C ATOM 959 O SER A 415 101.328 63.182 -4.224 1.00 56.63 O ATOM 960 CB SER A 415 101.120 65.657 -2.494 1.00 52.98 C ATOM 961 OG SER A 415 100.153 66.635 -2.264 1.00 63.57 O ATOM 0 H SER A 415 100.780 64.541 -0.353 1.00 45.68 H new ATOM 0 HA SER A 415 99.623 64.170 -2.667 1.00 50.44 H new ATOM 0 HB2 SER A 415 101.868 65.781 -1.890 1.00 52.98 H new ATOM 0 HB3 SER A 415 101.467 65.739 -3.396 1.00 52.98 H new ATOM 0 HG SER A 415 100.215 66.910 -1.473 1.00 63.57 H new ATOM 962 N THR A 416 102.388 62.720 -2.291 1.00 57.44 N ATOM 963 CA THR A 416 103.454 61.898 -2.891 1.00 62.01 C ATOM 964 C THR A 416 103.041 60.438 -2.914 1.00 66.73 C ATOM 965 O THR A 416 102.714 59.879 -1.867 1.00 67.27 O ATOM 966 CB THR A 416 104.768 62.027 -2.082 1.00 62.80 C ATOM 967 OG1 THR A 416 104.997 63.407 -1.741 1.00 55.32 O ATOM 968 CG2 THR A 416 105.967 61.496 -2.877 1.00 62.79 C ATOM 0 H THR A 416 102.433 62.775 -1.434 1.00 57.44 H new ATOM 0 HA THR A 416 103.599 62.216 -3.796 1.00 62.01 H new ATOM 0 HB THR A 416 104.675 61.496 -1.275 1.00 62.80 H new ATOM 0 HG1 THR A 416 104.472 63.635 -1.126 1.00 55.32 H new ATOM 0 HG21 THR A 416 106.774 61.589 -2.347 1.00 62.79 H new ATOM 0 HG22 THR A 416 105.826 60.560 -3.089 1.00 62.79 H new ATOM 0 HG23 THR A 416 106.060 62.002 -3.699 1.00 62.79 H new ATOM 969 N ILE A 417 103.087 59.804 -4.087 1.00 74.32 N ATOM 970 CA ILE A 417 102.590 58.408 -4.213 1.00 79.07 C ATOM 971 C ILE A 417 103.644 57.399 -3.740 1.00 79.62 C ATOM 972 O ILE A 417 103.299 56.276 -3.342 1.00 78.22 O ATOM 973 CB ILE A 417 102.102 57.970 -5.637 1.00 84.61 C ATOM 974 CG1 ILE A 417 102.076 59.115 -6.683 1.00 82.34 C ATOM 975 CG2 ILE A 417 100.750 57.245 -5.520 1.00 83.09 C ATOM 976 CD1 ILE A 417 101.071 60.227 -6.444 1.00 81.92 C ATOM 0 H ILE A 417 103.393 60.146 -4.814 1.00 74.32 H new ATOM 0 HA ILE A 417 101.805 58.406 -3.643 1.00 79.07 H new ATOM 0 HB ILE A 417 102.763 57.352 -5.988 1.00 84.61 H new ATOM 0 HG12 ILE A 417 102.961 59.509 -6.724 1.00 82.34 H new ATOM 0 HG13 ILE A 417 101.898 58.727 -7.554 1.00 82.34 H new ATOM 0 HG21 ILE A 417 100.450 56.975 -6.402 1.00 83.09 H new ATOM 0 HG22 ILE A 417 100.851 56.460 -4.959 1.00 83.09 H new ATOM 0 HG23 ILE A 417 100.095 57.842 -5.125 1.00 83.09 H new ATOM 0 HD11 ILE A 417 101.141 60.885 -7.154 1.00 81.92 H new ATOM 0 HD12 ILE A 417 100.175 59.857 -6.434 1.00 81.92 H new ATOM 0 HD13 ILE A 417 101.254 60.651 -5.591 1.00 81.92 H new ATOM 977 N GLU A 418 104.916 57.801 -3.797 1.00 80.33 N ATOM 978 CA GLU A 418 106.034 56.982 -3.313 1.00 85.84 C ATOM 979 C GLU A 418 105.962 56.832 -1.799 1.00 81.62 C ATOM 980 O GLU A 418 106.251 55.763 -1.265 1.00 85.16 O ATOM 981 CB GLU A 418 107.387 57.593 -3.693 1.00 95.50 C ATOM 982 CG GLU A 418 107.652 57.692 -5.191 1.00103.74 C ATOM 983 CD GLU A 418 107.227 59.027 -5.782 1.00112.29 C ATOM 984 OE1 GLU A 418 106.030 59.378 -5.667 1.00122.47 O ATOM 985 OE2 GLU A 418 108.086 59.729 -6.354 1.00121.37 O ATOM 0 H GLU A 418 105.157 58.561 -4.119 1.00 80.33 H new ATOM 0 HA GLU A 418 105.959 56.112 -3.735 1.00 85.84 H new ATOM 0 HB2 GLU A 418 107.445 58.482 -3.309 1.00 95.50 H new ATOM 0 HB3 GLU A 418 108.091 57.063 -3.288 1.00 95.50 H new ATOM 0 HG2 GLU A 418 108.598 57.557 -5.357 1.00103.74 H new ATOM 0 HG3 GLU A 418 107.180 56.977 -5.646 1.00103.74 H new ATOM 986 N GLU A 419 105.578 57.914 -1.122 1.00 73.71 N ATOM 987 CA GLU A 419 105.225 57.868 0.299 1.00 72.14 C ATOM 988 C GLU A 419 103.930 57.074 0.458 1.00 65.49 C ATOM 989 O GLU A 419 102.947 57.360 -0.220 1.00 72.06 O ATOM 990 CB GLU A 419 105.001 59.279 0.847 1.00 71.50 C ATOM 991 CG GLU A 419 106.215 60.196 0.799 1.00 72.01 C ATOM 992 CD GLU A 419 107.213 59.932 1.902 1.00 70.38 C ATOM 993 OE1 GLU A 419 107.075 58.924 2.623 1.00 66.15 O ATOM 994 OE2 GLU A 419 108.135 60.762 2.049 1.00 69.41 O ATOM 0 H GLU A 419 105.515 58.696 -1.473 1.00 73.71 H new ATOM 0 HA GLU A 419 105.951 57.450 0.788 1.00 72.14 H new ATOM 0 HB2 GLU A 419 104.281 59.694 0.347 1.00 71.50 H new ATOM 0 HB3 GLU A 419 104.703 59.209 1.768 1.00 71.50 H new ATOM 0 HG2 GLU A 419 106.656 60.092 -0.059 1.00 72.01 H new ATOM 0 HG3 GLU A 419 105.918 61.118 0.855 1.00 72.01 H new ATOM 995 N ASP A 420 103.934 56.070 1.318 1.00 62.57 N ATOM 996 CA ASP A 420 102.715 55.310 1.629 1.00 67.80 C ATOM 997 C ASP A 420 102.651 55.065 3.137 1.00 63.40 C ATOM 998 O ASP A 420 102.707 53.943 3.628 1.00 63.81 O ATOM 999 CB ASP A 420 102.642 54.009 0.833 1.00 70.93 C ATOM 1000 CG ASP A 420 103.837 53.126 1.064 1.00 78.71 C ATOM 1001 OD1 ASP A 420 104.966 53.586 0.796 1.00 88.98 O ATOM 1002 OD2 ASP A 420 103.650 51.984 1.534 1.00 82.41 O ATOM 0 H ASP A 420 104.634 55.804 1.740 1.00 62.57 H new ATOM 0 HA ASP A 420 101.940 55.829 1.364 1.00 67.80 H new ATOM 0 HB2 ASP A 420 101.836 53.528 1.078 1.00 70.93 H new ATOM 0 HB3 ASP A 420 102.573 54.215 -0.112 1.00 70.93 H new ATOM 1003 N VAL A 421 102.528 56.174 3.848 1.00 58.90 N ATOM 1004 CA VAL A 421 102.415 56.193 5.294 1.00 56.40 C ATOM 1005 C VAL A 421 101.007 55.779 5.667 1.00 50.92 C ATOM 1006 O VAL A 421 100.052 56.359 5.162 1.00 50.67 O ATOM 1007 CB VAL A 421 102.714 57.612 5.835 1.00 54.35 C ATOM 1008 CG1 VAL A 421 102.436 57.721 7.331 1.00 53.46 C ATOM 1009 CG2 VAL A 421 104.168 57.966 5.530 1.00 55.84 C ATOM 0 H VAL A 421 102.507 56.957 3.493 1.00 58.90 H new ATOM 0 HA VAL A 421 103.057 55.579 5.685 1.00 56.40 H new ATOM 0 HB VAL A 421 102.123 58.241 5.393 1.00 54.35 H new ATOM 0 HG11 VAL A 421 102.634 58.621 7.632 1.00 53.46 H new ATOM 0 HG12 VAL A 421 101.502 57.522 7.502 1.00 53.46 H new ATOM 0 HG13 VAL A 421 102.994 57.089 7.811 1.00 53.46 H new ATOM 0 HG21 VAL A 421 104.362 58.855 5.867 1.00 55.84 H new ATOM 0 HG22 VAL A 421 104.754 57.323 5.958 1.00 55.84 H new ATOM 0 HG23 VAL A 421 104.312 57.945 4.571 1.00 55.84 H new ATOM 1010 N THR A 422 100.886 54.766 6.522 1.00 50.53 N ATOM 1011 CA THR A 422 99.603 54.408 7.133 1.00 49.21 C ATOM 1012 C THR A 422 99.636 54.736 8.632 1.00 43.43 C ATOM 1013 O THR A 422 100.659 54.591 9.282 1.00 45.46 O ATOM 1014 CB THR A 422 99.271 52.918 6.941 1.00 52.32 C ATOM 1015 OG1 THR A 422 100.314 52.133 7.512 1.00 57.98 O ATOM 1016 CG2 THR A 422 99.150 52.575 5.469 1.00 52.17 C ATOM 0 H THR A 422 101.543 54.267 6.765 1.00 50.53 H new ATOM 0 HA THR A 422 98.912 54.926 6.692 1.00 49.21 H new ATOM 0 HB THR A 422 98.424 52.731 7.375 1.00 52.32 H new ATOM 0 HG1 THR A 422 100.138 51.318 7.412 1.00 57.98 H new ATOM 0 HG21 THR A 422 98.941 51.633 5.372 1.00 52.17 H new ATOM 0 HG22 THR A 422 98.443 53.105 5.070 1.00 52.17 H new ATOM 0 HG23 THR A 422 99.989 52.767 5.022 1.00 52.17 H new ATOM 1017 N VAL A 423 98.520 55.213 9.157 1.00 41.83 N ATOM 1018 CA VAL A 423 98.390 55.545 10.580 1.00 41.48 C ATOM 1019 C VAL A 423 97.111 54.883 11.072 1.00 44.29 C ATOM 1020 O VAL A 423 96.379 54.277 10.283 1.00 42.99 O ATOM 1021 CB VAL A 423 98.378 57.077 10.839 1.00 37.50 C ATOM 1022 CG1 VAL A 423 99.744 57.696 10.562 1.00 36.98 C ATOM 1023 CG2 VAL A 423 97.314 57.807 10.023 1.00 38.73 C ATOM 0 H VAL A 423 97.806 55.357 8.700 1.00 41.83 H new ATOM 0 HA VAL A 423 99.161 55.215 11.067 1.00 41.48 H new ATOM 0 HB VAL A 423 98.158 57.185 11.778 1.00 37.50 H new ATOM 0 HG11 VAL A 423 99.707 58.650 10.731 1.00 36.98 H new ATOM 0 HG12 VAL A 423 100.407 57.290 11.142 1.00 36.98 H new ATOM 0 HG13 VAL A 423 99.988 57.542 9.636 1.00 36.98 H new ATOM 0 HG21 VAL A 423 97.349 58.756 10.221 1.00 38.73 H new ATOM 0 HG22 VAL A 423 97.479 57.668 9.077 1.00 38.73 H new ATOM 0 HG23 VAL A 423 96.437 57.461 10.252 1.00 38.73 H new ATOM 1024 N GLU A 424 96.862 54.984 12.371 1.00 42.15 N ATOM 1025 CA GLU A 424 95.688 54.394 12.996 1.00 40.16 C ATOM 1026 C GLU A 424 95.055 55.419 13.870 1.00 41.73 C ATOM 1027 O GLU A 424 95.711 56.361 14.301 1.00 41.18 O ATOM 1028 CB GLU A 424 96.075 53.210 13.859 1.00 40.64 C ATOM 1029 CG GLU A 424 96.743 52.100 13.087 1.00 45.30 C ATOM 1030 CD GLU A 424 97.154 50.945 13.969 1.00 45.69 C ATOM 1031 OE1 GLU A 424 98.210 51.030 14.621 1.00 52.53 O ATOM 1032 OE2 GLU A 424 96.421 49.950 14.008 1.00 49.45 O ATOM 0 H GLU A 424 97.376 55.402 12.920 1.00 42.15 H new ATOM 0 HA GLU A 424 95.080 54.095 12.302 1.00 40.16 H new ATOM 0 HB2 GLU A 424 96.672 53.512 14.561 1.00 40.64 H new ATOM 0 HB3 GLU A 424 95.281 52.861 14.293 1.00 40.64 H new ATOM 0 HG2 GLU A 424 96.138 51.779 12.400 1.00 45.30 H new ATOM 0 HG3 GLU A 424 97.526 52.451 12.634 1.00 45.30 H new ATOM 1033 N TYR A 425 93.777 55.242 14.151 1.00 43.72 N ATOM 1034 CA TYR A 425 93.092 56.094 15.106 1.00 45.36 C ATOM 1035 C TYR A 425 91.871 55.399 15.683 1.00 47.38 C ATOM 1036 O TYR A 425 91.480 54.320 15.223 1.00 51.61 O ATOM 1037 CB TYR A 425 92.687 57.394 14.435 1.00 49.20 C ATOM 1038 CG TYR A 425 91.694 57.178 13.346 1.00 52.69 C ATOM 1039 CD1 TYR A 425 92.101 56.838 12.066 1.00 54.41 C ATOM 1040 CD2 TYR A 425 90.322 57.263 13.611 1.00 57.80 C ATOM 1041 CE1 TYR A 425 91.168 56.607 11.063 1.00 55.10 C ATOM 1042 CE2 TYR A 425 89.382 57.049 12.617 1.00 56.32 C ATOM 1043 CZ TYR A 425 89.805 56.714 11.349 1.00 53.05 C ATOM 1044 OH TYR A 425 88.868 56.486 10.375 1.00 54.00 O ATOM 0 H TYR A 425 93.285 54.631 13.798 1.00 43.72 H new ATOM 0 HA TYR A 425 93.700 56.285 15.837 1.00 45.36 H new ATOM 0 HB2 TYR A 425 92.313 57.995 15.098 1.00 49.20 H new ATOM 0 HB3 TYR A 425 93.475 57.828 14.071 1.00 49.20 H new ATOM 0 HD1 TYR A 425 93.008 56.764 11.876 1.00 54.41 H new ATOM 0 HD2 TYR A 425 90.036 57.467 14.472 1.00 57.80 H new ATOM 0 HE1 TYR A 425 91.449 56.382 10.206 1.00 55.10 H new ATOM 0 HE2 TYR A 425 88.474 57.131 12.803 1.00 56.32 H new ATOM 0 HH TYR A 425 88.099 56.587 10.697 1.00 54.00 H new ATOM 1045 N GLY A 426 91.275 56.036 16.686 1.00 45.32 N ATOM 1046 CA GLY A 426 90.022 55.583 17.291 1.00 42.74 C ATOM 1047 C GLY A 426 88.895 56.547 16.999 1.00 44.72 C ATOM 1048 O GLY A 426 89.063 57.758 17.140 1.00 43.48 O ATOM 0 H GLY A 426 91.590 56.754 17.040 1.00 45.32 H new ATOM 0 HA2 GLY A 426 89.795 54.703 16.951 1.00 42.74 H new ATOM 0 HA3 GLY A 426 90.136 55.496 18.250 1.00 42.74 H new ATOM 1049 N ALA A 427 87.759 56.018 16.548 1.00 45.34 N ATOM 1050 CA ALA A 427 86.516 56.787 16.459 1.00 50.05 C ATOM 1051 C ALA A 427 85.341 55.876 16.825 1.00 52.89 C ATOM 1052 O ALA A 427 85.091 54.906 16.132 1.00 53.39 O ATOM 1053 CB ALA A 427 86.333 57.379 15.076 1.00 48.48 C ATOM 0 H ALA A 427 87.686 55.203 16.285 1.00 45.34 H new ATOM 0 HA ALA A 427 86.556 57.529 17.082 1.00 50.05 H new ATOM 0 HB1 ALA A 427 85.504 57.882 15.046 1.00 48.48 H new ATOM 0 HB2 ALA A 427 87.076 57.969 14.876 1.00 48.48 H new ATOM 0 HB3 ALA A 427 86.302 56.665 14.420 1.00 48.48 H new ATOM 1054 N ASP A 428 84.651 56.177 17.923 1.00 52.18 N ATOM 1055 CA ASP A 428 83.513 55.380 18.347 1.00 57.80 C ATOM 1056 C ASP A 428 82.653 56.137 19.346 1.00 55.37 C ATOM 1057 O ASP A 428 83.105 57.082 19.999 1.00 47.91 O ATOM 1058 CB ASP A 428 83.984 54.054 18.967 1.00 65.89 C ATOM 1059 CG ASP A 428 83.262 52.829 18.375 1.00 75.49 C ATOM 1060 OD1 ASP A 428 82.008 52.829 18.298 1.00 73.31 O ATOM 1061 OD2 ASP A 428 83.961 51.862 17.985 1.00 76.81 O ATOM 0 H ASP A 428 84.830 56.843 18.436 1.00 52.18 H new ATOM 0 HA ASP A 428 82.977 55.191 17.561 1.00 57.80 H new ATOM 0 HB2 ASP A 428 84.939 53.959 18.830 1.00 65.89 H new ATOM 0 HB3 ASP A 428 83.836 54.079 19.925 1.00 65.89 H new ATOM 1062 N ILE A 429 81.403 55.700 19.458 1.00 57.44 N ATOM 1063 CA ILE A 429 80.446 56.263 20.422 1.00 59.58 C ATOM 1064 C ILE A 429 80.798 55.728 21.805 1.00 50.96 C ATOM 1065 O ILE A 429 81.351 54.634 21.919 1.00 50.90 O ATOM 1066 CB ILE A 429 78.981 55.950 19.983 1.00 65.49 C ATOM 1067 CG1 ILE A 429 78.576 56.907 18.851 1.00 67.26 C ATOM 1068 CG2 ILE A 429 77.982 56.059 21.133 1.00 66.97 C ATOM 1069 CD1 ILE A 429 77.467 56.389 17.952 1.00 72.04 C ATOM 0 H ILE A 429 81.079 55.065 18.977 1.00 57.44 H new ATOM 0 HA ILE A 429 80.505 57.231 20.452 1.00 59.58 H new ATOM 0 HB ILE A 429 78.960 55.030 19.677 1.00 65.49 H new ATOM 0 HG12 ILE A 429 78.294 57.749 19.241 1.00 67.26 H new ATOM 0 HG13 ILE A 429 79.357 57.094 18.307 1.00 67.26 H new ATOM 0 HG21 ILE A 429 77.091 55.856 20.808 1.00 66.97 H new ATOM 0 HG22 ILE A 429 78.222 55.430 21.831 1.00 66.97 H new ATOM 0 HG23 ILE A 429 77.997 56.960 21.491 1.00 66.97 H new ATOM 0 HD11 ILE A 429 77.271 57.048 17.267 1.00 72.04 H new ATOM 0 HD12 ILE A 429 77.750 55.561 17.533 1.00 72.04 H new ATOM 0 HD13 ILE A 429 76.670 56.227 18.481 1.00 72.04 H new ATOM 1070 N ALA A 430 80.516 56.504 22.852 1.00 57.24 N ATOM 1071 CA ALA A 430 80.729 56.005 24.215 1.00 63.39 C ATOM 1072 C ALA A 430 79.884 54.752 24.465 1.00 68.44 C ATOM 1073 O ALA A 430 78.700 54.716 24.151 1.00 65.06 O ATOM 1074 CB ALA A 430 80.437 57.060 25.276 1.00 65.69 C ATOM 0 H ALA A 430 80.207 57.305 22.800 1.00 57.24 H new ATOM 0 HA ALA A 430 81.669 55.778 24.289 1.00 63.39 H new ATOM 0 HB1 ALA A 430 80.591 56.685 26.157 1.00 65.69 H new ATOM 0 HB2 ALA A 430 81.021 57.823 25.143 1.00 65.69 H new ATOM 0 HB3 ALA A 430 79.512 57.345 25.204 1.00 65.69 H new ATOM 1075 N SER A 431 80.555 53.714 24.949 1.00 76.39 N ATOM 1076 CA SER A 431 79.951 52.528 25.538 1.00 78.10 C ATOM 1077 C SER A 431 80.638 52.313 26.891 1.00 83.59 C ATOM 1078 O SER A 431 81.558 53.065 27.260 1.00 83.54 O ATOM 1079 CB SER A 431 80.224 51.332 24.634 1.00 73.02 C ATOM 1080 OG SER A 431 81.625 51.148 24.505 1.00 67.54 O ATOM 0 H SER A 431 81.414 53.681 24.942 1.00 76.39 H new ATOM 0 HA SER A 431 78.992 52.629 25.644 1.00 78.10 H new ATOM 0 HB2 SER A 431 79.816 50.534 25.005 1.00 73.02 H new ATOM 0 HB3 SER A 431 79.825 51.476 23.762 1.00 73.02 H new ATOM 0 HG SER A 431 81.777 50.488 24.008 1.00 67.54 H new ATOM 1081 N LYS A 432 80.235 51.261 27.602 1.00 89.40 N ATOM 1082 CA LYS A 432 80.892 50.867 28.857 1.00 89.65 C ATOM 1083 C LYS A 432 82.413 50.617 28.711 1.00 92.54 C ATOM 1084 O LYS A 432 83.145 50.718 29.698 1.00 87.13 O ATOM 1085 CB LYS A 432 80.198 49.640 29.463 1.00 87.37 C ATOM 0 H LYS A 432 79.577 50.756 27.375 1.00 89.40 H new ATOM 0 HA LYS A 432 80.801 51.622 29.459 1.00 89.65 H new ATOM 1086 N GLU A 433 82.878 50.311 27.493 1.00 97.29 N ATOM 1087 CA GLU A 433 84.322 50.195 27.188 1.00 99.65 C ATOM 1088 C GLU A 433 84.950 51.545 26.834 1.00 94.99 C ATOM 1089 O GLU A 433 86.102 51.792 27.201 1.00 90.13 O ATOM 1090 CB GLU A 433 84.591 49.222 26.028 1.00104.26 C ATOM 1091 CG GLU A 433 83.963 47.847 26.187 1.00112.07 C ATOM 1092 CD GLU A 433 82.568 47.766 25.589 1.00117.31 C ATOM 1093 OE1 GLU A 433 82.463 47.587 24.359 1.00125.76 O ATOM 1094 OE2 GLU A 433 81.578 47.913 26.343 1.00119.69 O ATOM 0 H GLU A 433 82.368 50.164 26.817 1.00 97.29 H new ATOM 0 HA GLU A 433 84.728 49.854 28.000 1.00 99.65 H new ATOM 0 HB2 GLU A 433 84.263 49.620 25.207 1.00104.26 H new ATOM 0 HB3 GLU A 433 85.550 49.116 25.928 1.00104.26 H new ATOM 0 HG2 GLU A 433 84.531 47.185 25.763 1.00112.07 H new ATOM 0 HG3 GLU A 433 83.920 47.622 27.130 1.00112.07 H new ATOM 1095 N PHE A 434 84.205 52.386 26.101 1.00 90.12 N ATOM 1096 CA PHE A 434 84.685 53.698 25.650 1.00 81.20 C ATOM 1097 C PHE A 434 84.506 54.773 26.738 1.00 76.97 C ATOM 1098 O PHE A 434 85.486 55.194 27.332 1.00 88.67 O ATOM 1099 CB PHE A 434 84.015 54.096 24.327 1.00 79.33 C ATOM 0 H PHE A 434 83.402 52.207 25.851 1.00 90.12 H new ATOM 0 HA PHE A 434 85.638 53.629 25.485 1.00 81.20 H new ATOM 1100 N GLY A 435 83.283 55.220 27.004 1.00 68.24 N ATOM 1101 CA GLY A 435 83.028 56.172 28.087 1.00 58.80 C ATOM 1102 C GLY A 435 83.385 57.628 27.784 1.00 56.48 C ATOM 1103 O GLY A 435 84.506 57.948 27.391 1.00 58.20 O ATOM 0 H GLY A 435 82.581 54.984 26.567 1.00 68.24 H new ATOM 0 HA2 GLY A 435 82.087 56.128 28.320 1.00 58.80 H new ATOM 0 HA3 GLY A 435 83.527 55.889 28.869 1.00 58.80 H new ATOM 1104 N SER A 436 82.428 58.520 27.997 1.00 51.27 N ATOM 1105 CA SER A 436 82.646 59.944 27.848 1.00 51.30 C ATOM 1106 C SER A 436 83.859 60.490 28.627 1.00 56.45 C ATOM 1107 O SER A 436 84.181 60.020 29.716 1.00 58.53 O ATOM 1108 CB SER A 436 81.419 60.678 28.312 1.00 46.69 C ATOM 1109 OG SER A 436 81.570 62.061 28.108 1.00 46.43 O ATOM 0 H SER A 436 81.628 58.311 28.234 1.00 51.27 H new ATOM 0 HA SER A 436 82.831 60.088 26.907 1.00 51.30 H new ATOM 0 HB2 SER A 436 80.641 60.357 27.830 1.00 46.69 H new ATOM 0 HB3 SER A 436 81.264 60.499 29.253 1.00 46.69 H new ATOM 0 HG SER A 436 81.628 62.218 27.285 1.00 46.43 H new ATOM 1110 N GLY A 437 84.533 61.472 28.043 1.00 51.42 N ATOM 1111 CA GLY A 437 85.599 62.181 28.723 1.00 51.84 C ATOM 1112 C GLY A 437 85.069 63.172 29.746 1.00 50.05 C ATOM 1113 O GLY A 437 85.808 63.596 30.629 1.00 51.07 O ATOM 0 H GLY A 437 84.383 61.744 27.241 1.00 51.42 H new ATOM 0 HA2 GLY A 437 86.180 61.542 29.165 1.00 51.84 H new ATOM 0 HA3 GLY A 437 86.140 62.651 28.070 1.00 51.84 H new ATOM 1114 N PHE A 438 83.806 63.578 29.596 1.00 49.72 N ATOM 1115 CA PHE A 438 83.141 64.412 30.577 1.00 47.89 C ATOM 1116 C PHE A 438 82.524 63.545 31.687 1.00 51.84 C ATOM 1117 O PHE A 438 82.241 62.373 31.467 1.00 54.62 O ATOM 1118 CB PHE A 438 82.067 65.257 29.931 1.00 46.35 C ATOM 1119 CG PHE A 438 82.589 66.290 28.986 1.00 45.35 C ATOM 1120 CD1 PHE A 438 83.137 67.469 29.464 1.00 43.45 C ATOM 1121 CD2 PHE A 438 82.528 66.082 27.612 1.00 43.08 C ATOM 1122 CE1 PHE A 438 83.607 68.428 28.593 1.00 43.97 C ATOM 1123 CE2 PHE A 438 83.000 67.035 26.735 1.00 40.34 C ATOM 1124 CZ PHE A 438 83.539 68.212 27.226 1.00 41.98 C ATOM 0 H PHE A 438 83.317 63.373 28.919 1.00 49.72 H new ATOM 0 HA PHE A 438 83.805 65.002 30.966 1.00 47.89 H new ATOM 0 HB2 PHE A 438 81.455 64.675 29.453 1.00 46.35 H new ATOM 0 HB3 PHE A 438 81.554 65.698 30.626 1.00 46.35 H new ATOM 0 HD1 PHE A 438 83.188 67.615 30.381 1.00 43.45 H new ATOM 0 HD2 PHE A 438 82.165 65.292 27.282 1.00 43.08 H new ATOM 0 HE1 PHE A 438 83.969 69.219 28.922 1.00 43.97 H new ATOM 0 HE2 PHE A 438 82.957 66.888 25.818 1.00 40.34 H new ATOM 0 HZ PHE A 438 83.856 68.859 26.637 1.00 41.98 H new ATOM 1125 N PRO A 439 82.339 64.121 32.891 1.00 54.37 N ATOM 1126 CA PRO A 439 81.699 63.373 33.971 1.00 58.07 C ATOM 1127 C PRO A 439 80.217 63.103 33.692 1.00 57.41 C ATOM 1128 O PRO A 439 79.520 63.967 33.127 1.00 56.18 O ATOM 1129 CB PRO A 439 81.857 64.296 35.190 1.00 58.65 C ATOM 1130 CG PRO A 439 82.035 65.659 34.634 1.00 57.78 C ATOM 1131 CD PRO A 439 82.724 65.483 33.314 1.00 54.31 C ATOM 0 HA PRO A 439 82.098 62.497 34.091 1.00 58.07 H new ATOM 0 HB2 PRO A 439 81.077 64.252 35.765 1.00 58.65 H new ATOM 0 HB3 PRO A 439 82.621 64.036 35.728 1.00 58.65 H new ATOM 0 HG2 PRO A 439 81.180 66.102 34.522 1.00 57.78 H new ATOM 0 HG3 PRO A 439 82.565 66.211 35.231 1.00 57.78 H new ATOM 0 HD2 PRO A 439 82.436 66.150 32.671 1.00 54.31 H new ATOM 0 HD3 PRO A 439 83.686 65.570 33.401 1.00 54.31 H new ATOM 1132 N VAL A 440 79.773 61.905 34.077 1.00 64.61 N ATOM 1133 CA VAL A 440 78.351 61.496 34.030 1.00 73.09 C ATOM 1134 C VAL A 440 77.936 60.780 35.331 1.00 75.79 C ATOM 1135 O VAL A 440 78.790 60.292 36.086 1.00 72.80 O ATOM 1136 CB VAL A 440 78.062 60.568 32.832 1.00 72.58 C ATOM 1137 CG1 VAL A 440 78.399 61.278 31.530 1.00 73.14 C ATOM 1138 CG2 VAL A 440 78.814 59.240 32.958 1.00 71.15 C ATOM 0 H VAL A 440 80.294 61.291 34.379 1.00 64.61 H new ATOM 0 HA VAL A 440 77.832 62.309 33.928 1.00 73.09 H new ATOM 0 HB VAL A 440 77.115 60.356 32.829 1.00 72.58 H new ATOM 0 HG11 VAL A 440 78.215 60.688 30.782 1.00 73.14 H new ATOM 0 HG12 VAL A 440 77.859 62.080 31.449 1.00 73.14 H new ATOM 0 HG13 VAL A 440 79.338 61.519 31.527 1.00 73.14 H new ATOM 0 HG21 VAL A 440 78.612 58.680 32.192 1.00 71.15 H new ATOM 0 HG22 VAL A 440 79.768 59.410 32.991 1.00 71.15 H new ATOM 0 HG23 VAL A 440 78.538 58.788 33.770 1.00 71.15 H new ATOM 1139 N ARG A 441 76.629 60.710 35.581 1.00 81.89 N ATOM 1140 CA ARG A 441 76.104 60.039 36.787 1.00 84.70 C ATOM 1141 C ARG A 441 76.213 58.508 36.673 1.00 87.46 C ATOM 1142 O ARG A 441 75.613 57.920 35.776 1.00 93.25 O ATOM 1143 CB ARG A 441 74.650 60.434 37.023 1.00 81.10 C ATOM 1144 CG ARG A 441 74.446 61.921 37.228 1.00 79.59 C ATOM 1145 CD ARG A 441 73.007 62.243 37.611 1.00 82.96 C ATOM 1146 NE ARG A 441 72.648 63.610 37.225 1.00 83.25 N ATOM 1147 CZ ARG A 441 73.062 64.721 37.838 1.00 81.27 C ATOM 1148 NH1 ARG A 441 73.857 64.664 38.907 1.00 82.57 N ATOM 1149 NH2 ARG A 441 72.675 65.909 37.377 1.00 77.35 N ATOM 0 H ARG A 441 76.024 61.043 35.068 1.00 81.89 H new ATOM 0 HA ARG A 441 76.643 60.327 37.540 1.00 84.70 H new ATOM 0 HB2 ARG A 441 74.118 60.144 36.265 1.00 81.10 H new ATOM 0 HB3 ARG A 441 74.317 59.960 37.801 1.00 81.10 H new ATOM 0 HG2 ARG A 441 75.045 62.238 37.922 1.00 79.59 H new ATOM 0 HG3 ARG A 441 74.679 62.395 36.415 1.00 79.59 H new ATOM 0 HD2 ARG A 441 72.407 61.615 37.180 1.00 82.96 H new ATOM 0 HD3 ARG A 441 72.892 62.134 38.568 1.00 82.96 H new ATOM 0 HE ARG A 441 72.127 63.704 36.547 1.00 83.25 H new ATOM 0 HH11 ARG A 441 74.112 63.902 39.213 1.00 82.57 H new ATOM 0 HH12 ARG A 441 74.115 65.389 39.290 1.00 82.57 H new ATOM 0 HH21 ARG A 441 72.162 65.957 36.689 1.00 77.35 H new ATOM 0 HH22 ARG A 441 72.938 66.628 37.768 1.00 77.35 H new ATOM 1150 N ASP A 442 76.984 57.877 37.564 1.00 91.92 N ATOM 1151 CA ASP A 442 77.156 56.408 37.567 1.00 94.75 C ATOM 1152 C ASP A 442 77.773 55.905 38.874 1.00 95.50 C ATOM 1153 O ASP A 442 77.198 56.072 39.950 1.00 96.66 O ATOM 1154 CB ASP A 442 78.023 55.953 36.383 1.00 90.54 C ATOM 0 H ASP A 442 77.422 58.282 38.183 1.00 91.92 H new ATOM 0 HA ASP A 442 76.269 56.024 37.482 1.00 94.75 H new ATOM 1155 N SER A 448 81.146 67.391 45.481 1.00 80.72 N ATOM 1156 CA SER A 448 81.585 68.777 45.652 1.00 80.99 C ATOM 1157 C SER A 448 80.842 69.738 44.697 1.00 84.73 C ATOM 1158 O SER A 448 80.296 69.277 43.695 1.00 84.80 O ATOM 1159 CB SER A 448 83.101 68.874 45.442 1.00 77.71 C ATOM 1160 OG SER A 448 83.474 68.533 44.119 1.00 78.00 O ATOM 0 HA SER A 448 81.369 69.049 46.558 1.00 80.99 H new ATOM 0 HB2 SER A 448 83.397 69.776 45.639 1.00 77.71 H new ATOM 0 HB3 SER A 448 83.552 68.285 46.067 1.00 77.71 H new ATOM 0 HG SER A 448 83.711 67.727 44.093 1.00 78.00 H new ATOM 1161 N PRO A 449 80.803 71.065 45.009 1.00 92.73 N ATOM 1162 CA PRO A 449 80.204 72.063 44.089 1.00 93.80 C ATOM 1163 C PRO A 449 80.826 72.142 42.681 1.00 95.12 C ATOM 1164 O PRO A 449 80.086 72.317 41.704 1.00 93.14 O ATOM 1165 CB PRO A 449 80.410 73.395 44.828 1.00 93.47 C ATOM 1166 CG PRO A 449 80.442 73.020 46.259 1.00 93.28 C ATOM 1167 CD PRO A 449 81.132 71.681 46.313 1.00 91.48 C ATOM 0 HA PRO A 449 79.282 71.823 43.906 1.00 93.80 H new ATOM 0 HB2 PRO A 449 81.236 73.826 44.557 1.00 93.47 H new ATOM 0 HB3 PRO A 449 79.690 74.018 44.642 1.00 93.47 H new ATOM 0 HG2 PRO A 449 80.922 73.681 46.782 1.00 93.28 H new ATOM 0 HG3 PRO A 449 79.545 72.965 46.625 1.00 93.28 H new ATOM 0 HD2 PRO A 449 82.090 71.778 46.430 1.00 91.48 H new ATOM 0 HD3 PRO A 449 80.809 71.143 47.053 1.00 91.48 H new ATOM 1168 N GLU A 450 82.158 72.025 42.590 1.00 93.49 N ATOM 1169 CA GLU A 450 82.875 72.046 41.300 1.00 91.38 C ATOM 1170 C GLU A 450 82.637 70.761 40.472 1.00 90.90 C ATOM 1171 O GLU A 450 82.179 70.845 39.327 1.00 80.29 O ATOM 1172 CB GLU A 450 84.383 72.292 41.507 1.00 83.48 C ATOM 0 H GLU A 450 82.672 71.931 43.273 1.00 93.49 H new ATOM 0 HA GLU A 450 82.510 72.786 40.790 1.00 91.38 H new ATOM 1173 N GLU A 451 82.910 69.586 41.056 1.00 88.43 N ATOM 1174 CA GLU A 451 82.820 68.296 40.325 1.00 84.67 C ATOM 1175 C GLU A 451 81.352 67.967 39.906 1.00 82.15 C ATOM 1176 O GLU A 451 81.105 67.324 38.865 1.00 74.86 O ATOM 1177 CB GLU A 451 83.470 67.158 41.149 1.00 84.49 C ATOM 1178 CG GLU A 451 82.515 66.360 42.041 1.00 83.94 C ATOM 1179 CD GLU A 451 83.215 65.537 43.106 1.00 82.04 C ATOM 1180 OE1 GLU A 451 83.933 64.571 42.767 1.00 82.65 O ATOM 1181 OE2 GLU A 451 83.042 65.862 44.294 1.00 82.37 O ATOM 0 H GLU A 451 83.151 69.508 41.878 1.00 88.43 H new ATOM 0 HA GLU A 451 83.322 68.380 39.499 1.00 84.67 H new ATOM 0 HB2 GLU A 451 83.904 66.544 40.536 1.00 84.49 H new ATOM 0 HB3 GLU A 451 84.165 67.541 41.707 1.00 84.49 H new ATOM 0 HG2 GLU A 451 81.899 66.974 42.471 1.00 83.94 H new ATOM 0 HG3 GLU A 451 81.984 65.769 41.485 1.00 83.94 H new ATOM 1182 N GLU A 452 80.399 68.420 40.729 1.00 71.37 N ATOM 1183 CA GLU A 452 78.984 68.409 40.376 1.00 66.25 C ATOM 1184 C GLU A 452 78.669 69.476 39.345 1.00 59.45 C ATOM 1185 O GLU A 452 77.819 69.240 38.507 1.00 58.95 O ATOM 1186 CB GLU A 452 78.072 68.597 41.604 1.00 63.39 C ATOM 0 H GLU A 452 80.561 68.742 41.510 1.00 71.37 H new ATOM 0 HA GLU A 452 78.805 67.534 39.999 1.00 66.25 H new ATOM 1187 N GLU A 453 79.307 70.650 39.406 1.00 64.23 N ATOM 1188 CA GLU A 453 79.093 71.693 38.360 1.00 72.31 C ATOM 1189 C GLU A 453 79.278 71.134 36.951 1.00 71.61 C ATOM 1190 O GLU A 453 78.418 71.341 36.078 1.00 83.51 O ATOM 1191 CB GLU A 453 79.947 72.973 38.579 1.00 80.33 C ATOM 1192 CG GLU A 453 80.648 73.605 37.352 1.00 90.04 C ATOM 1193 CD GLU A 453 79.725 74.049 36.205 1.00 95.51 C ATOM 1194 OE1 GLU A 453 78.509 74.235 36.429 1.00104.28 O ATOM 1195 OE2 GLU A 453 80.219 74.196 35.059 1.00 91.59 O ATOM 0 H GLU A 453 79.859 70.870 40.027 1.00 64.23 H new ATOM 0 HA GLU A 453 78.167 71.967 38.452 1.00 72.31 H new ATOM 0 HB2 GLU A 453 79.373 73.648 38.972 1.00 80.33 H new ATOM 0 HB3 GLU A 453 80.630 72.764 39.235 1.00 80.33 H new ATOM 0 HG2 GLU A 453 81.155 74.375 37.652 1.00 90.04 H new ATOM 0 HG3 GLU A 453 81.286 72.965 37.001 1.00 90.04 H new ATOM 1196 N TYR A 454 80.369 70.408 36.731 1.00 61.67 N ATOM 1197 CA TYR A 454 80.661 69.922 35.383 1.00 63.14 C ATOM 1198 C TYR A 454 79.632 68.906 34.893 1.00 64.57 C ATOM 1199 O TYR A 454 79.427 68.783 33.688 1.00 57.63 O ATOM 1200 CB TYR A 454 82.109 69.422 35.276 1.00 61.87 C ATOM 1201 CG TYR A 454 83.100 70.557 35.509 1.00 63.23 C ATOM 1202 CD1 TYR A 454 83.114 71.679 34.672 1.00 63.77 C ATOM 1203 CD2 TYR A 454 83.982 70.535 36.584 1.00 65.29 C ATOM 1204 CE1 TYR A 454 83.987 72.732 34.891 1.00 61.31 C ATOM 1205 CE2 TYR A 454 84.868 71.583 36.804 1.00 66.16 C ATOM 1206 CZ TYR A 454 84.856 72.679 35.960 1.00 63.39 C ATOM 1207 OH TYR A 454 85.716 73.721 36.179 1.00 57.81 O ATOM 0 H TYR A 454 80.943 70.188 37.333 1.00 61.67 H new ATOM 0 HA TYR A 454 80.582 70.675 34.776 1.00 63.14 H new ATOM 0 HB2 TYR A 454 82.260 68.718 35.926 1.00 61.87 H new ATOM 0 HB3 TYR A 454 82.257 69.035 34.399 1.00 61.87 H new ATOM 0 HD1 TYR A 454 82.525 71.718 33.954 1.00 63.77 H new ATOM 0 HD2 TYR A 454 83.979 69.808 37.164 1.00 65.29 H new ATOM 0 HE1 TYR A 454 83.987 73.468 34.322 1.00 61.31 H new ATOM 0 HE2 TYR A 454 85.466 71.548 37.515 1.00 66.16 H new ATOM 0 HH TYR A 454 86.184 73.560 36.858 1.00 57.81 H new ATOM 1208 N LEU A 455 78.967 68.213 35.822 1.00 64.28 N ATOM 1209 CA LEU A 455 77.894 67.281 35.472 1.00 62.79 C ATOM 1210 C LEU A 455 76.739 67.922 34.731 1.00 58.07 C ATOM 1211 O LEU A 455 76.179 67.309 33.835 1.00 58.80 O ATOM 1212 CB LEU A 455 77.378 66.528 36.704 1.00 66.40 C ATOM 1213 CG LEU A 455 78.190 65.259 36.967 1.00 72.48 C ATOM 1214 CD1 LEU A 455 78.258 64.890 38.443 1.00 76.72 C ATOM 1215 CD2 LEU A 455 77.603 64.118 36.145 1.00 76.73 C ATOM 0 H LEU A 455 79.125 68.270 36.666 1.00 64.28 H new ATOM 0 HA LEU A 455 78.300 66.650 34.858 1.00 62.79 H new ATOM 0 HB2 LEU A 455 77.421 67.108 37.480 1.00 66.40 H new ATOM 0 HB3 LEU A 455 76.445 66.296 36.575 1.00 66.40 H new ATOM 0 HG LEU A 455 79.106 65.428 36.696 1.00 72.48 H new ATOM 0 HD11 LEU A 455 78.783 64.081 38.551 1.00 76.72 H new ATOM 0 HD12 LEU A 455 78.673 65.613 38.939 1.00 76.72 H new ATOM 0 HD13 LEU A 455 77.361 64.740 38.781 1.00 76.72 H new ATOM 0 HD21 LEU A 455 78.112 63.308 36.305 1.00 76.73 H new ATOM 0 HD22 LEU A 455 76.679 63.975 36.403 1.00 76.73 H new ATOM 0 HD23 LEU A 455 77.644 64.344 35.202 1.00 76.73 H new ATOM 1216 N ASP A 456 76.406 69.157 35.072 1.00 56.48 N ATOM 1217 CA ASP A 456 75.215 69.797 34.544 1.00 57.56 C ATOM 1218 C ASP A 456 75.529 70.953 33.623 1.00 56.15 C ATOM 1219 O ASP A 456 74.624 71.672 33.192 1.00 58.32 O ATOM 1220 CB ASP A 456 74.336 70.268 35.719 1.00 67.99 C ATOM 1221 CG ASP A 456 73.843 69.101 36.596 1.00 72.21 C ATOM 1222 OD1 ASP A 456 74.657 68.232 36.979 1.00 74.95 O ATOM 1223 OD2 ASP A 456 72.635 69.050 36.902 1.00 81.61 O ATOM 0 H ASP A 456 76.862 69.645 35.613 1.00 56.48 H new ATOM 0 HA ASP A 456 74.740 69.143 34.008 1.00 57.56 H new ATOM 0 HB2 ASP A 456 74.841 70.889 36.267 1.00 67.99 H new ATOM 0 HB3 ASP A 456 73.571 70.753 35.372 1.00 67.99 H new ATOM 1224 N SER A 457 76.804 71.132 33.289 1.00 51.82 N ATOM 1225 CA SER A 457 77.202 72.214 32.400 1.00 48.74 C ATOM 1226 C SER A 457 76.588 71.993 31.014 1.00 45.43 C ATOM 1227 O SER A 457 76.524 70.865 30.533 1.00 42.53 O ATOM 1228 CB SER A 457 78.741 72.288 32.273 1.00 47.36 C ATOM 1229 OG SER A 457 79.106 73.255 31.303 1.00 45.35 O ATOM 0 H SER A 457 77.451 70.638 33.567 1.00 51.82 H new ATOM 0 HA SER A 457 76.882 73.050 32.774 1.00 48.74 H new ATOM 0 HB2 SER A 457 79.132 72.517 33.131 1.00 47.36 H new ATOM 0 HB3 SER A 457 79.094 71.420 32.023 1.00 47.36 H new ATOM 0 HG SER A 457 79.943 73.289 31.242 1.00 45.35 H new ATOM 1230 N GLY A 458 76.164 73.074 30.378 1.00 47.30 N ATOM 1231 CA GLY A 458 75.780 73.032 28.959 1.00 54.32 C ATOM 1232 C GLY A 458 76.926 72.584 28.034 1.00 56.36 C ATOM 1233 O GLY A 458 76.697 71.874 27.049 1.00 53.11 O ATOM 0 H GLY A 458 76.088 73.848 30.744 1.00 47.30 H new ATOM 0 HA2 GLY A 458 75.030 72.427 28.851 1.00 54.32 H new ATOM 0 HA3 GLY A 458 75.477 73.912 28.686 1.00 54.32 H new ATOM 1234 N TRP A 459 78.159 72.957 28.388 1.00 48.58 N ATOM 1235 CA TRP A 459 79.344 72.615 27.598 1.00 43.97 C ATOM 1236 C TRP A 459 79.851 71.230 27.888 1.00 40.94 C ATOM 1237 O TRP A 459 80.786 70.793 27.256 1.00 45.11 O ATOM 1238 CB TRP A 459 80.456 73.632 27.821 1.00 39.90 C ATOM 1239 CG TRP A 459 80.046 74.961 27.438 1.00 37.39 C ATOM 1240 CD1 TRP A 459 79.416 75.861 28.219 1.00 36.94 C ATOM 1241 CD2 TRP A 459 80.235 75.590 26.161 1.00 37.31 C ATOM 1242 NE1 TRP A 459 79.195 77.011 27.517 1.00 39.08 N ATOM 1243 CE2 TRP A 459 79.682 76.870 26.248 1.00 34.77 C ATOM 1244 CE3 TRP A 459 80.821 75.186 24.955 1.00 35.98 C ATOM 1245 CZ2 TRP A 459 79.677 77.762 25.178 1.00 38.58 C ATOM 1246 CZ3 TRP A 459 80.824 76.060 23.894 1.00 39.73 C ATOM 1247 CH2 TRP A 459 80.258 77.348 24.009 1.00 40.27 C ATOM 0 H TRP A 459 78.331 73.416 29.094 1.00 48.58 H new ATOM 0 HA TRP A 459 79.071 72.637 26.668 1.00 43.97 H new ATOM 0 HB2 TRP A 459 80.715 73.629 28.756 1.00 39.90 H new ATOM 0 HB3 TRP A 459 81.239 73.374 27.309 1.00 39.90 H new ATOM 0 HD1 TRP A 459 79.169 75.720 29.104 1.00 36.94 H new ATOM 0 HE1 TRP A 459 78.809 77.715 27.826 1.00 39.08 H new ATOM 0 HE3 TRP A 459 81.201 74.341 24.873 1.00 35.98 H new ATOM 0 HZ2 TRP A 459 79.294 78.606 25.255 1.00 38.58 H new ATOM 0 HZ3 TRP A 459 81.205 75.798 23.087 1.00 39.73 H new ATOM 0 HH2 TRP A 459 80.280 77.924 23.280 1.00 40.27 H new ATOM 1248 N ASN A 460 79.257 70.533 28.843 1.00 40.24 N ATOM 1249 CA ASN A 460 79.456 69.106 28.958 1.00 41.48 C ATOM 1250 C ASN A 460 78.678 68.537 27.784 1.00 49.89 C ATOM 1251 O ASN A 460 77.456 68.764 27.680 1.00 48.20 O ATOM 1252 CB ASN A 460 78.891 68.611 30.274 1.00 44.86 C ATOM 1253 CG ASN A 460 79.102 67.128 30.500 1.00 46.28 C ATOM 1254 OD1 ASN A 460 79.097 66.315 29.578 1.00 51.89 O ATOM 1255 ND2 ASN A 460 79.262 66.766 31.751 1.00 51.22 N ATOM 0 H ASN A 460 78.733 70.872 29.435 1.00 40.24 H new ATOM 0 HA ASN A 460 80.390 68.845 28.943 1.00 41.48 H new ATOM 0 HB2 ASN A 460 79.303 69.104 31.001 1.00 44.86 H new ATOM 0 HB3 ASN A 460 77.941 68.804 30.303 1.00 44.86 H new ATOM 0 HD21 ASN A 460 79.368 65.936 31.948 1.00 51.22 H new ATOM 0 HD22 ASN A 460 79.261 67.359 32.374 1.00 51.22 H new ATOM 1256 N LEU A 461 79.379 67.847 26.887 1.00 46.44 N ATOM 1257 CA LEU A 461 78.797 67.432 25.601 1.00 50.20 C ATOM 1258 C LEU A 461 77.791 66.276 25.702 1.00 52.81 C ATOM 1259 O LEU A 461 77.092 65.985 24.742 1.00 52.86 O ATOM 1260 CB LEU A 461 79.900 67.105 24.569 1.00 44.17 C ATOM 1261 CG LEU A 461 80.806 68.282 24.185 1.00 43.67 C ATOM 1262 CD1 LEU A 461 81.690 67.931 22.982 1.00 44.25 C ATOM 1263 CD2 LEU A 461 80.021 69.555 23.909 1.00 40.81 C ATOM 0 H LEU A 461 80.197 67.606 27.000 1.00 46.44 H new ATOM 0 HA LEU A 461 78.287 68.198 25.295 1.00 50.20 H new ATOM 0 HB2 LEU A 461 80.454 66.392 24.924 1.00 44.17 H new ATOM 0 HB3 LEU A 461 79.479 66.764 23.764 1.00 44.17 H new ATOM 0 HG LEU A 461 81.375 68.452 24.952 1.00 43.67 H new ATOM 0 HD11 LEU A 461 82.252 68.690 22.760 1.00 44.25 H new ATOM 0 HD12 LEU A 461 82.249 67.169 23.202 1.00 44.25 H new ATOM 0 HD13 LEU A 461 81.129 67.711 22.222 1.00 44.25 H new ATOM 0 HD21 LEU A 461 80.634 70.268 23.671 1.00 40.81 H new ATOM 0 HD22 LEU A 461 79.404 69.402 23.177 1.00 40.81 H new ATOM 0 HD23 LEU A 461 79.524 69.808 24.703 1.00 40.81 H new ATOM 1264 N ASN A 462 77.697 65.632 26.852 1.00 54.55 N ATOM 1265 CA ASN A 462 76.563 64.740 27.093 1.00 58.97 C ATOM 1266 C ASN A 462 75.227 65.470 27.210 1.00 58.11 C ATOM 1267 O ASN A 462 74.203 64.932 26.826 1.00 64.40 O ATOM 1268 CB ASN A 462 76.805 63.919 28.320 1.00 56.09 C ATOM 1269 CG ASN A 462 78.043 63.086 28.191 1.00 58.31 C ATOM 1270 OD1 ASN A 462 78.001 61.994 27.656 1.00 57.36 O ATOM 1271 ND2 ASN A 462 79.167 63.612 28.663 1.00 59.44 N ATOM 0 H ASN A 462 78.263 65.691 27.497 1.00 54.55 H new ATOM 0 HA ASN A 462 76.497 64.166 26.314 1.00 58.97 H new ATOM 0 HB2 ASN A 462 76.886 64.503 29.090 1.00 56.09 H new ATOM 0 HB3 ASN A 462 76.042 63.343 28.480 1.00 56.09 H new ATOM 0 HD21 ASN A 462 79.906 63.177 28.597 1.00 59.44 H new ATOM 0 HD22 ASN A 462 79.156 64.387 29.035 1.00 59.44 H new ATOM 1272 N ASN A 463 75.260 66.707 27.686 1.00 58.51 N ATOM 1273 CA ASN A 463 74.059 67.492 27.941 1.00 63.67 C ATOM 1274 C ASN A 463 73.528 68.284 26.751 1.00 73.53 C ATOM 1275 O ASN A 463 72.306 68.399 26.604 1.00 66.98 O ATOM 1276 CB ASN A 463 74.296 68.477 29.096 1.00 61.27 C ATOM 1277 CG ASN A 463 74.676 67.785 30.398 1.00 65.32 C ATOM 1278 OD1 ASN A 463 74.440 66.578 30.596 1.00 58.34 O ATOM 1279 ND2 ASN A 463 75.275 68.556 31.303 1.00 66.85 N ATOM 0 H ASN A 463 75.990 67.121 27.873 1.00 58.51 H new ATOM 0 HA ASN A 463 73.386 66.828 28.158 1.00 63.67 H new ATOM 0 HB2 ASN A 463 75.000 69.096 28.847 1.00 61.27 H new ATOM 0 HB3 ASN A 463 73.493 69.002 29.237 1.00 61.27 H new ATOM 0 HD21 ASN A 463 75.515 68.224 32.059 1.00 66.85 H new ATOM 0 HD22 ASN A 463 75.422 69.386 31.131 1.00 66.85 H new ATOM 1280 N MET A 464 74.426 68.862 25.939 1.00 76.94 N ATOM 1281 CA MET A 464 74.026 69.646 24.743 1.00 81.69 C ATOM 1282 C MET A 464 72.944 69.017 23.881 1.00 78.95 C ATOM 1283 O MET A 464 71.993 69.716 23.533 1.00 74.15 O ATOM 1284 CB MET A 464 75.219 69.983 23.838 1.00 80.94 C ATOM 1285 CG MET A 464 75.986 71.193 24.317 1.00 82.19 C ATOM 1286 SD MET A 464 76.637 72.278 23.055 1.00 86.50 S ATOM 1287 CE MET A 464 75.161 72.825 22.205 1.00 92.72 C ATOM 0 H MET A 464 75.276 68.815 26.059 1.00 76.94 H new ATOM 0 HA MET A 464 73.653 70.451 25.135 1.00 81.69 H new ATOM 0 HB2 MET A 464 75.817 69.220 23.798 1.00 80.94 H new ATOM 0 HB3 MET A 464 74.901 70.142 22.935 1.00 80.94 H new ATOM 0 HG2 MET A 464 75.404 71.713 24.893 1.00 82.19 H new ATOM 0 HG3 MET A 464 76.726 70.886 24.864 1.00 82.19 H new ATOM 0 HE1 MET A 464 75.360 72.962 21.266 1.00 92.72 H new ATOM 0 HE2 MET A 464 74.468 72.152 22.293 1.00 92.72 H new ATOM 0 HE3 MET A 464 74.853 73.658 22.595 1.00 92.72 H new ATOM 1288 N PRO A 465 73.087 67.714 23.537 1.00 80.68 N ATOM 1289 CA PRO A 465 72.059 67.032 22.734 1.00 84.55 C ATOM 1290 C PRO A 465 70.723 66.891 23.455 1.00 89.59 C ATOM 1291 O PRO A 465 69.706 67.302 22.907 1.00 98.16 O ATOM 1292 CB PRO A 465 72.673 65.656 22.445 1.00 86.81 C ATOM 1293 CG PRO A 465 73.738 65.488 23.468 1.00 85.15 C ATOM 1294 CD PRO A 465 74.268 66.855 23.729 1.00 80.14 C ATOM 0 HA PRO A 465 71.845 67.538 21.935 1.00 84.55 H new ATOM 0 HB2 PRO A 465 72.008 64.953 22.512 1.00 86.81 H new ATOM 0 HB3 PRO A 465 73.039 65.616 21.547 1.00 86.81 H new ATOM 0 HG2 PRO A 465 73.382 65.092 24.279 1.00 85.15 H new ATOM 0 HG3 PRO A 465 74.438 64.898 23.148 1.00 85.15 H new ATOM 0 HD2 PRO A 465 74.628 66.935 24.626 1.00 80.14 H new ATOM 0 HD3 PRO A 465 74.983 67.086 23.115 1.00 80.14 H new ATOM 1295 N VAL A 466 70.722 66.347 24.677 1.00 87.06 N ATOM 1296 CA VAL A 466 69.469 66.181 25.448 1.00 78.04 C ATOM 1297 C VAL A 466 69.049 67.421 26.266 1.00 67.48 C ATOM 1298 O VAL A 466 68.229 67.299 27.155 1.00 67.10 O ATOM 1299 CB VAL A 466 69.472 64.895 26.330 1.00 77.15 C ATOM 1300 CG1 VAL A 466 69.893 63.685 25.498 1.00 80.26 C ATOM 1301 CG2 VAL A 466 70.338 65.040 27.580 1.00 79.69 C ATOM 0 H VAL A 466 71.428 66.068 25.080 1.00 87.06 H new ATOM 0 HA VAL A 466 68.786 66.074 24.767 1.00 78.04 H new ATOM 0 HB VAL A 466 68.565 64.757 26.645 1.00 77.15 H new ATOM 0 HG11 VAL A 466 69.891 62.892 26.056 1.00 80.26 H new ATOM 0 HG12 VAL A 466 69.271 63.565 24.764 1.00 80.26 H new ATOM 0 HG13 VAL A 466 70.785 63.829 25.145 1.00 80.26 H new ATOM 0 HG21 VAL A 466 70.307 64.217 28.093 1.00 79.69 H new ATOM 0 HG22 VAL A 466 71.254 65.224 27.320 1.00 79.69 H new ATOM 0 HG23 VAL A 466 70.004 65.771 28.122 1.00 79.69 H new ATOM 1302 N MET A 467 69.577 68.608 25.955 1.00 62.45 N ATOM 1303 CA MET A 467 69.085 69.841 26.574 1.00 64.95 C ATOM 1304 C MET A 467 67.814 70.227 25.877 1.00 70.90 C ATOM 1305 O MET A 467 67.585 69.807 24.742 1.00 70.25 O ATOM 1306 CB MET A 467 70.102 70.993 26.474 1.00 67.31 C ATOM 1307 CG MET A 467 70.962 71.154 27.730 1.00 73.93 C ATOM 1308 SD MET A 467 72.384 72.255 27.566 1.00 71.13 S ATOM 1309 CE MET A 467 71.725 73.875 27.987 1.00 71.31 C ATOM 0 H MET A 467 70.217 68.720 25.391 1.00 62.45 H new ATOM 0 HA MET A 467 68.937 69.679 27.519 1.00 64.95 H new ATOM 0 HB2 MET A 467 70.681 70.839 25.711 1.00 67.31 H new ATOM 0 HB3 MET A 467 69.627 71.822 26.307 1.00 67.31 H new ATOM 0 HG2 MET A 467 70.399 71.484 28.448 1.00 73.93 H new ATOM 0 HG3 MET A 467 71.281 70.278 27.999 1.00 73.93 H new ATOM 0 HE1 MET A 467 72.431 74.538 27.925 1.00 71.31 H new ATOM 0 HE2 MET A 467 71.011 74.104 27.371 1.00 71.31 H new ATOM 0 HE3 MET A 467 71.377 73.858 28.892 1.00 71.31 H new ATOM 1310 N GLU A 468 67.017 71.067 26.541 1.00 80.94 N ATOM 1311 CA GLU A 468 65.751 71.583 25.981 1.00 82.21 C ATOM 1312 C GLU A 468 66.011 72.132 24.569 1.00 81.95 C ATOM 1313 O GLU A 468 65.180 71.939 23.674 1.00 78.55 O ATOM 1314 CB GLU A 468 65.102 72.688 26.878 1.00 82.15 C ATOM 1315 CG GLU A 468 63.564 72.680 27.095 1.00 83.53 C ATOM 1316 CD GLU A 468 62.670 72.294 25.893 1.00 85.89 C ATOM 1317 OE1 GLU A 468 62.471 73.096 24.937 1.00 84.68 O ATOM 1318 OE2 GLU A 468 62.098 71.178 25.929 1.00 79.67 O ATOM 0 H GLU A 468 67.191 71.358 27.331 1.00 80.94 H new ATOM 0 HA GLU A 468 65.121 70.846 25.946 1.00 82.21 H new ATOM 0 HB2 GLU A 468 65.521 72.638 27.752 1.00 82.15 H new ATOM 0 HB3 GLU A 468 65.339 73.549 26.499 1.00 82.15 H new ATOM 0 HG2 GLU A 468 63.368 72.068 27.821 1.00 83.53 H new ATOM 0 HG3 GLU A 468 63.300 73.565 27.391 1.00 83.53 H new ATOM 1319 N GLN A 469 67.160 72.788 24.365 1.00 69.81 N ATOM 1320 CA GLN A 469 67.396 73.553 23.130 1.00 67.83 C ATOM 1321 C GLN A 469 68.018 72.794 21.945 1.00 56.66 C ATOM 1322 O GLN A 469 68.067 73.366 20.874 1.00 60.15 O ATOM 1323 CB GLN A 469 68.150 74.860 23.440 1.00 73.16 C ATOM 1324 CG GLN A 469 67.245 75.918 24.041 1.00 73.73 C ATOM 1325 CD GLN A 469 67.975 77.154 24.497 1.00 83.07 C ATOM 1326 OE1 GLN A 469 67.759 78.243 23.962 1.00 82.92 O ATOM 1327 NE2 GLN A 469 68.834 77.002 25.513 1.00 84.61 N ATOM 0 H GLN A 469 67.812 72.803 24.925 1.00 69.81 H new ATOM 0 HA GLN A 469 66.505 73.753 22.802 1.00 67.83 H new ATOM 0 HB2 GLN A 469 68.878 74.673 24.054 1.00 73.16 H new ATOM 0 HB3 GLN A 469 68.548 75.203 22.624 1.00 73.16 H new ATOM 0 HG2 GLN A 469 66.577 76.171 23.385 1.00 73.73 H new ATOM 0 HG3 GLN A 469 66.771 75.535 24.796 1.00 73.73 H new ATOM 0 HE21 GLN A 469 68.957 76.225 25.859 1.00 84.61 H new ATOM 0 HE22 GLN A 469 69.263 77.682 25.819 1.00 84.61 H new ATOM 1328 N SER A 470 68.450 71.533 22.080 1.00 53.69 N ATOM 1329 CA SER A 470 68.645 70.733 20.866 1.00 55.53 C ATOM 1330 C SER A 470 67.303 70.121 20.467 1.00 63.11 C ATOM 1331 O SER A 470 66.728 69.288 21.199 1.00 63.32 O ATOM 1332 CB SER A 470 69.722 69.653 20.948 1.00 60.13 C ATOM 1333 OG SER A 470 70.113 69.207 19.619 1.00 54.51 O ATOM 0 H SER A 470 68.627 71.140 22.824 1.00 53.69 H new ATOM 0 HA SER A 470 68.978 71.345 20.191 1.00 55.53 H new ATOM 0 HB2 SER A 470 70.497 69.999 21.418 1.00 60.13 H new ATOM 0 HB3 SER A 470 69.391 68.900 21.462 1.00 60.13 H new ATOM 0 HG SER A 470 70.706 68.616 19.685 1.00 54.51 H new ATOM 1334 N VAL A 471 66.794 70.543 19.309 1.00 60.18 N ATOM 1335 CA VAL A 471 65.566 69.972 18.763 1.00 62.32 C ATOM 1336 C VAL A 471 65.726 68.446 18.626 1.00 65.27 C ATOM 1337 O VAL A 471 64.732 67.723 18.679 1.00 68.74 O ATOM 1338 CB VAL A 471 65.133 70.660 17.432 1.00 65.63 C ATOM 1339 CG1 VAL A 471 65.061 72.182 17.577 1.00 62.89 C ATOM 1340 CG2 VAL A 471 66.068 70.300 16.297 1.00 67.55 C ATOM 0 H VAL A 471 67.146 71.160 18.825 1.00 60.18 H new ATOM 0 HA VAL A 471 64.839 70.145 19.382 1.00 62.32 H new ATOM 0 HB VAL A 471 64.245 70.330 17.224 1.00 65.63 H new ATOM 0 HG11 VAL A 471 64.790 72.575 16.733 1.00 62.89 H new ATOM 0 HG12 VAL A 471 64.415 72.412 18.263 1.00 62.89 H new ATOM 0 HG13 VAL A 471 65.933 72.525 17.827 1.00 62.89 H new ATOM 0 HG21 VAL A 471 65.775 70.741 15.484 1.00 67.55 H new ATOM 0 HG22 VAL A 471 66.968 70.589 16.515 1.00 67.55 H new ATOM 0 HG23 VAL A 471 66.061 69.339 16.164 1.00 67.55 H new ATOM 1341 N LEU A 472 66.971 67.964 18.480 1.00 66.02 N ATOM 1342 CA LEU A 472 67.287 66.525 18.560 1.00 70.44 C ATOM 1343 C LEU A 472 66.929 65.832 19.881 1.00 71.87 C ATOM 1344 O LEU A 472 66.796 64.606 19.895 1.00 68.27 O ATOM 1345 CB LEU A 472 68.777 66.256 18.291 1.00 78.65 C ATOM 1346 CG LEU A 472 69.422 66.662 16.961 1.00 84.83 C ATOM 1347 CD1 LEU A 472 70.815 66.045 16.851 1.00 90.23 C ATOM 1348 CD2 LEU A 472 68.569 66.271 15.763 1.00 86.79 C ATOM 0 H LEU A 472 67.656 68.462 18.332 1.00 66.02 H new ATOM 0 HA LEU A 472 66.719 66.145 17.872 1.00 70.44 H new ATOM 0 HB2 LEU A 472 69.277 66.696 18.996 1.00 78.65 H new ATOM 0 HB3 LEU A 472 68.918 65.302 18.396 1.00 78.65 H new ATOM 0 HG LEU A 472 69.494 67.629 16.952 1.00 84.83 H new ATOM 0 HD11 LEU A 472 71.219 66.305 16.008 1.00 90.23 H new ATOM 0 HD12 LEU A 472 71.367 66.359 17.584 1.00 90.23 H new ATOM 0 HD13 LEU A 472 70.745 65.078 16.891 1.00 90.23 H new ATOM 0 HD21 LEU A 472 69.013 66.546 14.946 1.00 86.79 H new ATOM 0 HD22 LEU A 472 68.444 65.309 15.755 1.00 86.79 H new ATOM 0 HD23 LEU A 472 67.705 66.708 15.824 1.00 86.79 H new ATOM 1349 N ALA A 473 66.807 66.594 20.975 1.00 73.33 N ATOM 1350 CA ALA A 473 66.384 66.079 22.293 1.00 71.75 C ATOM 1351 C ALA A 473 65.043 65.392 22.246 1.00 69.15 C ATOM 1352 O ALA A 473 64.832 64.373 22.897 1.00 64.87 O ATOM 1353 CB ALA A 473 66.299 67.211 23.315 1.00 73.34 C ATOM 0 H ALA A 473 66.970 67.438 20.975 1.00 73.33 H new ATOM 0 HA ALA A 473 67.057 65.431 22.553 1.00 71.75 H new ATOM 0 HB1 ALA A 473 66.020 66.853 24.172 1.00 73.34 H new ATOM 0 HB2 ALA A 473 67.169 67.630 23.407 1.00 73.34 H new ATOM 0 HB3 ALA A 473 65.654 67.870 23.015 1.00 73.34 H new ATOM 1354 N HIS A 474 64.138 65.978 21.480 1.00 69.35 N ATOM 1355 CA HIS A 474 62.759 65.544 21.445 1.00 65.35 C ATOM 1356 C HIS A 474 62.549 64.352 20.544 1.00 60.72 C ATOM 1357 O HIS A 474 61.523 63.703 20.642 1.00 64.32 O ATOM 1358 CB HIS A 474 61.890 66.713 21.020 1.00 73.49 C ATOM 1359 CG HIS A 474 62.023 67.896 21.927 1.00 78.29 C ATOM 1360 ND1 HIS A 474 62.870 68.949 21.651 1.00 75.82 N ATOM 1361 CD2 HIS A 474 61.455 68.169 23.126 1.00 80.15 C ATOM 1362 CE1 HIS A 474 62.793 69.837 22.626 1.00 81.31 C ATOM 1363 NE2 HIS A 474 61.944 69.387 23.535 1.00 84.36 N ATOM 0 H HIS A 474 64.310 66.643 20.963 1.00 69.35 H new ATOM 0 HA HIS A 474 62.507 65.251 22.335 1.00 65.35 H new ATOM 0 HB2 HIS A 474 62.127 66.975 20.117 1.00 73.49 H new ATOM 0 HB3 HIS A 474 60.962 66.430 20.999 1.00 73.49 H new ATOM 0 HD2 HIS A 474 60.849 67.634 23.586 1.00 80.15 H new ATOM 0 HE1 HIS A 474 63.257 70.642 22.666 1.00 81.31 H new ATOM 0 HE2 HIS A 474 61.732 69.791 24.264 1.00 84.36 H new ATOM 1364 N ILE A 475 63.504 64.045 19.676 1.00 57.51 N ATOM 1365 CA ILE A 475 63.405 62.836 18.857 1.00 62.88 C ATOM 1366 C ILE A 475 63.395 61.586 19.762 1.00 68.13 C ATOM 1367 O ILE A 475 64.263 61.406 20.620 1.00 66.19 O ATOM 1368 CB ILE A 475 64.521 62.746 17.787 1.00 63.89 C ATOM 1369 CG1 ILE A 475 64.357 63.866 16.753 1.00 66.49 C ATOM 1370 CG2 ILE A 475 64.505 61.390 17.072 1.00 67.77 C ATOM 1371 CD1 ILE A 475 65.590 64.122 15.904 1.00 65.75 C ATOM 0 H ILE A 475 64.212 64.515 19.544 1.00 57.51 H new ATOM 0 HA ILE A 475 62.568 62.881 18.370 1.00 62.88 H new ATOM 0 HB ILE A 475 65.371 62.843 18.244 1.00 63.89 H new ATOM 0 HG12 ILE A 475 63.615 63.645 16.168 1.00 66.49 H new ATOM 0 HG13 ILE A 475 64.120 64.685 17.215 1.00 66.49 H new ATOM 0 HG21 ILE A 475 65.213 61.365 16.410 1.00 67.77 H new ATOM 0 HG22 ILE A 475 64.643 60.681 17.719 1.00 67.77 H new ATOM 0 HG23 ILE A 475 63.649 61.265 16.634 1.00 67.77 H new ATOM 0 HD11 ILE A 475 65.409 64.840 15.278 1.00 65.75 H new ATOM 0 HD12 ILE A 475 66.331 64.373 16.477 1.00 65.75 H new ATOM 0 HD13 ILE A 475 65.819 63.317 15.414 1.00 65.75 H new ATOM 1372 N THR A 476 62.362 60.763 19.580 1.00 71.97 N ATOM 1373 CA THR A 476 62.220 59.487 20.276 1.00 74.14 C ATOM 1374 C THR A 476 62.738 58.330 19.409 1.00 72.07 C ATOM 1375 O THR A 476 63.011 57.255 19.929 1.00 73.03 O ATOM 1376 CB THR A 476 60.747 59.234 20.684 1.00 76.39 C ATOM 1377 OG1 THR A 476 59.916 59.185 19.514 1.00 71.23 O ATOM 1378 CG2 THR A 476 60.245 60.345 21.632 1.00 74.77 C ATOM 0 H THR A 476 61.715 60.934 19.040 1.00 71.97 H new ATOM 0 HA THR A 476 62.756 59.532 21.083 1.00 74.14 H new ATOM 0 HB THR A 476 60.700 58.384 21.149 1.00 76.39 H new ATOM 0 HG1 THR A 476 59.119 59.046 19.741 1.00 71.23 H new ATOM 0 HG21 THR A 476 59.323 60.170 21.876 1.00 74.77 H new ATOM 0 HG22 THR A 476 60.794 60.360 22.432 1.00 74.77 H new ATOM 0 HG23 THR A 476 60.303 61.203 21.184 1.00 74.77 H new ATOM 1379 N ALA A 477 62.866 58.541 18.097 1.00 72.48 N ATOM 1380 CA ALA A 477 63.565 57.587 17.220 1.00 73.24 C ATOM 1381 C ALA A 477 65.029 57.359 17.634 1.00 73.98 C ATOM 1382 O ALA A 477 65.659 58.204 18.291 1.00 67.90 O ATOM 1383 CB ALA A 477 63.502 58.045 15.771 1.00 73.25 C ATOM 0 H ALA A 477 62.555 59.232 17.691 1.00 72.48 H new ATOM 0 HA ALA A 477 63.104 56.739 17.313 1.00 73.24 H new ATOM 0 HB1 ALA A 477 63.967 57.406 15.209 1.00 73.25 H new ATOM 0 HB2 ALA A 477 62.575 58.107 15.491 1.00 73.25 H new ATOM 0 HB3 ALA A 477 63.924 58.915 15.688 1.00 73.25 H new ATOM 1384 N ASP A 478 65.539 56.187 17.267 1.00 80.12 N ATOM 1385 CA ASP A 478 66.943 55.846 17.455 1.00 86.72 C ATOM 1386 C ASP A 478 67.737 56.669 16.443 1.00 88.88 C ATOM 1387 O ASP A 478 67.612 56.463 15.233 1.00 88.25 O ATOM 1388 CB ASP A 478 67.179 54.337 17.238 1.00 89.48 C ATOM 1389 CG ASP A 478 68.644 53.908 17.462 1.00 94.09 C ATOM 1390 OD1 ASP A 478 69.525 54.759 17.730 1.00 93.19 O ATOM 1391 OD2 ASP A 478 68.917 52.691 17.363 1.00 97.54 O ATOM 0 H ASP A 478 65.075 55.563 16.899 1.00 80.12 H new ATOM 0 HA ASP A 478 67.226 56.045 18.361 1.00 86.72 H new ATOM 0 HB2 ASP A 478 66.607 53.837 17.841 1.00 89.48 H new ATOM 0 HB3 ASP A 478 66.914 54.102 16.335 1.00 89.48 H new ATOM 1392 N ILE A 479 68.516 57.621 16.954 1.00 85.61 N ATOM 1393 CA ILE A 479 69.457 58.397 16.149 1.00 82.96 C ATOM 1394 C ILE A 479 70.784 58.474 16.928 1.00 86.11 C ATOM 1395 O ILE A 479 71.338 59.556 17.144 1.00 86.80 O ATOM 1396 CB ILE A 479 68.868 59.788 15.781 1.00 78.80 C ATOM 1397 CG1 ILE A 479 68.380 60.553 17.016 1.00 76.39 C ATOM 1398 CG2 ILE A 479 67.691 59.633 14.824 1.00 77.32 C ATOM 1399 CD1 ILE A 479 68.247 62.041 16.778 1.00 76.40 C ATOM 0 H ILE A 479 68.513 57.836 17.787 1.00 85.61 H new ATOM 0 HA ILE A 479 69.625 57.967 15.296 1.00 82.96 H new ATOM 0 HB ILE A 479 69.585 60.289 15.363 1.00 78.80 H new ATOM 0 HG12 ILE A 479 67.521 60.197 17.292 1.00 76.39 H new ATOM 0 HG13 ILE A 479 68.998 60.402 17.748 1.00 76.39 H new ATOM 0 HG21 ILE A 479 67.335 60.508 14.604 1.00 77.32 H new ATOM 0 HG22 ILE A 479 67.989 59.193 14.013 1.00 77.32 H new ATOM 0 HG23 ILE A 479 66.999 59.100 15.245 1.00 77.32 H new ATOM 0 HD11 ILE A 479 67.936 62.472 17.589 1.00 76.40 H new ATOM 0 HD12 ILE A 479 69.110 62.407 16.528 1.00 76.40 H new ATOM 0 HD13 ILE A 479 67.610 62.199 16.064 1.00 76.40 H new ATOM 1400 N CYS A 480 71.278 57.298 17.334 1.00 88.83 N ATOM 1401 CA CYS A 480 72.449 57.163 18.238 1.00 90.49 C ATOM 1402 C CYS A 480 73.728 57.852 17.766 1.00 86.37 C ATOM 1403 O CYS A 480 74.445 58.441 18.582 1.00 83.36 O ATOM 1404 CB CYS A 480 72.759 55.689 18.530 1.00 92.68 C ATOM 1405 SG CYS A 480 71.845 55.069 19.953 1.00101.59 S ATOM 0 H CYS A 480 70.943 56.543 17.093 1.00 88.83 H new ATOM 0 HA CYS A 480 72.171 57.627 19.043 1.00 90.49 H new ATOM 0 HB2 CYS A 480 72.542 55.154 17.750 1.00 92.68 H new ATOM 0 HB3 CYS A 480 73.710 55.586 18.689 1.00 92.68 H new ATOM 0 HG CYS A 480 70.728 54.784 19.619 1.00101.59 H new ATOM 1406 N GLY A 481 73.999 57.783 16.460 1.00 80.43 N ATOM 1407 CA GLY A 481 75.080 58.554 15.834 1.00 79.50 C ATOM 1408 C GLY A 481 75.011 60.072 16.016 1.00 79.80 C ATOM 1409 O GLY A 481 76.046 60.742 15.969 1.00 84.06 O ATOM 0 H GLY A 481 73.561 57.287 15.911 1.00 80.43 H new ATOM 0 HA2 GLY A 481 75.926 58.241 16.191 1.00 79.50 H new ATOM 0 HA3 GLY A 481 75.084 58.360 14.884 1.00 79.50 H new ATOM 1410 N MET A 482 73.808 60.603 16.259 1.00 73.26 N ATOM 1411 CA MET A 482 73.535 62.039 16.228 1.00 72.56 C ATOM 1412 C MET A 482 73.195 62.734 17.551 1.00 78.64 C ATOM 1413 O MET A 482 73.034 63.969 17.576 1.00 83.47 O ATOM 1414 CB MET A 482 72.369 62.275 15.281 1.00 70.61 C ATOM 1415 CG MET A 482 72.767 62.308 13.824 1.00 66.61 C ATOM 1416 SD MET A 482 71.567 63.345 13.008 1.00 57.67 S ATOM 1417 CE MET A 482 72.128 64.995 13.444 1.00 56.85 C ATOM 0 H MET A 482 73.117 60.127 16.450 1.00 73.26 H new ATOM 0 HA MET A 482 74.378 62.432 15.953 1.00 72.56 H new ATOM 0 HB2 MET A 482 71.710 61.576 15.412 1.00 70.61 H new ATOM 0 HB3 MET A 482 71.941 63.115 15.510 1.00 70.61 H new ATOM 0 HG2 MET A 482 73.663 62.664 13.717 1.00 66.61 H new ATOM 0 HG3 MET A 482 72.769 61.415 13.445 1.00 66.61 H new ATOM 0 HE1 MET A 482 71.369 65.534 13.715 1.00 56.85 H new ATOM 0 HE2 MET A 482 72.762 64.939 14.176 1.00 56.85 H new ATOM 0 HE3 MET A 482 72.557 65.404 12.677 1.00 56.85 H new ATOM 1418 N LYS A 483 73.017 61.980 18.629 1.00 73.12 N ATOM 1419 CA LYS A 483 72.889 62.622 19.945 1.00 72.85 C ATOM 1420 C LYS A 483 73.800 62.067 21.040 1.00 60.34 C ATOM 1421 O LYS A 483 73.841 62.636 22.124 1.00 61.94 O ATOM 1422 CB LYS A 483 71.424 62.655 20.403 1.00 77.18 C ATOM 1423 CG LYS A 483 70.716 61.306 20.401 1.00 80.80 C ATOM 1424 CD LYS A 483 69.462 61.309 21.273 1.00 84.13 C ATOM 1425 CE LYS A 483 68.609 62.555 21.068 1.00 86.14 C ATOM 1426 NZ LYS A 483 67.195 62.353 21.485 1.00 88.91 N ATOM 0 H LYS A 483 72.968 61.121 18.630 1.00 73.12 H new ATOM 0 HA LYS A 483 73.205 63.529 19.806 1.00 72.85 H new ATOM 0 HB2 LYS A 483 71.388 63.022 21.300 1.00 77.18 H new ATOM 0 HB3 LYS A 483 70.933 63.263 19.828 1.00 77.18 H new ATOM 0 HG2 LYS A 483 70.474 61.071 19.491 1.00 80.80 H new ATOM 0 HG3 LYS A 483 71.326 60.622 20.718 1.00 80.80 H new ATOM 0 HD2 LYS A 483 68.932 60.522 21.074 1.00 84.13 H new ATOM 0 HD3 LYS A 483 69.721 61.248 22.206 1.00 84.13 H new ATOM 0 HE2 LYS A 483 68.990 63.291 21.573 1.00 86.14 H new ATOM 0 HE3 LYS A 483 68.634 62.810 20.132 1.00 86.14 H new ATOM 0 HZ1 LYS A 483 66.682 62.975 21.108 1.00 88.91 H new ATOM 0 HZ2 LYS A 483 66.921 61.547 21.226 1.00 88.91 H new ATOM 0 HZ3 LYS A 483 67.135 62.416 22.371 1.00 88.91 H new ATOM 1427 N LEU A 484 74.488 60.957 20.779 1.00 53.72 N ATOM 1428 CA LEU A 484 75.486 60.453 21.692 1.00 54.23 C ATOM 1429 C LEU A 484 76.814 61.008 21.218 1.00 52.70 C ATOM 1430 O LEU A 484 77.033 61.106 20.008 1.00 48.54 O ATOM 1431 CB LEU A 484 75.517 58.928 21.697 1.00 55.32 C ATOM 1432 CG LEU A 484 74.211 58.241 22.154 1.00 57.18 C ATOM 1433 CD1 LEU A 484 74.458 56.750 22.332 1.00 56.78 C ATOM 1434 CD2 LEU A 484 73.663 58.841 23.446 1.00 53.44 C ATOM 0 H LEU A 484 74.384 60.483 20.069 1.00 53.72 H new ATOM 0 HA LEU A 484 75.288 60.727 22.601 1.00 54.23 H new ATOM 0 HB2 LEU A 484 75.730 58.621 20.802 1.00 55.32 H new ATOM 0 HB3 LEU A 484 76.238 58.636 22.276 1.00 55.32 H new ATOM 0 HG LEU A 484 73.543 58.387 21.466 1.00 57.18 H new ATOM 0 HD11 LEU A 484 73.638 56.318 22.619 1.00 56.78 H new ATOM 0 HD12 LEU A 484 74.747 56.367 21.489 1.00 56.78 H new ATOM 0 HD13 LEU A 484 75.146 56.614 23.002 1.00 56.78 H new ATOM 0 HD21 LEU A 484 72.846 58.382 23.695 1.00 53.44 H new ATOM 0 HD22 LEU A 484 74.319 58.740 24.154 1.00 53.44 H new ATOM 0 HD23 LEU A 484 73.476 59.783 23.311 1.00 53.44 H new ATOM 1435 N PRO A 485 77.692 61.397 22.161 1.00 51.00 N ATOM 1436 CA PRO A 485 78.992 61.860 21.693 1.00 45.86 C ATOM 1437 C PRO A 485 79.867 60.777 21.071 1.00 43.36 C ATOM 1438 O PRO A 485 79.780 59.583 21.395 1.00 36.74 O ATOM 1439 CB PRO A 485 79.635 62.443 22.962 1.00 46.88 C ATOM 1440 CG PRO A 485 78.475 62.909 23.770 1.00 49.04 C ATOM 1441 CD PRO A 485 77.451 61.817 23.557 1.00 50.54 C ATOM 0 HA PRO A 485 78.894 62.497 20.968 1.00 45.86 H new ATOM 0 HB2 PRO A 485 80.153 61.775 23.437 1.00 46.88 H new ATOM 0 HB3 PRO A 485 80.238 63.173 22.752 1.00 46.88 H new ATOM 0 HG2 PRO A 485 78.706 63.007 24.707 1.00 49.04 H new ATOM 0 HG3 PRO A 485 78.149 63.771 23.467 1.00 49.04 H new ATOM 0 HD2 PRO A 485 77.575 61.083 24.179 1.00 50.54 H new ATOM 0 HD3 PRO A 485 76.547 62.144 23.682 1.00 50.54 H new ATOM 1442 N TRP A 486 80.716 61.227 20.163 1.00 43.67 N ATOM 1443 CA TRP A 486 81.768 60.386 19.611 1.00 42.05 C ATOM 1444 C TRP A 486 83.097 60.744 20.275 1.00 37.75 C ATOM 1445 O TRP A 486 83.375 61.920 20.555 1.00 35.63 O ATOM 1446 CB TRP A 486 81.855 60.605 18.105 1.00 45.20 C ATOM 1447 CG TRP A 486 80.737 59.959 17.350 1.00 49.43 C ATOM 1448 CD1 TRP A 486 79.426 60.338 17.325 1.00 49.90 C ATOM 1449 CD2 TRP A 486 80.846 58.822 16.501 1.00 54.00 C ATOM 1450 NE1 TRP A 486 78.716 59.510 16.501 1.00 51.60 N ATOM 1451 CE2 TRP A 486 79.560 58.565 15.984 1.00 54.68 C ATOM 1452 CE3 TRP A 486 81.913 57.985 16.127 1.00 58.49 C ATOM 1453 CZ2 TRP A 486 79.300 57.502 15.111 1.00 56.08 C ATOM 1454 CZ3 TRP A 486 81.662 56.927 15.259 1.00 59.63 C ATOM 1455 CH2 TRP A 486 80.356 56.696 14.758 1.00 56.76 C ATOM 0 H TRP A 486 80.701 62.027 19.848 1.00 43.67 H new ATOM 0 HA TRP A 486 81.569 59.452 19.781 1.00 42.05 H new ATOM 0 HB2 TRP A 486 81.853 61.558 17.922 1.00 45.20 H new ATOM 0 HB3 TRP A 486 82.700 60.256 17.782 1.00 45.20 H new ATOM 0 HD1 TRP A 486 79.068 61.054 17.799 1.00 49.90 H new ATOM 0 HE1 TRP A 486 77.875 59.573 16.334 1.00 51.60 H new ATOM 0 HE3 TRP A 486 82.770 58.136 16.454 1.00 58.49 H new ATOM 0 HZ2 TRP A 486 78.444 57.347 14.782 1.00 56.08 H new ATOM 0 HZ3 TRP A 486 82.358 56.365 15.005 1.00 59.63 H new ATOM 0 HH2 TRP A 486 80.211 55.984 14.178 1.00 56.76 H new ATOM 1456 N LEU A 487 83.906 59.719 20.490 1.00 36.98 N ATOM 1457 CA LEU A 487 85.227 59.844 21.050 1.00 39.26 C ATOM 1458 C LEU A 487 86.270 59.579 19.964 1.00 39.32 C ATOM 1459 O LEU A 487 86.227 58.530 19.301 1.00 35.06 O ATOM 1460 CB LEU A 487 85.403 58.814 22.146 1.00 42.16 C ATOM 1461 CG LEU A 487 84.367 58.936 23.277 1.00 46.71 C ATOM 1462 CD1 LEU A 487 84.554 57.780 24.236 1.00 49.62 C ATOM 1463 CD2 LEU A 487 84.481 60.273 23.984 1.00 46.60 C ATOM 0 H LEU A 487 83.689 58.907 20.306 1.00 36.98 H new ATOM 0 HA LEU A 487 85.340 60.739 21.407 1.00 39.26 H new ATOM 0 HB2 LEU A 487 85.345 57.927 21.758 1.00 42.16 H new ATOM 0 HB3 LEU A 487 86.293 58.901 22.522 1.00 42.16 H new ATOM 0 HG LEU A 487 83.473 58.897 22.903 1.00 46.71 H new ATOM 0 HD11 LEU A 487 83.905 57.847 24.954 1.00 49.62 H new ATOM 0 HD12 LEU A 487 84.427 56.943 23.763 1.00 49.62 H new ATOM 0 HD13 LEU A 487 85.450 57.808 24.607 1.00 49.62 H new ATOM 0 HD21 LEU A 487 83.818 60.323 24.690 1.00 46.60 H new ATOM 0 HD22 LEU A 487 85.368 60.362 24.366 1.00 46.60 H new ATOM 0 HD23 LEU A 487 84.330 60.990 23.348 1.00 46.60 H new ATOM 1464 N TYR A 488 87.230 60.489 19.835 1.00 35.38 N ATOM 1465 CA TYR A 488 88.290 60.374 18.812 1.00 34.76 C ATOM 1466 C TYR A 488 89.670 60.319 19.460 1.00 33.95 C ATOM 1467 O TYR A 488 90.087 61.283 20.089 1.00 36.94 O ATOM 1468 CB TYR A 488 88.209 61.545 17.849 1.00 31.82 C ATOM 1469 CG TYR A 488 86.896 61.634 17.104 1.00 33.64 C ATOM 1470 CD1 TYR A 488 86.637 60.829 15.988 1.00 36.42 C ATOM 1471 CD2 TYR A 488 85.907 62.516 17.517 1.00 36.07 C ATOM 1472 CE1 TYR A 488 85.428 60.914 15.305 1.00 38.16 C ATOM 1473 CE2 TYR A 488 84.698 62.613 16.847 1.00 37.79 C ATOM 1474 CZ TYR A 488 84.458 61.809 15.747 1.00 39.05 C ATOM 1475 OH TYR A 488 83.245 61.930 15.116 1.00 41.40 O ATOM 0 H TYR A 488 87.293 61.189 20.330 1.00 35.38 H new ATOM 0 HA TYR A 488 88.154 59.548 18.322 1.00 34.76 H new ATOM 0 HB2 TYR A 488 88.348 62.369 18.342 1.00 31.82 H new ATOM 0 HB3 TYR A 488 88.932 61.474 17.206 1.00 31.82 H new ATOM 0 HD1 TYR A 488 87.284 60.227 15.698 1.00 36.42 H new ATOM 0 HD2 TYR A 488 86.059 63.054 18.260 1.00 36.07 H new ATOM 0 HE1 TYR A 488 85.270 60.379 14.561 1.00 38.16 H new ATOM 0 HE2 TYR A 488 84.051 63.216 17.135 1.00 37.79 H new ATOM 0 HH TYR A 488 82.943 62.705 15.236 1.00 41.40 H new ATOM 1476 N VAL A 489 90.344 59.183 19.345 1.00 33.90 N ATOM 1477 CA VAL A 489 91.719 59.035 19.840 1.00 37.94 C ATOM 1478 C VAL A 489 92.681 59.211 18.654 1.00 38.04 C ATOM 1479 O VAL A 489 92.718 58.353 17.775 1.00 39.09 O ATOM 1480 CB VAL A 489 91.929 57.660 20.489 1.00 35.82 C ATOM 1481 CG1 VAL A 489 93.332 57.532 21.058 1.00 38.88 C ATOM 1482 CG2 VAL A 489 90.914 57.483 21.599 1.00 38.51 C ATOM 0 H VAL A 489 90.024 58.474 18.979 1.00 33.90 H new ATOM 0 HA VAL A 489 91.890 59.708 20.518 1.00 37.94 H new ATOM 0 HB VAL A 489 91.814 56.974 19.813 1.00 35.82 H new ATOM 0 HG11 VAL A 489 93.439 56.656 21.462 1.00 38.88 H new ATOM 0 HG12 VAL A 489 93.981 57.641 20.346 1.00 38.88 H new ATOM 0 HG13 VAL A 489 93.472 58.217 21.731 1.00 38.88 H new ATOM 0 HG21 VAL A 489 91.038 56.616 22.016 1.00 38.51 H new ATOM 0 HG22 VAL A 489 91.034 58.181 22.262 1.00 38.51 H new ATOM 0 HG23 VAL A 489 90.018 57.539 21.231 1.00 38.51 H new ATOM 1483 N GLY A 490 93.423 60.313 18.624 1.00 35.12 N ATOM 1484 CA GLY A 490 94.311 60.622 17.487 1.00 36.49 C ATOM 1485 C GLY A 490 95.777 60.249 17.682 1.00 36.05 C ATOM 1486 O GLY A 490 96.229 60.018 18.805 1.00 34.98 O ATOM 0 H GLY A 490 93.432 60.902 19.251 1.00 35.12 H new ATOM 0 HA2 GLY A 490 93.978 60.161 16.701 1.00 36.49 H new ATOM 0 HA3 GLY A 490 94.257 61.573 17.303 1.00 36.49 H new ATOM 1487 N MET A 491 96.501 60.159 16.568 1.00 35.52 N ATOM 1488 CA MET A 491 97.968 60.150 16.557 1.00 34.81 C ATOM 1489 C MET A 491 98.423 61.079 15.435 1.00 35.13 C ATOM 1490 O MET A 491 97.580 61.593 14.659 1.00 29.63 O ATOM 1491 CB MET A 491 98.503 58.752 16.337 1.00 36.00 C ATOM 1492 CG MET A 491 98.123 58.156 14.999 1.00 35.45 C ATOM 1493 SD MET A 491 98.890 56.571 14.680 1.00 38.01 S ATOM 1494 CE MET A 491 100.588 57.097 14.394 1.00 38.07 C ATOM 0 H MET A 491 96.151 60.100 15.785 1.00 35.52 H new ATOM 0 HA MET A 491 98.309 60.453 17.413 1.00 34.81 H new ATOM 0 HB2 MET A 491 99.470 58.770 16.411 1.00 36.00 H new ATOM 0 HB3 MET A 491 98.175 58.174 17.044 1.00 36.00 H new ATOM 0 HG2 MET A 491 97.159 58.054 14.960 1.00 35.45 H new ATOM 0 HG3 MET A 491 98.372 58.775 14.295 1.00 35.45 H new ATOM 0 HE1 MET A 491 101.002 56.513 13.739 1.00 38.07 H new ATOM 0 HE2 MET A 491 100.593 58.009 14.062 1.00 38.07 H new ATOM 0 HE3 MET A 491 101.085 57.053 15.226 1.00 38.07 H new ATOM 1495 N CYS A 492 99.743 61.293 15.342 1.00 33.52 N ATOM 1496 CA CYS A 492 100.310 62.210 14.362 1.00 32.11 C ATOM 1497 C CYS A 492 99.818 61.824 12.966 1.00 30.33 C ATOM 1498 O CYS A 492 99.926 60.671 12.587 1.00 28.73 O ATOM 1499 CB CYS A 492 101.840 62.155 14.384 1.00 34.92 C ATOM 1500 SG CYS A 492 102.575 63.470 13.420 1.00 36.69 S ATOM 0 H CYS A 492 100.326 60.910 15.845 1.00 33.52 H new ATOM 0 HA CYS A 492 100.027 63.111 14.584 1.00 32.11 H new ATOM 0 HB2 CYS A 492 102.151 62.215 15.301 1.00 34.92 H new ATOM 0 HB3 CYS A 492 102.137 61.298 14.039 1.00 34.92 H new ATOM 0 HG CYS A 492 102.786 63.079 12.305 1.00 36.69 H new ATOM 1501 N PHE A 493 99.239 62.789 12.252 1.00 30.72 N ATOM 1502 CA PHE A 493 98.743 62.623 10.862 1.00 31.57 C ATOM 1503 C PHE A 493 97.403 61.893 10.702 1.00 32.45 C ATOM 1504 O PHE A 493 96.871 61.848 9.582 1.00 31.88 O ATOM 1505 CB PHE A 493 99.769 61.927 9.922 1.00 30.98 C ATOM 1506 CG PHE A 493 101.127 62.578 9.878 1.00 32.85 C ATOM 1507 CD1 PHE A 493 101.259 63.946 9.703 1.00 32.50 C ATOM 1508 CD2 PHE A 493 102.280 61.799 9.911 1.00 34.15 C ATOM 1509 CE1 PHE A 493 102.514 64.529 9.617 1.00 34.38 C ATOM 1510 CE2 PHE A 493 103.535 62.381 9.823 1.00 33.13 C ATOM 1511 CZ PHE A 493 103.645 63.746 9.684 1.00 33.87 C ATOM 0 H PHE A 493 99.116 63.582 12.561 1.00 30.72 H new ATOM 0 HA PHE A 493 98.606 63.548 10.603 1.00 31.57 H new ATOM 0 HB2 PHE A 493 99.875 61.005 10.205 1.00 30.98 H new ATOM 0 HB3 PHE A 493 99.404 61.907 9.023 1.00 30.98 H new ATOM 0 HD1 PHE A 493 100.499 64.478 9.643 1.00 32.50 H new ATOM 0 HD2 PHE A 493 102.207 60.875 9.993 1.00 34.15 H new ATOM 0 HE1 PHE A 493 102.592 65.450 9.514 1.00 34.38 H new ATOM 0 HE2 PHE A 493 104.299 61.852 9.858 1.00 33.13 H new ATOM 0 HZ PHE A 493 104.486 64.141 9.635 1.00 33.87 H new ATOM 1512 N SER A 494 96.851 61.292 11.757 1.00 32.76 N ATOM 1513 CA SER A 494 95.520 60.690 11.625 1.00 30.80 C ATOM 1514 C SER A 494 94.578 61.825 11.242 1.00 31.28 C ATOM 1515 O SER A 494 94.733 62.944 11.730 1.00 32.37 O ATOM 1516 CB SER A 494 95.093 59.936 12.886 1.00 31.15 C ATOM 1517 OG SER A 494 94.853 60.802 13.952 1.00 30.84 O ATOM 0 H SER A 494 97.214 61.222 12.533 1.00 32.76 H new ATOM 0 HA SER A 494 95.509 60.004 10.939 1.00 30.80 H new ATOM 0 HB2 SER A 494 94.291 59.423 12.700 1.00 31.15 H new ATOM 0 HB3 SER A 494 95.785 59.302 13.134 1.00 31.15 H new ATOM 0 HG SER A 494 95.564 61.201 14.155 1.00 30.84 H new ATOM 1518 N SER A 495 93.685 61.580 10.287 1.00 30.22 N ATOM 1519 CA SER A 495 92.950 62.671 9.677 1.00 33.79 C ATOM 1520 C SER A 495 91.482 62.382 9.530 1.00 31.55 C ATOM 1521 O SER A 495 91.062 61.256 9.457 1.00 28.86 O ATOM 1522 CB SER A 495 93.514 63.024 8.289 1.00 36.58 C ATOM 1523 OG SER A 495 93.669 61.854 7.534 1.00 46.48 O ATOM 0 H SER A 495 93.495 60.798 9.984 1.00 30.22 H new ATOM 0 HA SER A 495 93.058 63.420 10.283 1.00 33.79 H new ATOM 0 HB2 SER A 495 92.916 63.637 7.833 1.00 36.58 H new ATOM 0 HB3 SER A 495 94.367 63.476 8.382 1.00 36.58 H new ATOM 0 HG SER A 495 93.975 62.048 6.776 1.00 46.48 H new ATOM 1524 N PHE A 496 90.726 63.451 9.441 1.00 30.84 N ATOM 1525 CA PHE A 496 89.349 63.347 9.113 1.00 31.95 C ATOM 1526 C PHE A 496 89.134 64.035 7.772 1.00 30.32 C ATOM 1527 O PHE A 496 89.514 65.199 7.592 1.00 31.04 O ATOM 1528 CB PHE A 496 88.437 63.871 10.226 1.00 30.36 C ATOM 1529 CG PHE A 496 88.785 65.241 10.771 1.00 30.27 C ATOM 1530 CD1 PHE A 496 89.840 65.406 11.680 1.00 31.72 C ATOM 1531 CD2 PHE A 496 87.985 66.338 10.481 1.00 29.88 C ATOM 1532 CE1 PHE A 496 90.124 66.655 12.226 1.00 30.60 C ATOM 1533 CE2 PHE A 496 88.250 67.579 11.041 1.00 31.71 C ATOM 1534 CZ PHE A 496 89.339 67.743 11.897 1.00 31.68 C ATOM 0 H PHE A 496 91.005 64.254 9.571 1.00 30.84 H new ATOM 0 HA PHE A 496 89.098 62.414 9.030 1.00 31.95 H new ATOM 0 HB2 PHE A 496 87.527 63.896 9.891 1.00 30.36 H new ATOM 0 HB3 PHE A 496 88.452 63.236 10.959 1.00 30.36 H new ATOM 0 HD1 PHE A 496 90.357 64.671 11.921 1.00 31.72 H new ATOM 0 HD2 PHE A 496 87.262 66.240 9.904 1.00 29.88 H new ATOM 0 HE1 PHE A 496 90.840 66.756 12.811 1.00 30.60 H new ATOM 0 HE2 PHE A 496 87.700 68.303 10.845 1.00 31.71 H new ATOM 0 HZ PHE A 496 89.536 68.583 12.245 1.00 31.68 H new ATOM 1535 N CYS A 497 88.483 63.305 6.862 1.00 30.98 N ATOM 1536 CA CYS A 497 88.202 63.758 5.500 1.00 29.73 C ATOM 1537 C CYS A 497 87.183 64.845 5.473 1.00 28.79 C ATOM 1538 O CYS A 497 86.460 65.022 6.438 1.00 30.96 O ATOM 1539 CB CYS A 497 87.754 62.586 4.649 1.00 33.05 C ATOM 1540 SG CYS A 497 89.049 61.339 4.512 1.00 37.32 S ATOM 0 H CYS A 497 88.186 62.514 7.025 1.00 30.98 H new ATOM 0 HA CYS A 497 89.021 64.126 5.134 1.00 29.73 H new ATOM 0 HB2 CYS A 497 86.959 62.188 5.037 1.00 33.05 H new ATOM 0 HB3 CYS A 497 87.511 62.901 3.764 1.00 33.05 H new ATOM 0 HG CYS A 497 88.738 60.528 3.684 1.00 37.32 H new ATOM 1541 N TRP A 498 87.175 65.609 4.387 1.00 27.32 N ATOM 1542 CA TRP A 498 86.215 66.675 4.170 1.00 29.96 C ATOM 1543 C TRP A 498 84.775 66.148 4.277 1.00 33.22 C ATOM 1544 O TRP A 498 84.428 65.179 3.619 1.00 30.72 O ATOM 1545 CB TRP A 498 86.394 67.280 2.795 1.00 31.19 C ATOM 1546 CG TRP A 498 87.571 68.209 2.671 1.00 31.57 C ATOM 1547 CD1 TRP A 498 88.776 67.961 2.056 1.00 32.35 C ATOM 1548 CD2 TRP A 498 87.635 69.531 3.166 1.00 30.79 C ATOM 1549 NE1 TRP A 498 89.583 69.076 2.147 1.00 31.33 N ATOM 1550 CE2 TRP A 498 88.905 70.053 2.820 1.00 31.06 C ATOM 1551 CE3 TRP A 498 86.743 70.335 3.873 1.00 30.56 C ATOM 1552 CZ2 TRP A 498 89.294 71.325 3.170 1.00 30.27 C ATOM 1553 CZ3 TRP A 498 87.122 71.615 4.213 1.00 31.66 C ATOM 1554 CH2 TRP A 498 88.398 72.097 3.866 1.00 31.93 C ATOM 0 H TRP A 498 87.740 65.518 3.745 1.00 27.32 H new ATOM 0 HA TRP A 498 86.370 67.346 4.853 1.00 29.96 H new ATOM 0 HB2 TRP A 498 86.493 66.563 2.149 1.00 31.19 H new ATOM 0 HB3 TRP A 498 85.587 67.765 2.560 1.00 31.19 H new ATOM 0 HD1 TRP A 498 89.011 67.162 1.642 1.00 32.35 H new ATOM 0 HE1 TRP A 498 90.380 69.145 1.832 1.00 31.33 H new ATOM 0 HE3 TRP A 498 85.904 70.012 4.112 1.00 30.56 H new ATOM 0 HZ2 TRP A 498 90.135 71.651 2.943 1.00 30.27 H new ATOM 0 HZ3 TRP A 498 86.531 72.164 4.675 1.00 31.66 H new ATOM 0 HH2 TRP A 498 88.640 72.960 4.115 1.00 31.93 H new ATOM 1555 N HIS A 499 83.964 66.777 5.114 1.00 31.91 N ATOM 1556 CA HIS A 499 82.568 66.379 5.235 1.00 33.21 C ATOM 1557 C HIS A 499 81.787 67.484 5.853 1.00 33.76 C ATOM 1558 O HIS A 499 82.346 68.474 6.354 1.00 30.66 O ATOM 1559 CB HIS A 499 82.420 65.106 6.074 1.00 33.23 C ATOM 1560 CG HIS A 499 82.783 65.288 7.514 1.00 37.06 C ATOM 1561 ND1 HIS A 499 84.092 65.344 7.950 1.00 36.54 N ATOM 1562 CD2 HIS A 499 82.012 65.455 8.615 1.00 36.53 C ATOM 1563 CE1 HIS A 499 84.110 65.524 9.257 1.00 38.77 C ATOM 1564 NE2 HIS A 499 82.860 65.607 9.683 1.00 39.59 N ATOM 0 H HIS A 499 84.198 67.433 5.619 1.00 31.91 H new ATOM 0 HA HIS A 499 82.228 66.192 4.346 1.00 33.21 H new ATOM 0 HB2 HIS A 499 81.503 64.796 6.017 1.00 33.23 H new ATOM 0 HB3 HIS A 499 82.979 64.411 5.693 1.00 33.23 H new ATOM 0 HD1 HIS A 499 84.787 65.273 7.448 1.00 36.54 H new ATOM 0 HD2 HIS A 499 81.082 65.465 8.642 1.00 36.53 H new ATOM 0 HE1 HIS A 499 84.871 65.583 9.788 1.00 38.77 H new ATOM 1565 N ILE A 500 80.479 67.294 5.809 1.00 32.05 N ATOM 1566 CA ILE A 500 79.522 68.095 6.572 1.00 30.85 C ATOM 1567 C ILE A 500 78.742 67.116 7.429 1.00 28.89 C ATOM 1568 O ILE A 500 78.870 65.898 7.257 1.00 30.15 O ATOM 1569 CB ILE A 500 78.601 68.909 5.679 1.00 32.74 C ATOM 1570 CG1 ILE A 500 77.979 68.011 4.577 1.00 33.73 C ATOM 1571 CG2 ILE A 500 79.367 70.072 5.081 1.00 33.63 C ATOM 1572 CD1 ILE A 500 76.976 68.733 3.728 1.00 33.94 C ATOM 0 H ILE A 500 80.110 66.685 5.327 1.00 32.05 H new ATOM 0 HA ILE A 500 79.987 68.751 7.115 1.00 30.85 H new ATOM 0 HB ILE A 500 77.871 69.265 6.210 1.00 32.74 H new ATOM 0 HG12 ILE A 500 78.687 67.667 4.010 1.00 33.73 H new ATOM 0 HG13 ILE A 500 77.552 67.246 4.993 1.00 33.73 H new ATOM 0 HG21 ILE A 500 78.777 70.590 4.511 1.00 33.63 H new ATOM 0 HG22 ILE A 500 79.706 70.637 5.793 1.00 33.63 H new ATOM 0 HG23 ILE A 500 80.109 69.735 4.555 1.00 33.63 H new ATOM 0 HD11 ILE A 500 76.621 68.126 3.059 1.00 33.94 H new ATOM 0 HD12 ILE A 500 76.252 69.057 4.287 1.00 33.94 H new ATOM 0 HD13 ILE A 500 77.405 69.484 3.288 1.00 33.94 H new ATOM 1573 N GLU A 501 77.992 67.627 8.400 1.00 31.15 N ATOM 1574 CA GLU A 501 77.320 66.727 9.350 1.00 33.89 C ATOM 1575 C GLU A 501 75.975 66.226 8.770 1.00 31.01 C ATOM 1576 O GLU A 501 75.399 66.835 7.886 1.00 31.52 O ATOM 1577 CB GLU A 501 77.118 67.385 10.707 1.00 34.05 C ATOM 1578 CG GLU A 501 78.349 68.010 11.340 1.00 35.69 C ATOM 1579 CD GLU A 501 79.515 67.061 11.511 1.00 35.05 C ATOM 1580 OE1 GLU A 501 79.302 65.921 11.932 1.00 34.67 O ATOM 1581 OE2 GLU A 501 80.658 67.473 11.230 1.00 37.15 O ATOM 0 H GLU A 501 77.858 68.467 8.530 1.00 31.15 H new ATOM 0 HA GLU A 501 77.899 65.961 9.487 1.00 33.89 H new ATOM 0 HB2 GLU A 501 76.440 68.073 10.614 1.00 34.05 H new ATOM 0 HB3 GLU A 501 76.765 66.720 11.319 1.00 34.05 H new ATOM 0 HG2 GLU A 501 78.634 68.760 10.795 1.00 35.69 H new ATOM 0 HG3 GLU A 501 78.107 68.367 12.209 1.00 35.69 H new ATOM 1582 N ASP A 502 75.528 65.089 9.254 1.00 34.34 N ATOM 1583 CA ASP A 502 74.209 64.551 8.892 1.00 37.09 C ATOM 1584 C ASP A 502 73.129 65.576 9.173 1.00 34.61 C ATOM 1585 O ASP A 502 73.152 66.232 10.203 1.00 35.62 O ATOM 1586 CB ASP A 502 73.937 63.269 9.665 1.00 41.36 C ATOM 1587 CG ASP A 502 74.846 62.135 9.237 1.00 40.23 C ATOM 1588 OD1 ASP A 502 75.415 62.227 8.135 1.00 42.98 O ATOM 1589 OD2 ASP A 502 74.986 61.161 10.007 1.00 46.68 O ATOM 0 H ASP A 502 75.971 64.597 9.803 1.00 34.34 H new ATOM 0 HA ASP A 502 74.203 64.349 7.943 1.00 37.09 H new ATOM 0 HB2 ASP A 502 74.055 63.435 10.613 1.00 41.36 H new ATOM 0 HB3 ASP A 502 73.012 63.006 9.536 1.00 41.36 H new ATOM 1590 N HIS A 503 72.238 65.761 8.204 1.00 34.04 N ATOM 1591 CA HIS A 503 71.161 66.756 8.259 1.00 32.73 C ATOM 1592 C HIS A 503 71.654 68.174 8.386 1.00 33.75 C ATOM 1593 O HIS A 503 70.920 69.080 8.816 1.00 32.14 O ATOM 1594 CB HIS A 503 70.158 66.403 9.339 1.00 34.16 C ATOM 1595 CG HIS A 503 69.341 65.215 8.985 1.00 37.18 C ATOM 1596 ND1 HIS A 503 68.001 65.317 8.688 1.00 36.16 N ATOM 1597 CD2 HIS A 503 69.678 63.920 8.791 1.00 36.71 C ATOM 1598 CE1 HIS A 503 67.535 64.125 8.377 1.00 37.09 C ATOM 1599 NE2 HIS A 503 68.527 63.261 8.436 1.00 39.82 N ATOM 0 H HIS A 503 72.240 65.302 7.477 1.00 34.04 H new ATOM 0 HA HIS A 503 70.710 66.722 7.401 1.00 32.73 H new ATOM 0 HB2 HIS A 503 70.628 66.233 10.170 1.00 34.16 H new ATOM 0 HB3 HIS A 503 69.573 67.161 9.494 1.00 34.16 H new ATOM 0 HD1 HIS A 503 67.541 66.044 8.703 1.00 36.16 H new ATOM 0 HD2 HIS A 503 70.525 63.548 8.881 1.00 36.71 H new ATOM 0 HE1 HIS A 503 66.654 63.927 8.154 1.00 37.09 H new ATOM 1600 N TRP A 504 72.884 68.393 7.924 1.00 34.52 N ATOM 1601 CA TRP A 504 73.537 69.697 8.054 1.00 30.75 C ATOM 1602 C TRP A 504 73.463 70.260 9.470 1.00 27.93 C ATOM 1603 O TRP A 504 73.284 71.449 9.659 1.00 31.18 O ATOM 1604 CB TRP A 504 72.942 70.702 7.082 1.00 31.95 C ATOM 1605 CG TRP A 504 73.015 70.309 5.617 1.00 31.48 C ATOM 1606 CD1 TRP A 504 73.684 69.253 5.070 1.00 32.11 C ATOM 1607 CD2 TRP A 504 72.392 70.990 4.536 1.00 29.98 C ATOM 1608 NE1 TRP A 504 73.522 69.246 3.712 1.00 31.21 N ATOM 1609 CE2 TRP A 504 72.730 70.307 3.359 1.00 31.26 C ATOM 1610 CE3 TRP A 504 71.570 72.118 4.451 1.00 34.26 C ATOM 1611 CZ2 TRP A 504 72.272 70.714 2.089 1.00 32.52 C ATOM 1612 CZ3 TRP A 504 71.142 72.545 3.196 1.00 33.60 C ATOM 1613 CH2 TRP A 504 71.484 71.833 2.037 1.00 34.19 C ATOM 0 H TRP A 504 73.361 67.796 7.529 1.00 34.52 H new ATOM 0 HA TRP A 504 74.472 69.549 7.843 1.00 30.75 H new ATOM 0 HB2 TRP A 504 72.012 70.846 7.317 1.00 31.95 H new ATOM 0 HB3 TRP A 504 73.398 71.550 7.197 1.00 31.95 H new ATOM 0 HD1 TRP A 504 74.178 68.629 5.551 1.00 32.11 H new ATOM 0 HE1 TRP A 504 73.861 68.671 3.170 1.00 31.21 H new ATOM 0 HE3 TRP A 504 71.313 72.575 5.219 1.00 34.26 H new ATOM 0 HZ2 TRP A 504 72.496 70.243 1.319 1.00 32.52 H new ATOM 0 HZ3 TRP A 504 70.622 73.313 3.126 1.00 33.60 H new ATOM 0 HH2 TRP A 504 71.168 72.128 1.213 1.00 34.19 H new ATOM 1614 N SER A 505 73.578 69.409 10.470 1.00 30.64 N ATOM 1615 CA SER A 505 73.588 69.889 11.859 1.00 34.13 C ATOM 1616 C SER A 505 74.908 70.610 12.179 1.00 37.24 C ATOM 1617 O SER A 505 75.868 70.547 11.390 1.00 32.87 O ATOM 1618 CB SER A 505 73.411 68.749 12.832 1.00 33.23 C ATOM 1619 OG SER A 505 74.409 67.764 12.695 1.00 37.13 O ATOM 0 H SER A 505 73.651 68.557 10.380 1.00 30.64 H new ATOM 0 HA SER A 505 72.847 70.508 11.952 1.00 34.13 H new ATOM 0 HB2 SER A 505 73.425 69.096 13.738 1.00 33.23 H new ATOM 0 HB3 SER A 505 72.540 68.344 12.696 1.00 33.23 H new ATOM 0 HG SER A 505 74.209 67.249 12.062 1.00 37.13 H new ATOM 1620 N TYR A 506 74.915 71.295 13.322 1.00 35.74 N ATOM 1621 CA TYR A 506 76.153 71.786 13.941 1.00 35.63 C ATOM 1622 C TYR A 506 76.917 70.598 14.488 1.00 34.26 C ATOM 1623 O TYR A 506 76.326 69.561 14.751 1.00 35.31 O ATOM 1624 CB TYR A 506 75.883 72.696 15.132 1.00 33.42 C ATOM 1625 CG TYR A 506 75.246 74.022 14.890 1.00 34.68 C ATOM 1626 CD1 TYR A 506 73.873 74.129 14.617 1.00 34.84 C ATOM 1627 CD2 TYR A 506 75.967 75.199 15.059 1.00 35.92 C ATOM 1628 CE1 TYR A 506 73.269 75.359 14.463 1.00 35.03 C ATOM 1629 CE2 TYR A 506 75.355 76.442 14.903 1.00 37.04 C ATOM 1630 CZ TYR A 506 74.000 76.522 14.614 1.00 38.93 C ATOM 1631 OH TYR A 506 73.383 77.768 14.455 1.00 42.24 O ATOM 0 H TYR A 506 74.203 71.490 13.763 1.00 35.74 H new ATOM 0 HA TYR A 506 76.639 72.277 13.261 1.00 35.63 H new ATOM 0 HB2 TYR A 506 75.320 72.208 15.753 1.00 33.42 H new ATOM 0 HB3 TYR A 506 76.729 72.853 15.580 1.00 33.42 H new ATOM 0 HD1 TYR A 506 73.362 73.356 14.539 1.00 34.84 H new ATOM 0 HD2 TYR A 506 76.870 75.156 15.279 1.00 35.92 H new ATOM 0 HE1 TYR A 506 72.364 75.406 14.256 1.00 35.03 H new ATOM 0 HE2 TYR A 506 75.856 77.220 14.993 1.00 37.04 H new ATOM 0 HH TYR A 506 73.884 78.370 14.758 1.00 42.24 H new ATOM 1632 N SER A 507 78.245 70.731 14.641 1.00 34.67 N ATOM 1633 CA SER A 507 78.995 69.858 15.546 1.00 32.33 C ATOM 1634 C SER A 507 79.760 70.741 16.527 1.00 31.35 C ATOM 1635 O SER A 507 80.014 71.897 16.274 1.00 30.34 O ATOM 1636 CB SER A 507 79.960 68.891 14.856 1.00 36.31 C ATOM 1637 OG SER A 507 80.920 69.601 14.093 1.00 38.27 O ATOM 0 H SER A 507 78.722 71.317 14.231 1.00 34.67 H new ATOM 0 HA SER A 507 78.347 69.290 15.991 1.00 32.33 H new ATOM 0 HB2 SER A 507 80.408 68.345 15.521 1.00 36.31 H new ATOM 0 HB3 SER A 507 79.464 68.288 14.280 1.00 36.31 H new ATOM 0 HG SER A 507 81.526 69.075 13.846 1.00 38.27 H new ATOM 1638 N ILE A 508 80.096 70.162 17.659 1.00 33.77 N ATOM 1639 CA ILE A 508 80.908 70.830 18.654 1.00 34.58 C ATOM 1640 C ILE A 508 81.840 69.779 19.167 1.00 32.22 C ATOM 1641 O ILE A 508 81.425 68.651 19.419 1.00 31.71 O ATOM 1642 CB ILE A 508 80.092 71.466 19.794 1.00 37.89 C ATOM 1643 CG1 ILE A 508 81.044 72.212 20.746 1.00 38.51 C ATOM 1644 CG2 ILE A 508 79.248 70.410 20.515 1.00 37.66 C ATOM 1645 CD1 ILE A 508 80.392 73.206 21.671 1.00 37.72 C ATOM 0 H ILE A 508 79.859 69.364 17.876 1.00 33.77 H new ATOM 0 HA ILE A 508 81.376 71.581 18.258 1.00 34.58 H new ATOM 0 HB ILE A 508 79.467 72.112 19.429 1.00 37.89 H new ATOM 0 HG12 ILE A 508 81.518 71.557 21.283 1.00 38.51 H new ATOM 0 HG13 ILE A 508 81.709 72.677 20.214 1.00 38.51 H new ATOM 0 HG21 ILE A 508 78.743 70.831 21.228 1.00 37.66 H new ATOM 0 HG22 ILE A 508 78.636 69.999 19.885 1.00 37.66 H new ATOM 0 HG23 ILE A 508 79.830 69.731 20.889 1.00 37.66 H new ATOM 0 HD11 ILE A 508 81.068 73.622 22.228 1.00 37.72 H new ATOM 0 HD12 ILE A 508 79.941 73.887 21.148 1.00 37.72 H new ATOM 0 HD13 ILE A 508 79.747 72.750 22.233 1.00 37.72 H new ATOM 1646 N ASN A 509 83.119 70.152 19.246 1.00 32.56 N ATOM 1647 CA ASN A 509 84.206 69.225 19.495 1.00 31.80 C ATOM 1648 C ASN A 509 85.110 69.844 20.570 1.00 29.86 C ATOM 1649 O ASN A 509 85.518 71.002 20.466 1.00 32.27 O ATOM 1650 CB ASN A 509 84.969 69.047 18.176 1.00 33.00 C ATOM 1651 CG ASN A 509 86.123 68.070 18.277 1.00 34.77 C ATOM 1652 OD1 ASN A 509 87.018 68.212 19.121 1.00 32.72 O ATOM 1653 ND2 ASN A 509 86.123 67.075 17.397 1.00 34.86 N ATOM 0 H ASN A 509 83.376 70.967 19.154 1.00 32.56 H new ATOM 0 HA ASN A 509 83.892 68.361 19.804 1.00 31.80 H new ATOM 0 HB2 ASN A 509 84.353 68.740 17.492 1.00 33.00 H new ATOM 0 HB3 ASN A 509 85.308 69.909 17.887 1.00 33.00 H new ATOM 0 HD21 ASN A 509 86.761 66.499 17.400 1.00 34.86 H new ATOM 0 HD22 ASN A 509 85.485 67.007 16.825 1.00 34.86 H new ATOM 1654 N TYR A 510 85.404 69.052 21.582 1.00 33.94 N ATOM 1655 CA TYR A 510 86.255 69.436 22.690 1.00 34.50 C ATOM 1656 C TYR A 510 87.436 68.500 22.696 1.00 32.93 C ATOM 1657 O TYR A 510 87.270 67.260 22.683 1.00 33.62 O ATOM 1658 CB TYR A 510 85.508 69.284 24.024 1.00 35.68 C ATOM 1659 CG TYR A 510 86.267 69.772 25.242 1.00 33.82 C ATOM 1660 CD1 TYR A 510 86.527 71.125 25.409 1.00 34.64 C ATOM 1661 CD2 TYR A 510 86.728 68.888 26.211 1.00 35.77 C ATOM 1662 CE1 TYR A 510 87.190 71.594 26.518 1.00 35.91 C ATOM 1663 CE2 TYR A 510 87.410 69.359 27.339 1.00 37.00 C ATOM 1664 CZ TYR A 510 87.631 70.713 27.469 1.00 35.72 C ATOM 1665 OH TYR A 510 88.277 71.237 28.552 1.00 40.54 O ATOM 0 H TYR A 510 85.104 68.249 21.646 1.00 33.94 H new ATOM 0 HA TYR A 510 86.527 70.362 22.589 1.00 34.50 H new ATOM 0 HB2 TYR A 510 84.669 69.768 23.967 1.00 35.68 H new ATOM 0 HB3 TYR A 510 85.287 68.348 24.151 1.00 35.68 H new ATOM 0 HD1 TYR A 510 86.247 71.727 24.757 1.00 34.64 H new ATOM 0 HD2 TYR A 510 86.582 67.975 26.109 1.00 35.77 H new ATOM 0 HE1 TYR A 510 87.338 72.506 26.622 1.00 35.91 H new ATOM 0 HE2 TYR A 510 87.709 68.767 27.991 1.00 37.00 H new ATOM 0 HH TYR A 510 88.503 70.616 29.071 1.00 40.54 H new ATOM 1666 N LEU A 511 88.629 69.093 22.725 1.00 33.89 N ATOM 1667 CA LEU A 511 89.859 68.318 22.865 1.00 31.98 C ATOM 1668 C LEU A 511 90.155 68.213 24.344 1.00 33.60 C ATOM 1669 O LEU A 511 90.484 69.227 24.960 1.00 33.85 O ATOM 1670 CB LEU A 511 91.014 68.998 22.131 1.00 32.45 C ATOM 1671 CG LEU A 511 92.280 68.159 22.022 1.00 33.72 C ATOM 1672 CD1 LEU A 511 92.029 66.858 21.274 1.00 35.89 C ATOM 1673 CD2 LEU A 511 93.343 68.963 21.303 1.00 37.90 C ATOM 0 H LEU A 511 88.747 69.943 22.665 1.00 33.89 H new ATOM 0 HA LEU A 511 89.753 67.437 22.474 1.00 31.98 H new ATOM 0 HB2 LEU A 511 90.719 69.234 21.238 1.00 32.45 H new ATOM 0 HB3 LEU A 511 91.228 69.827 22.587 1.00 32.45 H new ATOM 0 HG LEU A 511 92.575 67.932 22.918 1.00 33.72 H new ATOM 0 HD11 LEU A 511 92.854 66.350 21.223 1.00 35.89 H new ATOM 0 HD12 LEU A 511 91.358 66.339 21.744 1.00 35.89 H new ATOM 0 HD13 LEU A 511 91.715 67.055 20.378 1.00 35.89 H new ATOM 0 HD21 LEU A 511 94.154 68.435 21.229 1.00 37.90 H new ATOM 0 HD22 LEU A 511 93.028 69.196 20.416 1.00 37.90 H new ATOM 0 HD23 LEU A 511 93.530 69.773 21.803 1.00 37.90 H new ATOM 1674 N HIS A 512 90.035 67.011 24.915 1.00 34.41 N ATOM 1675 CA HIS A 512 90.234 66.813 26.365 1.00 37.71 C ATOM 1676 C HIS A 512 91.718 66.978 26.764 1.00 38.77 C ATOM 1677 O HIS A 512 92.019 67.621 27.752 1.00 34.84 O ATOM 1678 CB HIS A 512 89.749 65.430 26.807 1.00 37.60 C ATOM 1679 CG HIS A 512 88.259 65.311 26.853 1.00 43.90 C ATOM 1680 ND1 HIS A 512 87.509 65.868 27.865 1.00 44.12 N ATOM 1681 CD2 HIS A 512 87.379 64.716 26.012 1.00 42.37 C ATOM 1682 CE1 HIS A 512 86.229 65.622 27.645 1.00 46.43 C ATOM 1683 NE2 HIS A 512 86.124 64.923 26.530 1.00 45.46 N ATOM 0 H HIS A 512 89.839 66.293 24.484 1.00 34.41 H new ATOM 0 HA HIS A 512 89.710 67.496 26.813 1.00 37.71 H new ATOM 0 HB2 HIS A 512 90.102 64.761 26.199 1.00 37.60 H new ATOM 0 HB3 HIS A 512 90.110 65.233 27.686 1.00 37.60 H new ATOM 0 HD2 HIS A 512 87.586 64.255 25.231 1.00 42.37 H new ATOM 0 HE1 HIS A 512 85.522 65.895 28.184 1.00 46.43 H new ATOM 0 HE2 HIS A 512 85.388 64.643 26.184 1.00 45.46 H new ATOM 1684 N TRP A 513 92.616 66.371 25.992 1.00 37.53 N ATOM 1685 CA TRP A 513 94.051 66.473 26.239 1.00 38.42 C ATOM 1686 C TRP A 513 94.857 65.991 25.036 1.00 37.46 C ATOM 1687 O TRP A 513 94.319 65.334 24.110 1.00 35.27 O ATOM 1688 CB TRP A 513 94.455 65.643 27.481 1.00 39.10 C ATOM 1689 CG TRP A 513 93.978 64.275 27.485 1.00 40.57 C ATOM 1690 CD1 TRP A 513 92.846 63.789 28.116 1.00 45.20 C ATOM 1691 CD2 TRP A 513 94.584 63.157 26.841 1.00 46.32 C ATOM 1692 NE1 TRP A 513 92.725 62.442 27.892 1.00 44.18 N ATOM 1693 CE2 TRP A 513 93.769 62.028 27.108 1.00 45.58 C ATOM 1694 CE3 TRP A 513 95.726 62.999 26.038 1.00 49.77 C ATOM 1695 CZ2 TRP A 513 94.071 60.762 26.621 1.00 49.77 C ATOM 1696 CZ3 TRP A 513 96.031 61.744 25.550 1.00 49.74 C ATOM 1697 CH2 TRP A 513 95.202 60.632 25.844 1.00 50.56 C ATOM 0 H TRP A 513 92.410 65.889 25.310 1.00 37.53 H new ATOM 0 HA TRP A 513 94.248 67.410 26.396 1.00 38.42 H new ATOM 0 HB2 TRP A 513 95.423 65.634 27.546 1.00 39.10 H new ATOM 0 HB3 TRP A 513 94.121 66.090 28.275 1.00 39.10 H new ATOM 0 HD1 TRP A 513 92.254 64.301 28.618 1.00 45.20 H new ATOM 0 HE1 TRP A 513 92.096 61.939 28.194 1.00 44.18 H new ATOM 0 HE3 TRP A 513 96.268 63.728 25.838 1.00 49.77 H new ATOM 0 HZ2 TRP A 513 93.530 60.030 26.812 1.00 49.77 H new ATOM 0 HZ3 TRP A 513 96.788 61.627 25.023 1.00 49.74 H new ATOM 0 HH2 TRP A 513 95.427 59.796 25.505 1.00 50.56 H new ATOM 1698 N GLY A 514 96.152 66.287 25.109 1.00 33.66 N ATOM 1699 CA GLY A 514 97.162 65.785 24.203 1.00 33.56 C ATOM 1700 C GLY A 514 97.516 66.875 23.246 1.00 31.58 C ATOM 1701 O GLY A 514 97.223 68.054 23.502 1.00 33.18 O ATOM 0 H GLY A 514 96.472 66.807 25.714 1.00 33.66 H new ATOM 0 HA2 GLY A 514 97.947 65.500 24.696 1.00 33.56 H new ATOM 0 HA3 GLY A 514 96.831 65.009 23.724 1.00 33.56 H new ATOM 1702 N GLU A 515 98.133 66.486 22.135 1.00 31.40 N ATOM 1703 CA GLU A 515 98.635 67.453 21.153 1.00 32.15 C ATOM 1704 C GLU A 515 97.519 67.992 20.263 1.00 31.24 C ATOM 1705 O GLU A 515 96.491 67.354 20.158 1.00 31.64 O ATOM 1706 CB GLU A 515 99.756 66.823 20.328 1.00 34.76 C ATOM 1707 CG GLU A 515 100.953 66.499 21.232 1.00 39.08 C ATOM 1708 CD GLU A 515 102.192 66.068 20.483 1.00 39.57 C ATOM 1709 OE1 GLU A 515 102.342 64.871 20.203 1.00 40.11 O ATOM 1710 OE2 GLU A 515 103.025 66.935 20.191 1.00 43.00 O ATOM 0 H GLU A 515 98.273 65.663 21.927 1.00 31.40 H new ATOM 0 HA GLU A 515 98.995 68.214 21.634 1.00 32.15 H new ATOM 0 HB2 GLU A 515 99.437 66.014 19.899 1.00 34.76 H new ATOM 0 HB3 GLU A 515 100.029 67.430 19.622 1.00 34.76 H new ATOM 0 HG2 GLU A 515 101.165 67.281 21.765 1.00 39.08 H new ATOM 0 HG3 GLU A 515 100.699 65.795 21.849 1.00 39.08 H new ATOM 1711 N PRO A 516 97.724 69.164 19.628 1.00 31.46 N ATOM 1712 CA PRO A 516 96.612 69.814 18.947 1.00 30.60 C ATOM 1713 C PRO A 516 96.000 69.045 17.765 1.00 31.26 C ATOM 1714 O PRO A 516 96.589 68.085 17.254 1.00 29.32 O ATOM 1715 CB PRO A 516 97.205 71.148 18.447 1.00 30.89 C ATOM 1716 CG PRO A 516 98.405 71.394 19.312 1.00 32.66 C ATOM 1717 CD PRO A 516 98.924 70.038 19.697 1.00 31.27 C ATOM 0 HA PRO A 516 95.870 69.895 19.566 1.00 30.60 H new ATOM 0 HB2 PRO A 516 97.453 71.092 17.511 1.00 30.89 H new ATOM 0 HB3 PRO A 516 96.562 71.869 18.527 1.00 30.89 H new ATOM 0 HG2 PRO A 516 99.080 71.901 18.834 1.00 32.66 H new ATOM 0 HG3 PRO A 516 98.166 71.910 20.098 1.00 32.66 H new ATOM 0 HD2 PRO A 516 99.618 69.737 19.090 1.00 31.27 H new ATOM 0 HD3 PRO A 516 99.309 70.044 20.587 1.00 31.27 H new ATOM 1718 N LYS A 517 94.793 69.479 17.391 1.00 29.45 N ATOM 1719 CA LYS A 517 94.083 69.011 16.208 1.00 28.69 C ATOM 1720 C LYS A 517 94.054 70.193 15.270 1.00 27.01 C ATOM 1721 O LYS A 517 93.574 71.267 15.644 1.00 28.89 O ATOM 1722 CB LYS A 517 92.639 68.599 16.590 1.00 31.33 C ATOM 1723 CG LYS A 517 91.843 67.969 15.448 1.00 33.83 C ATOM 1724 CD LYS A 517 90.422 67.488 15.800 1.00 35.13 C ATOM 1725 CE LYS A 517 90.269 66.524 16.966 1.00 35.65 C ATOM 1726 NZ LYS A 517 90.572 65.124 16.681 1.00 37.01 N ATOM 0 H LYS A 517 94.356 70.072 17.835 1.00 29.45 H new ATOM 0 HA LYS A 517 94.510 68.239 15.805 1.00 28.69 H new ATOM 0 HB2 LYS A 517 92.677 67.971 17.328 1.00 31.33 H new ATOM 0 HB3 LYS A 517 92.164 69.382 16.908 1.00 31.33 H new ATOM 0 HG2 LYS A 517 91.777 68.616 14.728 1.00 33.83 H new ATOM 0 HG3 LYS A 517 92.346 67.213 15.106 1.00 33.83 H new ATOM 0 HD2 LYS A 517 89.880 68.270 15.987 1.00 35.13 H new ATOM 0 HD3 LYS A 517 90.047 67.065 15.012 1.00 35.13 H new ATOM 0 HE2 LYS A 517 90.846 66.821 17.687 1.00 35.65 H new ATOM 0 HE3 LYS A 517 89.357 66.580 17.291 1.00 35.65 H new ATOM 0 HZ1 LYS A 517 90.554 64.656 17.438 1.00 37.01 H new ATOM 0 HZ2 LYS A 517 89.966 64.798 16.117 1.00 37.01 H new ATOM 0 HZ3 LYS A 517 91.381 65.064 16.315 1.00 37.01 H new ATOM 1727 N THR A 518 94.521 70.002 14.042 1.00 26.42 N ATOM 1728 CA THR A 518 94.488 71.059 13.043 1.00 28.09 C ATOM 1729 C THR A 518 93.239 70.874 12.190 1.00 28.19 C ATOM 1730 O THR A 518 92.984 69.773 11.733 1.00 30.05 O ATOM 1731 CB THR A 518 95.753 71.009 12.158 1.00 28.49 C ATOM 1732 OG1 THR A 518 96.907 71.279 12.972 1.00 30.15 O ATOM 1733 CG2 THR A 518 95.667 72.001 11.055 1.00 28.66 C ATOM 0 H THR A 518 94.863 69.262 13.767 1.00 26.42 H new ATOM 0 HA THR A 518 94.466 71.924 13.481 1.00 28.09 H new ATOM 0 HB THR A 518 95.827 70.126 11.763 1.00 28.49 H new ATOM 0 HG1 THR A 518 96.893 72.081 13.221 1.00 30.15 H new ATOM 0 HG21 THR A 518 96.470 71.953 10.513 1.00 28.66 H new ATOM 0 HG22 THR A 518 94.893 71.806 10.504 1.00 28.66 H new ATOM 0 HG23 THR A 518 95.582 72.893 11.427 1.00 28.66 H new ATOM 1734 N TRP A 519 92.508 71.966 11.987 1.00 28.84 N ATOM 1735 CA TRP A 519 91.234 71.993 11.298 1.00 30.82 C ATOM 1736 C TRP A 519 91.324 72.900 10.103 1.00 31.02 C ATOM 1737 O TRP A 519 91.997 73.937 10.170 1.00 30.32 O ATOM 1738 CB TRP A 519 90.139 72.619 12.180 1.00 29.85 C ATOM 1739 CG TRP A 519 89.749 71.813 13.343 1.00 30.58 C ATOM 1740 CD1 TRP A 519 90.474 71.599 14.465 1.00 30.82 C ATOM 1741 CD2 TRP A 519 88.512 71.142 13.529 1.00 31.30 C ATOM 1742 NE1 TRP A 519 89.792 70.809 15.335 1.00 30.84 N ATOM 1743 CE2 TRP A 519 88.573 70.510 14.785 1.00 31.69 C ATOM 1744 CE3 TRP A 519 87.357 70.998 12.746 1.00 31.44 C ATOM 1745 CZ2 TRP A 519 87.513 69.751 15.299 1.00 32.84 C ATOM 1746 CZ3 TRP A 519 86.302 70.242 13.253 1.00 31.53 C ATOM 1747 CH2 TRP A 519 86.393 69.618 14.514 1.00 32.67 C ATOM 0 H TRP A 519 92.756 72.742 12.261 1.00 28.84 H new ATOM 0 HA TRP A 519 91.023 71.076 11.063 1.00 30.82 H new ATOM 0 HB2 TRP A 519 90.448 73.484 12.491 1.00 29.85 H new ATOM 0 HB3 TRP A 519 89.353 72.777 11.634 1.00 29.85 H new ATOM 0 HD1 TRP A 519 91.323 71.945 14.620 1.00 30.82 H new ATOM 0 HE1 TRP A 519 90.077 70.542 16.101 1.00 30.84 H new ATOM 0 HE3 TRP A 519 87.297 71.398 11.908 1.00 31.44 H new ATOM 0 HZ2 TRP A 519 87.565 69.353 16.138 1.00 32.84 H new ATOM 0 HZ3 TRP A 519 85.525 70.147 12.751 1.00 31.53 H new ATOM 0 HH2 TRP A 519 85.680 69.106 14.821 1.00 32.67 H new ATOM 1748 N TYR A 520 90.627 72.506 9.037 1.00 27.50 N ATOM 1749 CA TYR A 520 90.267 73.395 7.953 1.00 28.86 C ATOM 1750 C TYR A 520 88.735 73.415 7.813 1.00 30.66 C ATOM 1751 O TYR A 520 88.085 72.363 7.965 1.00 29.36 O ATOM 1752 CB TYR A 520 90.934 72.945 6.653 1.00 29.97 C ATOM 1753 CG TYR A 520 92.426 72.721 6.823 1.00 30.40 C ATOM 1754 CD1 TYR A 520 93.303 73.796 6.841 1.00 31.68 C ATOM 1755 CD2 TYR A 520 92.936 71.468 7.025 1.00 31.41 C ATOM 1756 CE1 TYR A 520 94.653 73.609 7.036 1.00 31.07 C ATOM 1757 CE2 TYR A 520 94.290 71.265 7.205 1.00 32.45 C ATOM 1758 CZ TYR A 520 95.135 72.350 7.217 1.00 31.61 C ATOM 1759 OH TYR A 520 96.476 72.147 7.391 1.00 31.15 O ATOM 0 H TYR A 520 90.349 71.699 8.929 1.00 27.50 H new ATOM 0 HA TYR A 520 90.579 74.293 8.146 1.00 28.86 H new ATOM 0 HB2 TYR A 520 90.518 72.125 6.345 1.00 29.97 H new ATOM 0 HB3 TYR A 520 90.785 73.614 5.966 1.00 29.97 H new ATOM 0 HD1 TYR A 520 92.973 74.657 6.719 1.00 31.68 H new ATOM 0 HD2 TYR A 520 92.360 70.738 7.041 1.00 31.41 H new ATOM 0 HE1 TYR A 520 95.231 74.338 7.044 1.00 31.07 H new ATOM 0 HE2 TYR A 520 94.626 70.405 7.317 1.00 32.45 H new ATOM 0 HH TYR A 520 96.828 72.845 7.700 1.00 31.15 H new ATOM 1760 N GLY A 521 88.194 74.602 7.534 1.00 32.93 N ATOM 1761 CA GLY A 521 86.751 74.841 7.467 1.00 33.58 C ATOM 1762 C GLY A 521 86.369 75.769 6.334 1.00 34.93 C ATOM 1763 O GLY A 521 87.135 76.678 5.956 1.00 31.49 O ATOM 0 H GLY A 521 88.665 75.304 7.375 1.00 32.93 H new ATOM 0 HA2 GLY A 521 86.291 73.994 7.357 1.00 33.58 H new ATOM 0 HA3 GLY A 521 86.450 75.220 8.307 1.00 33.58 H new ATOM 1764 N VAL A 522 85.172 75.537 5.792 1.00 31.92 N ATOM 1765 CA VAL A 522 84.630 76.311 4.695 1.00 31.89 C ATOM 1766 C VAL A 522 83.219 76.714 5.085 1.00 33.47 C ATOM 1767 O VAL A 522 82.485 75.901 5.625 1.00 32.52 O ATOM 1768 CB VAL A 522 84.561 75.454 3.416 1.00 33.63 C ATOM 1769 CG1 VAL A 522 83.903 76.202 2.258 1.00 33.07 C ATOM 1770 CG2 VAL A 522 85.938 74.966 3.018 1.00 35.01 C ATOM 0 H VAL A 522 84.648 74.911 6.063 1.00 31.92 H new ATOM 0 HA VAL A 522 85.191 77.083 4.522 1.00 31.89 H new ATOM 0 HB VAL A 522 84.005 74.686 3.619 1.00 33.63 H new ATOM 0 HG11 VAL A 522 83.879 75.630 1.475 1.00 33.07 H new ATOM 0 HG12 VAL A 522 82.998 76.449 2.505 1.00 33.07 H new ATOM 0 HG13 VAL A 522 84.413 77.002 2.058 1.00 33.07 H new ATOM 0 HG21 VAL A 522 85.871 74.430 2.212 1.00 35.01 H new ATOM 0 HG22 VAL A 522 86.516 75.727 2.852 1.00 35.01 H new ATOM 0 HG23 VAL A 522 86.310 74.428 3.734 1.00 35.01 H new ATOM 1771 N PRO A 523 82.831 77.965 4.819 1.00 33.53 N ATOM 1772 CA PRO A 523 81.512 78.344 5.273 1.00 36.38 C ATOM 1773 C PRO A 523 80.371 77.693 4.470 1.00 37.33 C ATOM 1774 O PRO A 523 80.539 77.293 3.310 1.00 35.42 O ATOM 1775 CB PRO A 523 81.516 79.858 5.132 1.00 35.08 C ATOM 1776 CG PRO A 523 82.518 80.138 4.079 1.00 35.80 C ATOM 1777 CD PRO A 523 83.574 79.100 4.264 1.00 34.65 C ATOM 0 HA PRO A 523 81.342 78.041 6.179 1.00 36.38 H new ATOM 0 HB2 PRO A 523 80.640 80.190 4.881 1.00 35.08 H new ATOM 0 HB3 PRO A 523 81.754 80.289 5.968 1.00 35.08 H new ATOM 0 HG2 PRO A 523 82.123 80.083 3.195 1.00 35.80 H new ATOM 0 HG3 PRO A 523 82.884 81.032 4.171 1.00 35.80 H new ATOM 0 HD2 PRO A 523 84.003 78.872 3.425 1.00 34.65 H new ATOM 0 HD3 PRO A 523 84.272 79.401 4.867 1.00 34.65 H new ATOM 1778 N GLY A 524 79.231 77.575 5.133 1.00 39.90 N ATOM 1779 CA GLY A 524 78.013 77.036 4.543 1.00 40.38 C ATOM 1780 C GLY A 524 77.669 77.544 3.170 1.00 38.23 C ATOM 1781 O GLY A 524 77.322 76.758 2.289 1.00 39.25 O ATOM 0 H GLY A 524 79.140 77.810 5.955 1.00 39.90 H new ATOM 0 HA2 GLY A 524 78.094 76.070 4.501 1.00 40.38 H new ATOM 0 HA3 GLY A 524 77.272 77.233 5.137 1.00 40.38 H new ATOM 1782 N TYR A 525 77.807 78.840 2.965 1.00 40.04 N ATOM 1783 CA TYR A 525 77.447 79.425 1.682 1.00 42.38 C ATOM 1784 C TYR A 525 78.288 78.887 0.524 1.00 42.56 C ATOM 1785 O TYR A 525 77.853 78.955 -0.609 1.00 42.31 O ATOM 1786 CB TYR A 525 77.462 80.960 1.734 1.00 44.16 C ATOM 1787 CG TYR A 525 78.836 81.622 1.750 1.00 47.07 C ATOM 1788 CD1 TYR A 525 79.571 81.803 0.578 1.00 47.28 C ATOM 1789 CD2 TYR A 525 79.371 82.112 2.944 1.00 49.09 C ATOM 1790 CE1 TYR A 525 80.817 82.431 0.610 1.00 51.54 C ATOM 1791 CE2 TYR A 525 80.599 82.737 2.985 1.00 47.86 C ATOM 1792 CZ TYR A 525 81.327 82.895 1.827 1.00 48.34 C ATOM 1793 OH TYR A 525 82.562 83.516 1.912 1.00 50.03 O ATOM 0 H TYR A 525 78.105 79.398 3.548 1.00 40.04 H new ATOM 0 HA TYR A 525 76.535 79.148 1.503 1.00 42.38 H new ATOM 0 HB2 TYR A 525 76.971 81.295 0.967 1.00 44.16 H new ATOM 0 HB3 TYR A 525 76.979 81.243 2.526 1.00 44.16 H new ATOM 0 HD1 TYR A 525 79.227 81.502 -0.232 1.00 47.28 H new ATOM 0 HD2 TYR A 525 78.886 82.014 3.732 1.00 49.09 H new ATOM 0 HE1 TYR A 525 81.306 82.540 -0.174 1.00 51.54 H new ATOM 0 HE2 TYR A 525 80.935 83.051 3.793 1.00 47.86 H new ATOM 0 HH TYR A 525 82.713 83.731 2.710 1.00 50.03 H new ATOM 1794 N ALA A 526 79.484 78.363 0.807 1.00 41.60 N ATOM 1795 CA ALA A 526 80.386 77.857 -0.234 1.00 38.43 C ATOM 1796 C ALA A 526 80.350 76.343 -0.401 1.00 37.02 C ATOM 1797 O ALA A 526 81.179 75.789 -1.128 1.00 37.12 O ATOM 1798 CB ALA A 526 81.808 78.301 0.074 1.00 40.59 C ATOM 0 H ALA A 526 79.795 78.291 1.606 1.00 41.60 H new ATOM 0 HA ALA A 526 80.076 78.231 -1.074 1.00 38.43 H new ATOM 0 HB1 ALA A 526 82.407 77.968 -0.612 1.00 40.59 H new ATOM 0 HB2 ALA A 526 81.847 79.270 0.095 1.00 40.59 H new ATOM 0 HB3 ALA A 526 82.078 77.948 0.937 1.00 40.59 H new ATOM 1799 N ALA A 527 79.420 75.654 0.254 1.00 34.77 N ATOM 1800 CA ALA A 527 79.388 74.178 0.163 1.00 35.26 C ATOM 1801 C ALA A 527 79.348 73.621 -1.275 1.00 37.49 C ATOM 1802 O ALA A 527 80.113 72.711 -1.630 1.00 35.30 O ATOM 1803 CB ALA A 527 78.224 73.651 0.963 1.00 37.22 C ATOM 0 H ALA A 527 78.808 76.003 0.748 1.00 34.77 H new ATOM 0 HA ALA A 527 80.230 73.867 0.531 1.00 35.26 H new ATOM 0 HB1 ALA A 527 78.202 72.683 0.904 1.00 37.22 H new ATOM 0 HB2 ALA A 527 78.323 73.916 1.891 1.00 37.22 H new ATOM 0 HB3 ALA A 527 77.397 74.015 0.610 1.00 37.22 H new ATOM 1804 N GLU A 528 78.482 74.171 -2.118 1.00 40.24 N ATOM 1805 CA GLU A 528 78.349 73.621 -3.483 1.00 46.19 C ATOM 1806 C GLU A 528 79.575 73.939 -4.353 1.00 44.97 C ATOM 1807 O GLU A 528 79.965 73.124 -5.182 1.00 44.16 O ATOM 1808 CB GLU A 528 77.047 74.066 -4.146 1.00 49.21 C ATOM 1809 CG GLU A 528 75.840 73.594 -3.345 1.00 60.17 C ATOM 1810 CD GLU A 528 74.533 73.524 -4.127 1.00 68.50 C ATOM 1811 OE1 GLU A 528 74.489 73.992 -5.290 1.00 75.17 O ATOM 1812 OE2 GLU A 528 73.543 72.989 -3.555 1.00 72.30 O ATOM 0 H GLU A 528 77.973 74.841 -1.938 1.00 40.24 H new ATOM 0 HA GLU A 528 78.310 72.656 -3.398 1.00 46.19 H new ATOM 0 HB2 GLU A 528 77.032 75.033 -4.221 1.00 49.21 H new ATOM 0 HB3 GLU A 528 77.001 73.711 -5.047 1.00 49.21 H new ATOM 0 HG2 GLU A 528 76.032 72.714 -2.984 1.00 60.17 H new ATOM 0 HG3 GLU A 528 75.717 74.190 -2.590 1.00 60.17 H new ATOM 1813 N GLN A 529 80.202 75.095 -4.136 1.00 47.72 N ATOM 1814 CA GLN A 529 81.500 75.393 -4.791 1.00 46.24 C ATOM 1815 C GLN A 529 82.524 74.358 -4.450 1.00 41.64 C ATOM 1816 O GLN A 529 83.213 73.868 -5.336 1.00 41.82 O ATOM 1817 CB GLN A 529 82.070 76.727 -4.352 1.00 48.44 C ATOM 1818 CG GLN A 529 81.335 77.928 -4.872 1.00 53.88 C ATOM 1819 CD GLN A 529 81.697 79.167 -4.083 1.00 60.38 C ATOM 1820 OE1 GLN A 529 80.822 79.800 -3.472 1.00 65.81 O ATOM 1821 NE2 GLN A 529 82.999 79.508 -4.062 1.00 59.22 N ATOM 0 H GLN A 529 79.906 75.718 -3.622 1.00 47.72 H new ATOM 0 HA GLN A 529 81.315 75.406 -5.743 1.00 46.24 H new ATOM 0 HB2 GLN A 529 82.073 76.760 -3.383 1.00 48.44 H new ATOM 0 HB3 GLN A 529 82.995 76.780 -4.640 1.00 48.44 H new ATOM 0 HG2 GLN A 529 81.549 78.062 -5.808 1.00 53.88 H new ATOM 0 HG3 GLN A 529 80.379 77.774 -4.819 1.00 53.88 H new ATOM 0 HE21 GLN A 529 83.573 79.041 -4.500 1.00 59.22 H new ATOM 0 HE22 GLN A 529 83.257 80.193 -3.610 1.00 59.22 H new ATOM 1822 N LEU A 530 82.650 74.039 -3.161 1.00 37.18 N ATOM 1823 CA LEU A 530 83.613 73.020 -2.755 1.00 34.56 C ATOM 1824 C LEU A 530 83.301 71.711 -3.424 1.00 36.00 C ATOM 1825 O LEU A 530 84.204 71.024 -3.881 1.00 35.24 O ATOM 1826 CB LEU A 530 83.641 72.826 -1.246 1.00 35.11 C ATOM 1827 CG LEU A 530 84.499 71.655 -0.745 1.00 38.93 C ATOM 1828 CD1 LEU A 530 85.087 72.024 0.619 1.00 41.04 C ATOM 1829 CD2 LEU A 530 83.748 70.310 -0.662 1.00 38.34 C ATOM 0 H LEU A 530 82.198 74.393 -2.521 1.00 37.18 H new ATOM 0 HA LEU A 530 84.489 73.330 -3.032 1.00 34.56 H new ATOM 0 HB2 LEU A 530 83.966 73.643 -0.837 1.00 35.11 H new ATOM 0 HB3 LEU A 530 82.731 72.696 -0.936 1.00 35.11 H new ATOM 0 HG LEU A 530 85.200 71.515 -1.401 1.00 38.93 H new ATOM 0 HD11 LEU A 530 85.632 71.291 0.946 1.00 41.04 H new ATOM 0 HD12 LEU A 530 85.635 72.819 0.531 1.00 41.04 H new ATOM 0 HD13 LEU A 530 84.367 72.196 1.246 1.00 41.04 H new ATOM 0 HD21 LEU A 530 84.351 69.622 -0.340 1.00 38.34 H new ATOM 0 HD22 LEU A 530 82.999 70.395 -0.052 1.00 38.34 H new ATOM 0 HD23 LEU A 530 83.421 70.067 -1.542 1.00 38.34 H new ATOM 1830 N GLU A 531 82.020 71.344 -3.441 1.00 37.32 N ATOM 1831 CA GLU A 531 81.591 70.085 -4.039 1.00 39.89 C ATOM 1832 C GLU A 531 81.900 70.027 -5.532 1.00 38.77 C ATOM 1833 O GLU A 531 82.346 68.978 -6.047 1.00 40.32 O ATOM 1834 CB GLU A 531 80.093 69.876 -3.802 1.00 39.39 C ATOM 1835 CG GLU A 531 79.813 69.443 -2.373 1.00 45.02 C ATOM 1836 CD GLU A 531 78.348 69.540 -1.952 1.00 46.38 C ATOM 1837 OE1 GLU A 531 77.526 70.024 -2.758 1.00 48.47 O ATOM 1838 OE2 GLU A 531 78.038 69.137 -0.791 1.00 43.88 O ATOM 0 H GLU A 531 81.382 71.815 -3.109 1.00 37.32 H new ATOM 0 HA GLU A 531 82.090 69.372 -3.611 1.00 39.89 H new ATOM 0 HB2 GLU A 531 79.616 70.699 -3.992 1.00 39.39 H new ATOM 0 HB3 GLU A 531 79.757 69.205 -4.417 1.00 39.39 H new ATOM 0 HG2 GLU A 531 80.109 68.526 -2.262 1.00 45.02 H new ATOM 0 HG3 GLU A 531 80.346 69.987 -1.773 1.00 45.02 H new ATOM 1839 N ASN A 532 81.652 71.142 -6.213 1.00 39.04 N ATOM 1840 CA ASN A 532 81.980 71.248 -7.646 1.00 45.79 C ATOM 1841 C ASN A 532 83.467 71.085 -7.927 1.00 45.48 C ATOM 1842 O ASN A 532 83.852 70.323 -8.818 1.00 50.03 O ATOM 1843 CB ASN A 532 81.416 72.545 -8.230 1.00 47.84 C ATOM 1844 CG ASN A 532 79.893 72.517 -8.301 1.00 48.86 C ATOM 1845 OD1 ASN A 532 79.288 71.446 -8.303 1.00 48.39 O ATOM 1846 ND2 ASN A 532 79.270 73.687 -8.337 1.00 48.05 N ATOM 0 H ASN A 532 81.297 71.848 -5.873 1.00 39.04 H new ATOM 0 HA ASN A 532 81.551 70.504 -8.098 1.00 45.79 H new ATOM 0 HB2 ASN A 532 81.701 73.296 -7.686 1.00 47.84 H new ATOM 0 HB3 ASN A 532 81.779 72.685 -9.119 1.00 47.84 H new ATOM 0 HD21 ASN A 532 78.411 73.716 -8.363 1.00 48.05 H new ATOM 0 HD22 ASN A 532 79.725 74.417 -8.334 1.00 48.05 H new ATOM 1847 N VAL A 533 84.306 71.724 -7.121 1.00 45.01 N ATOM 1848 CA VAL A 533 85.757 71.521 -7.249 1.00 43.31 C ATOM 1849 C VAL A 533 86.080 70.053 -7.048 1.00 40.90 C ATOM 1850 O VAL A 533 86.860 69.468 -7.807 1.00 43.88 O ATOM 1851 CB VAL A 533 86.563 72.366 -6.238 1.00 42.68 C ATOM 1852 CG1 VAL A 533 88.038 71.981 -6.276 1.00 44.49 C ATOM 1853 CG2 VAL A 533 86.396 73.845 -6.524 1.00 42.72 C ATOM 0 H VAL A 533 84.068 72.271 -6.502 1.00 45.01 H new ATOM 0 HA VAL A 533 86.013 71.809 -8.139 1.00 43.31 H new ATOM 0 HB VAL A 533 86.220 72.185 -5.349 1.00 42.68 H new ATOM 0 HG11 VAL A 533 88.530 72.520 -5.637 1.00 44.49 H new ATOM 0 HG12 VAL A 533 88.134 71.043 -6.049 1.00 44.49 H new ATOM 0 HG13 VAL A 533 88.390 72.135 -7.167 1.00 44.49 H new ATOM 0 HG21 VAL A 533 86.908 74.359 -5.880 1.00 42.72 H new ATOM 0 HG22 VAL A 533 86.714 74.040 -7.419 1.00 42.72 H new ATOM 0 HG23 VAL A 533 85.458 74.084 -6.455 1.00 42.72 H new ATOM 1854 N MET A 534 85.481 69.454 -6.026 1.00 43.70 N ATOM 1855 CA MET A 534 85.751 68.049 -5.687 1.00 50.43 C ATOM 1856 C MET A 534 85.275 67.044 -6.741 1.00 49.17 C ATOM 1857 O MET A 534 85.967 66.054 -7.016 1.00 49.88 O ATOM 1858 CB MET A 534 85.147 67.681 -4.314 1.00 56.08 C ATOM 1859 CG MET A 534 85.979 68.186 -3.129 1.00 65.17 C ATOM 1860 SD MET A 534 86.104 67.181 -1.612 1.00 72.98 S ATOM 1861 CE MET A 534 85.806 65.522 -2.197 1.00 58.83 C ATOM 0 H MET A 534 84.911 69.840 -5.510 1.00 43.70 H new ATOM 0 HA MET A 534 86.718 67.982 -5.655 1.00 50.43 H new ATOM 0 HB2 MET A 534 84.252 68.049 -4.253 1.00 56.08 H new ATOM 0 HB3 MET A 534 85.062 66.717 -4.253 1.00 56.08 H new ATOM 0 HG2 MET A 534 86.881 68.335 -3.452 1.00 65.17 H new ATOM 0 HG3 MET A 534 85.623 69.051 -2.874 1.00 65.17 H new ATOM 0 HE1 MET A 534 85.836 64.905 -1.449 1.00 58.83 H new ATOM 0 HE2 MET A 534 84.932 65.479 -2.616 1.00 58.83 H new ATOM 0 HE3 MET A 534 86.487 65.280 -2.844 1.00 58.83 H new ATOM 1862 N LYS A 535 84.096 67.295 -7.294 1.00 47.85 N ATOM 1863 CA LYS A 535 83.519 66.463 -8.360 1.00 53.97 C ATOM 1864 C LYS A 535 84.424 66.392 -9.596 1.00 51.07 C ATOM 1865 O LYS A 535 84.563 65.342 -10.213 1.00 52.18 O ATOM 1866 CB LYS A 535 82.143 67.016 -8.742 1.00 57.69 C ATOM 1867 CG LYS A 535 81.274 66.104 -9.608 1.00 68.26 C ATOM 1868 CD LYS A 535 79.852 65.931 -9.057 1.00 74.93 C ATOM 1869 CE LYS A 535 79.072 67.225 -8.803 1.00 80.86 C ATOM 1870 NZ LYS A 535 78.200 67.594 -9.952 1.00 90.13 N ATOM 0 H LYS A 535 83.598 67.958 -7.064 1.00 47.85 H new ATOM 0 HA LYS A 535 83.433 65.558 -8.021 1.00 53.97 H new ATOM 0 HB2 LYS A 535 81.657 67.218 -7.927 1.00 57.69 H new ATOM 0 HB3 LYS A 535 82.270 67.855 -9.212 1.00 57.69 H new ATOM 0 HG2 LYS A 535 81.226 66.469 -10.506 1.00 68.26 H new ATOM 0 HG3 LYS A 535 81.697 65.234 -9.678 1.00 68.26 H new ATOM 0 HD2 LYS A 535 79.346 65.386 -9.680 1.00 74.93 H new ATOM 0 HD3 LYS A 535 79.904 65.436 -8.224 1.00 74.93 H new ATOM 0 HE2 LYS A 535 78.528 67.121 -8.007 1.00 80.86 H new ATOM 0 HE3 LYS A 535 79.696 67.947 -8.628 1.00 80.86 H new ATOM 0 HZ1 LYS A 535 77.766 68.348 -9.765 1.00 90.13 H new ATOM 0 HZ2 LYS A 535 78.700 67.712 -10.679 1.00 90.13 H new ATOM 0 HZ3 LYS A 535 77.612 66.943 -10.100 1.00 90.13 H new ATOM 1871 N LYS A 536 85.062 67.505 -9.919 1.00 48.79 N ATOM 1872 CA LYS A 536 85.971 67.566 -11.054 1.00 53.52 C ATOM 1873 C LYS A 536 87.236 66.739 -10.791 1.00 54.29 C ATOM 1874 O LYS A 536 87.660 65.969 -11.646 1.00 53.81 O ATOM 1875 CB LYS A 536 86.315 69.019 -11.391 1.00 56.46 C ATOM 1876 CG LYS A 536 86.637 69.208 -12.860 1.00 65.10 C ATOM 1877 CD LYS A 536 87.386 70.498 -13.127 1.00 71.61 C ATOM 1878 CE LYS A 536 87.785 70.569 -14.593 1.00 78.50 C ATOM 1879 NZ LYS A 536 88.742 71.680 -14.831 1.00 84.75 N ATOM 0 H LYS A 536 84.982 68.245 -9.489 1.00 48.79 H new ATOM 0 HA LYS A 536 85.524 67.179 -11.823 1.00 53.52 H new ATOM 0 HB2 LYS A 536 85.569 69.590 -11.149 1.00 56.46 H new ATOM 0 HB3 LYS A 536 87.074 69.302 -10.857 1.00 56.46 H new ATOM 0 HG2 LYS A 536 87.168 68.458 -13.171 1.00 65.10 H new ATOM 0 HG3 LYS A 536 85.813 69.204 -13.372 1.00 65.10 H new ATOM 0 HD2 LYS A 536 86.829 71.258 -12.898 1.00 71.61 H new ATOM 0 HD3 LYS A 536 88.176 70.545 -12.566 1.00 71.61 H new ATOM 0 HE2 LYS A 536 88.186 69.728 -14.864 1.00 78.50 H new ATOM 0 HE3 LYS A 536 86.995 70.695 -15.141 1.00 78.50 H new ATOM 0 HZ1 LYS A 536 88.962 71.703 -15.693 1.00 84.75 H new ATOM 0 HZ2 LYS A 536 88.364 72.452 -14.601 1.00 84.75 H new ATOM 0 HZ3 LYS A 536 89.474 71.551 -14.342 1.00 84.75 H new ATOM 1880 N LEU A 537 87.812 66.862 -9.598 1.00 50.85 N ATOM 1881 CA LEU A 537 89.032 66.132 -9.272 1.00 49.03 C ATOM 1882 C LEU A 537 88.820 64.687 -8.831 1.00 52.90 C ATOM 1883 O LEU A 537 89.746 63.887 -8.913 1.00 57.43 O ATOM 1884 CB LEU A 537 89.809 66.889 -8.203 1.00 50.11 C ATOM 1885 CG LEU A 537 90.221 68.305 -8.604 1.00 51.50 C ATOM 1886 CD1 LEU A 537 90.966 68.969 -7.464 1.00 53.73 C ATOM 1887 CD2 LEU A 537 91.089 68.300 -9.851 1.00 53.24 C ATOM 0 H LEU A 537 87.513 67.362 -8.965 1.00 50.85 H new ATOM 0 HA LEU A 537 89.534 66.078 -10.100 1.00 49.03 H new ATOM 0 HB2 LEU A 537 89.268 66.937 -7.399 1.00 50.11 H new ATOM 0 HB3 LEU A 537 90.606 66.383 -7.979 1.00 50.11 H new ATOM 0 HG LEU A 537 89.414 68.805 -8.801 1.00 51.50 H new ATOM 0 HD11 LEU A 537 91.224 69.867 -7.725 1.00 53.73 H new ATOM 0 HD12 LEU A 537 90.392 69.013 -6.684 1.00 53.73 H new ATOM 0 HD13 LEU A 537 91.760 68.453 -7.252 1.00 53.73 H new ATOM 0 HD21 LEU A 537 91.333 69.211 -10.079 1.00 53.24 H new ATOM 0 HD22 LEU A 537 91.892 67.782 -9.684 1.00 53.24 H new ATOM 0 HD23 LEU A 537 90.596 67.904 -10.587 1.00 53.24 H new ATOM 1888 N ALA A 538 87.628 64.341 -8.352 1.00 54.86 N ATOM 1889 CA ALA A 538 87.388 62.996 -7.821 1.00 55.75 C ATOM 1890 C ALA A 538 85.908 62.573 -7.950 1.00 59.57 C ATOM 1891 O ALA A 538 85.193 62.434 -6.945 1.00 55.51 O ATOM 1892 CB ALA A 538 87.863 62.922 -6.382 1.00 57.10 C ATOM 0 H ALA A 538 86.947 64.865 -8.324 1.00 54.86 H new ATOM 0 HA ALA A 538 87.898 62.366 -8.354 1.00 55.75 H new ATOM 0 HB1 ALA A 538 87.703 62.031 -6.034 1.00 57.10 H new ATOM 0 HB2 ALA A 538 88.812 63.118 -6.344 1.00 57.10 H new ATOM 0 HB3 ALA A 538 87.378 63.570 -5.847 1.00 57.10 H new ATOM 1893 N PRO A 539 85.447 62.356 -9.199 1.00 62.17 N ATOM 1894 CA PRO A 539 84.040 61.993 -9.466 1.00 59.84 C ATOM 1895 C PRO A 539 83.569 60.648 -8.868 1.00 57.35 C ATOM 1896 O PRO A 539 82.390 60.500 -8.562 1.00 54.63 O ATOM 1897 CB PRO A 539 83.968 61.980 -11.004 1.00 63.91 C ATOM 1898 CG PRO A 539 85.374 61.760 -11.460 1.00 62.99 C ATOM 1899 CD PRO A 539 86.235 62.457 -10.449 1.00 64.36 C ATOM 0 HA PRO A 539 83.441 62.624 -9.036 1.00 59.84 H new ATOM 0 HB2 PRO A 539 83.382 61.275 -11.321 1.00 63.91 H new ATOM 0 HB3 PRO A 539 83.616 62.817 -11.345 1.00 63.91 H new ATOM 0 HG2 PRO A 539 85.583 60.814 -11.504 1.00 62.99 H new ATOM 0 HG3 PRO A 539 85.514 62.123 -12.348 1.00 62.99 H new ATOM 0 HD2 PRO A 539 87.101 62.029 -10.361 1.00 64.36 H new ATOM 0 HD3 PRO A 539 86.399 63.381 -10.695 1.00 64.36 H new ATOM 1900 N GLU A 540 84.491 59.700 -8.711 1.00 59.05 N ATOM 1901 CA GLU A 540 84.286 58.426 -7.973 1.00 63.27 C ATOM 1902 C GLU A 540 83.582 58.573 -6.625 1.00 63.48 C ATOM 1903 O GLU A 540 82.821 57.691 -6.214 1.00 64.91 O ATOM 1904 CB GLU A 540 85.624 57.716 -7.694 1.00 71.11 C ATOM 1905 CG GLU A 540 86.663 57.729 -8.820 1.00 77.81 C ATOM 1906 CD GLU A 540 87.449 59.039 -8.933 1.00 82.83 C ATOM 1907 OE1 GLU A 540 87.722 59.695 -7.904 1.00 79.37 O ATOM 1908 OE2 GLU A 540 87.769 59.434 -10.076 1.00 95.01 O ATOM 0 H GLU A 540 85.283 59.772 -9.038 1.00 59.05 H new ATOM 0 HA GLU A 540 83.716 57.912 -8.565 1.00 63.27 H new ATOM 0 HB2 GLU A 540 86.024 58.123 -6.909 1.00 71.11 H new ATOM 0 HB3 GLU A 540 85.434 56.792 -7.469 1.00 71.11 H new ATOM 0 HG2 GLU A 540 87.287 57.000 -8.679 1.00 77.81 H new ATOM 0 HG3 GLU A 540 86.214 57.559 -9.663 1.00 77.81 H new ATOM 1909 N LEU A 541 83.873 59.675 -5.934 1.00 60.93 N ATOM 1910 CA LEU A 541 83.270 59.987 -4.636 1.00 60.11 C ATOM 1911 C LEU A 541 81.810 60.415 -4.729 1.00 58.67 C ATOM 1912 O LEU A 541 81.101 60.440 -3.715 1.00 56.11 O ATOM 1913 CB LEU A 541 84.031 61.124 -3.942 1.00 62.25 C ATOM 1914 CG LEU A 541 85.545 60.996 -3.768 1.00 63.37 C ATOM 1915 CD1 LEU A 541 86.063 62.210 -3.021 1.00 63.39 C ATOM 1916 CD2 LEU A 541 85.942 59.704 -3.069 1.00 62.69 C ATOM 0 H LEU A 541 84.432 60.269 -6.208 1.00 60.93 H new ATOM 0 HA LEU A 541 83.321 59.161 -4.131 1.00 60.11 H new ATOM 0 HB2 LEU A 541 83.860 61.939 -4.440 1.00 62.25 H new ATOM 0 HB3 LEU A 541 83.643 61.243 -3.061 1.00 62.25 H new ATOM 0 HG LEU A 541 85.952 60.959 -4.648 1.00 63.37 H new ATOM 0 HD11 LEU A 541 87.023 62.135 -2.907 1.00 63.39 H new ATOM 0 HD12 LEU A 541 85.860 63.012 -3.527 1.00 63.39 H new ATOM 0 HD13 LEU A 541 85.638 62.260 -2.151 1.00 63.39 H new ATOM 0 HD21 LEU A 541 86.907 59.667 -2.981 1.00 62.69 H new ATOM 0 HD22 LEU A 541 85.536 59.674 -2.188 1.00 62.69 H new ATOM 0 HD23 LEU A 541 85.636 58.946 -3.591 1.00 62.69 H new ATOM 1917 N PHE A 542 81.368 60.786 -5.925 1.00 57.27 N ATOM 1918 CA PHE A 542 80.002 61.264 -6.124 1.00 60.18 C ATOM 1919 C PHE A 542 79.034 60.232 -6.735 1.00 60.93 C ATOM 1920 O PHE A 542 77.893 60.573 -6.998 1.00 59.15 O ATOM 1921 CB PHE A 542 80.038 62.555 -6.938 1.00 56.97 C ATOM 1922 CG PHE A 542 80.656 63.701 -6.195 1.00 58.48 C ATOM 1923 CD1 PHE A 542 82.046 63.787 -6.049 1.00 54.47 C ATOM 1924 CD2 PHE A 542 79.854 64.693 -5.621 1.00 57.66 C ATOM 1925 CE1 PHE A 542 82.615 64.837 -5.347 1.00 56.69 C ATOM 1926 CE2 PHE A 542 80.429 65.759 -4.934 1.00 60.05 C ATOM 1927 CZ PHE A 542 81.809 65.827 -4.796 1.00 56.67 C ATOM 0 H PHE A 542 81.846 60.769 -6.640 1.00 57.27 H new ATOM 0 HA PHE A 542 79.635 61.432 -5.242 1.00 60.18 H new ATOM 0 HB2 PHE A 542 80.535 62.401 -7.756 1.00 56.97 H new ATOM 0 HB3 PHE A 542 79.134 62.794 -7.196 1.00 56.97 H new ATOM 0 HD1 PHE A 542 82.591 63.135 -6.426 1.00 54.47 H new ATOM 0 HD2 PHE A 542 78.929 64.640 -5.699 1.00 57.66 H new ATOM 0 HE1 PHE A 542 83.538 64.880 -5.244 1.00 56.69 H new ATOM 0 HE2 PHE A 542 79.890 66.423 -4.569 1.00 60.05 H new ATOM 0 HZ PHE A 542 82.195 66.536 -4.334 1.00 56.67 H new ATOM 1928 N VAL A 543 79.472 58.986 -6.936 1.00 67.06 N ATOM 1929 CA VAL A 543 78.558 57.898 -7.361 1.00 71.25 C ATOM 1930 C VAL A 543 77.630 57.551 -6.182 1.00 73.93 C ATOM 1931 O VAL A 543 78.107 57.319 -5.073 1.00 78.37 O ATOM 1932 CB VAL A 543 79.323 56.645 -7.883 1.00 68.76 C ATOM 1933 CG1 VAL A 543 80.299 57.032 -8.997 1.00 70.39 C ATOM 1934 CG2 VAL A 543 80.048 55.903 -6.760 1.00 67.40 C ATOM 0 H VAL A 543 80.291 58.743 -6.834 1.00 67.06 H new ATOM 0 HA VAL A 543 78.029 58.208 -8.113 1.00 71.25 H new ATOM 0 HB VAL A 543 78.662 56.036 -8.247 1.00 68.76 H new ATOM 0 HG11 VAL A 543 80.765 56.240 -9.309 1.00 70.39 H new ATOM 0 HG12 VAL A 543 79.809 57.429 -9.734 1.00 70.39 H new ATOM 0 HG13 VAL A 543 80.943 57.672 -8.656 1.00 70.39 H new ATOM 0 HG21 VAL A 543 80.510 55.133 -7.126 1.00 67.40 H new ATOM 0 HG22 VAL A 543 80.691 56.497 -6.342 1.00 67.40 H new ATOM 0 HG23 VAL A 543 79.403 55.608 -6.098 1.00 67.40 H new ATOM 1935 N SER A 544 76.313 57.542 -6.399 1.00 77.17 N ATOM 1936 CA SER A 544 75.368 57.471 -5.264 1.00 78.49 C ATOM 1937 C SER A 544 75.580 56.210 -4.421 1.00 76.28 C ATOM 1938 O SER A 544 75.959 55.156 -4.944 1.00 67.69 O ATOM 1939 CB SER A 544 73.899 57.639 -5.704 1.00 79.83 C ATOM 1940 OG SER A 544 73.647 57.049 -6.965 1.00 81.00 O ATOM 0 H SER A 544 75.946 57.575 -7.176 1.00 77.17 H new ATOM 0 HA SER A 544 75.567 58.229 -4.692 1.00 78.49 H new ATOM 0 HB2 SER A 544 73.316 57.239 -5.040 1.00 79.83 H new ATOM 0 HB3 SER A 544 73.680 58.583 -5.741 1.00 79.83 H new ATOM 0 HG SER A 544 72.840 57.159 -7.170 1.00 81.00 H new ATOM 1941 N GLN A 545 75.380 56.358 -3.109 1.00 78.29 N ATOM 1942 CA GLN A 545 75.763 55.340 -2.136 1.00 81.39 C ATOM 1943 C GLN A 545 74.592 54.394 -1.921 1.00 83.74 C ATOM 1944 O GLN A 545 73.444 54.850 -1.829 1.00 75.17 O ATOM 1945 CB GLN A 545 76.194 55.979 -0.808 1.00 78.79 C ATOM 0 H GLN A 545 75.017 57.055 -2.760 1.00 78.29 H new ATOM 0 HA GLN A 545 76.522 54.843 -2.479 1.00 81.39 H new ATOM 1946 N PRO A 546 74.872 53.073 -1.839 1.00 91.30 N ATOM 1947 CA PRO A 546 73.790 52.091 -1.691 1.00 93.20 C ATOM 1948 C PRO A 546 73.113 52.110 -0.312 1.00 94.26 C ATOM 1949 O PRO A 546 71.995 51.610 -0.188 1.00 94.52 O ATOM 1950 CB PRO A 546 74.493 50.747 -1.946 1.00 93.87 C ATOM 1951 CG PRO A 546 75.907 50.980 -1.539 1.00 94.14 C ATOM 1952 CD PRO A 546 76.206 52.435 -1.787 1.00 92.72 C ATOM 0 HA PRO A 546 73.060 52.278 -2.302 1.00 93.20 H new ATOM 0 HB2 PRO A 546 74.089 50.034 -1.427 1.00 93.87 H new ATOM 0 HB3 PRO A 546 74.432 50.488 -2.879 1.00 93.87 H new ATOM 0 HG2 PRO A 546 76.035 50.758 -0.603 1.00 94.14 H new ATOM 0 HG3 PRO A 546 76.508 50.415 -2.049 1.00 94.14 H new ATOM 0 HD2 PRO A 546 76.752 52.811 -1.079 1.00 92.72 H new ATOM 0 HD3 PRO A 546 76.692 52.561 -2.617 1.00 92.72 H new ATOM 1953 N ASP A 547 73.783 52.673 0.701 1.00 94.46 N ATOM 1954 CA ASP A 547 73.197 52.841 2.040 1.00 94.32 C ATOM 1955 C ASP A 547 73.888 53.953 2.855 1.00 85.91 C ATOM 1956 O ASP A 547 74.795 54.627 2.355 1.00 77.26 O ATOM 1957 CB ASP A 547 73.207 51.498 2.794 1.00 99.08 C ATOM 1958 CG ASP A 547 74.603 50.961 3.022 1.00102.75 C ATOM 1959 OD1 ASP A 547 75.384 50.882 2.050 1.00110.92 O ATOM 1960 OD2 ASP A 547 74.911 50.609 4.177 1.00107.06 O ATOM 0 H ASP A 547 74.588 52.968 0.632 1.00 94.46 H new ATOM 0 HA ASP A 547 72.277 53.127 1.924 1.00 94.32 H new ATOM 0 HB2 ASP A 547 72.765 51.610 3.650 1.00 99.08 H new ATOM 0 HB3 ASP A 547 72.693 50.847 2.292 1.00 99.08 H new ATOM 1961 N LEU A 548 73.421 54.156 4.089 1.00 87.60 N ATOM 1962 CA LEU A 548 74.024 55.130 5.012 1.00 89.29 C ATOM 1963 C LEU A 548 75.485 54.820 5.364 1.00 89.87 C ATOM 1964 O LEU A 548 76.281 55.737 5.541 1.00 99.51 O ATOM 1965 CB LEU A 548 73.191 55.288 6.305 1.00 90.82 C ATOM 1966 CG LEU A 548 72.093 56.370 6.351 1.00 87.67 C ATOM 1967 CD1 LEU A 548 71.330 56.286 7.669 1.00 81.83 C ATOM 1968 CD2 LEU A 548 72.658 57.778 6.145 1.00 85.18 C ATOM 0 H LEU A 548 72.747 53.735 4.417 1.00 87.60 H new ATOM 0 HA LEU A 548 74.020 55.971 4.528 1.00 89.29 H new ATOM 0 HB2 LEU A 548 72.770 54.434 6.490 1.00 90.82 H new ATOM 0 HB3 LEU A 548 73.808 55.464 7.033 1.00 90.82 H new ATOM 0 HG LEU A 548 71.483 56.199 5.616 1.00 87.67 H new ATOM 0 HD11 LEU A 548 70.642 56.970 7.689 1.00 81.83 H new ATOM 0 HD12 LEU A 548 70.918 55.411 7.750 1.00 81.83 H new ATOM 0 HD13 LEU A 548 71.944 56.424 8.408 1.00 81.83 H new ATOM 0 HD21 LEU A 548 71.936 58.425 6.181 1.00 85.18 H new ATOM 0 HD22 LEU A 548 73.302 57.974 6.843 1.00 85.18 H new ATOM 0 HD23 LEU A 548 73.094 57.829 5.280 1.00 85.18 H new ATOM 1969 N LEU A 549 75.841 53.539 5.423 1.00 92.03 N ATOM 1970 CA LEU A 549 77.175 53.102 5.864 1.00 90.57 C ATOM 1971 C LEU A 549 78.226 53.016 4.724 1.00 87.14 C ATOM 1972 O LEU A 549 79.172 52.227 4.808 1.00 85.02 O ATOM 1973 CB LEU A 549 77.059 51.734 6.586 1.00 93.52 C ATOM 1974 CG LEU A 549 76.032 51.476 7.725 1.00 94.32 C ATOM 1975 CD1 LEU A 549 75.664 52.750 8.487 1.00 92.15 C ATOM 1976 CD2 LEU A 549 74.758 50.772 7.258 1.00 94.41 C ATOM 0 H LEU A 549 75.316 52.892 5.208 1.00 92.03 H new ATOM 0 HA LEU A 549 77.500 53.785 6.471 1.00 90.57 H new ATOM 0 HB2 LEU A 549 76.884 51.071 5.899 1.00 93.52 H new ATOM 0 HB3 LEU A 549 77.935 51.538 6.953 1.00 93.52 H new ATOM 0 HG LEU A 549 76.495 50.874 8.329 1.00 94.32 H new ATOM 0 HD11 LEU A 549 75.024 52.537 9.184 1.00 92.15 H new ATOM 0 HD12 LEU A 549 76.462 53.130 8.887 1.00 92.15 H new ATOM 0 HD13 LEU A 549 75.273 53.392 7.874 1.00 92.15 H new ATOM 0 HD21 LEU A 549 74.164 50.643 8.014 1.00 94.41 H new ATOM 0 HD22 LEU A 549 74.315 51.316 6.588 1.00 94.41 H new ATOM 0 HD23 LEU A 549 74.986 49.910 6.875 1.00 94.41 H new ATOM 1977 N HIS A 550 78.064 53.812 3.666 1.00 82.71 N ATOM 1978 CA HIS A 550 78.939 53.739 2.490 1.00 86.58 C ATOM 1979 C HIS A 550 79.247 55.133 1.913 1.00 83.18 C ATOM 1980 O HIS A 550 79.438 55.290 0.703 1.00 85.72 O ATOM 1981 CB HIS A 550 78.288 52.836 1.427 1.00 93.33 C ATOM 1982 CG HIS A 550 78.596 51.378 1.588 1.00 99.73 C ATOM 1983 ND1 HIS A 550 78.066 50.604 2.600 1.00102.68 N ATOM 1984 CD2 HIS A 550 79.359 50.545 0.841 1.00101.88 C ATOM 1985 CE1 HIS A 550 78.500 49.363 2.476 1.00102.09 C ATOM 1986 NE2 HIS A 550 79.286 49.300 1.416 1.00103.59 N ATOM 0 H HIS A 550 77.447 54.408 3.608 1.00 82.71 H new ATOM 0 HA HIS A 550 79.788 53.357 2.764 1.00 86.58 H new ATOM 0 HB2 HIS A 550 77.326 52.959 1.458 1.00 93.33 H new ATOM 0 HB3 HIS A 550 78.582 53.123 0.549 1.00 93.33 H new ATOM 0 HD2 HIS A 550 79.842 50.774 0.080 1.00101.88 H new ATOM 0 HE1 HIS A 550 78.288 48.654 3.039 1.00102.09 H new ATOM 0 HE2 HIS A 550 79.687 48.594 1.132 1.00103.59 H new ATOM 1987 N GLN A 551 79.315 56.135 2.790 1.00 76.16 N ATOM 1988 CA GLN A 551 79.569 57.525 2.395 1.00 70.30 C ATOM 1989 C GLN A 551 81.035 57.682 2.050 1.00 62.57 C ATOM 1990 O GLN A 551 81.893 57.317 2.849 1.00 60.07 O ATOM 1991 CB GLN A 551 79.229 58.478 3.535 1.00 73.03 C ATOM 1992 CG GLN A 551 77.742 58.607 3.786 1.00 77.88 C ATOM 1993 CD GLN A 551 77.431 59.245 5.126 1.00 79.38 C ATOM 1994 OE1 GLN A 551 77.970 60.297 5.467 1.00 79.40 O ATOM 1995 NE2 GLN A 551 76.552 58.613 5.890 1.00 83.55 N ATOM 0 H GLN A 551 79.215 56.028 3.637 1.00 76.16 H new ATOM 0 HA GLN A 551 79.014 57.737 1.629 1.00 70.30 H new ATOM 0 HB2 GLN A 551 79.662 58.169 4.346 1.00 73.03 H new ATOM 0 HB3 GLN A 551 79.594 59.354 3.335 1.00 73.03 H new ATOM 0 HG2 GLN A 551 77.343 59.137 3.079 1.00 77.88 H new ATOM 0 HG3 GLN A 551 77.333 57.728 3.747 1.00 77.88 H new ATOM 0 HE21 GLN A 551 76.195 57.879 5.618 1.00 83.55 H new ATOM 0 HE22 GLN A 551 76.338 58.937 6.658 1.00 83.55 H new ATOM 1996 N LEU A 552 81.317 58.213 0.864 1.00 53.13 N ATOM 1997 CA LEU A 552 82.683 58.316 0.391 1.00 48.36 C ATOM 1998 C LEU A 552 83.205 59.729 0.618 1.00 43.58 C ATOM 1999 O LEU A 552 82.554 60.709 0.299 1.00 40.64 O ATOM 2000 CB LEU A 552 82.791 57.892 -1.073 1.00 50.94 C ATOM 2001 CG LEU A 552 82.483 56.409 -1.364 1.00 52.02 C ATOM 2002 CD1 LEU A 552 82.679 56.125 -2.854 1.00 51.82 C ATOM 2003 CD2 LEU A 552 83.334 55.456 -0.518 1.00 49.78 C ATOM 0 H LEU A 552 80.726 58.519 0.320 1.00 53.13 H new ATOM 0 HA LEU A 552 83.240 57.706 0.899 1.00 48.36 H new ATOM 0 HB2 LEU A 552 82.186 58.440 -1.597 1.00 50.94 H new ATOM 0 HB3 LEU A 552 83.689 58.086 -1.383 1.00 50.94 H new ATOM 0 HG LEU A 552 81.558 56.248 -1.120 1.00 52.02 H new ATOM 0 HD11 LEU A 552 82.485 55.192 -3.034 1.00 51.82 H new ATOM 0 HD12 LEU A 552 82.080 56.685 -3.372 1.00 51.82 H new ATOM 0 HD13 LEU A 552 83.597 56.317 -3.102 1.00 51.82 H new ATOM 0 HD21 LEU A 552 83.106 54.539 -0.735 1.00 49.78 H new ATOM 0 HD22 LEU A 552 84.274 55.608 -0.705 1.00 49.78 H new ATOM 0 HD23 LEU A 552 83.162 55.617 0.423 1.00 49.78 H new ATOM 2004 N VAL A 553 84.391 59.812 1.205 1.00 43.81 N ATOM 2005 CA VAL A 553 85.012 61.091 1.552 1.00 41.55 C ATOM 2006 C VAL A 553 86.489 61.009 1.246 1.00 37.47 C ATOM 2007 O VAL A 553 87.021 59.908 1.050 1.00 39.51 O ATOM 2008 CB VAL A 553 84.795 61.436 3.046 1.00 42.29 C ATOM 2009 CG1 VAL A 553 83.342 61.775 3.308 1.00 41.84 C ATOM 2010 CG2 VAL A 553 85.238 60.298 3.946 1.00 43.53 C ATOM 0 H VAL A 553 84.864 59.126 1.416 1.00 43.81 H new ATOM 0 HA VAL A 553 84.599 61.795 1.028 1.00 41.55 H new ATOM 0 HB VAL A 553 85.340 62.211 3.251 1.00 42.29 H new ATOM 0 HG11 VAL A 553 83.223 61.988 4.247 1.00 41.84 H new ATOM 0 HG12 VAL A 553 83.085 62.539 2.768 1.00 41.84 H new ATOM 0 HG13 VAL A 553 82.785 61.015 3.077 1.00 41.84 H new ATOM 0 HG21 VAL A 553 85.091 60.542 4.873 1.00 43.53 H new ATOM 0 HG22 VAL A 553 84.726 59.501 3.736 1.00 43.53 H new ATOM 0 HG23 VAL A 553 86.181 60.122 3.805 1.00 43.53 H new ATOM 2011 N THR A 554 87.141 62.166 1.225 1.00 36.04 N ATOM 2012 CA THR A 554 88.556 62.241 0.905 1.00 37.40 C ATOM 2013 C THR A 554 89.350 63.391 1.535 1.00 35.87 C ATOM 2014 O THR A 554 88.792 64.411 1.937 1.00 32.63 O ATOM 2015 CB THR A 554 88.733 62.328 -0.627 1.00 39.61 C ATOM 2016 OG1 THR A 554 90.005 61.791 -0.978 1.00 43.93 O ATOM 2017 CG2 THR A 554 88.588 63.770 -1.165 1.00 40.15 C ATOM 0 H THR A 554 86.775 62.925 1.395 1.00 36.04 H new ATOM 0 HA THR A 554 88.923 61.431 1.292 1.00 37.40 H new ATOM 0 HB THR A 554 88.024 61.810 -1.039 1.00 39.61 H new ATOM 0 HG1 THR A 554 90.081 61.018 -0.658 1.00 43.93 H new ATOM 0 HG21 THR A 554 88.707 63.770 -2.128 1.00 40.15 H new ATOM 0 HG22 THR A 554 87.705 64.109 -0.949 1.00 40.15 H new ATOM 0 HG23 THR A 554 89.260 64.337 -0.756 1.00 40.15 H new ATOM 2018 N ILE A 555 90.669 63.190 1.571 1.00 37.00 N ATOM 2019 CA ILE A 555 91.640 64.223 1.889 1.00 37.57 C ATOM 2020 C ILE A 555 91.828 65.106 0.651 1.00 38.68 C ATOM 2021 O ILE A 555 91.994 64.591 -0.459 1.00 39.16 O ATOM 2022 CB ILE A 555 92.995 63.600 2.292 1.00 39.17 C ATOM 2023 CG1 ILE A 555 92.847 62.790 3.584 1.00 39.67 C ATOM 2024 CG2 ILE A 555 94.067 64.682 2.461 1.00 41.16 C ATOM 2025 CD1 ILE A 555 93.935 61.755 3.826 1.00 40.45 C ATOM 0 H ILE A 555 91.027 62.426 1.406 1.00 37.00 H new ATOM 0 HA ILE A 555 91.316 64.749 2.637 1.00 37.57 H new ATOM 0 HB ILE A 555 93.277 63.004 1.581 1.00 39.17 H new ATOM 0 HG12 ILE A 555 92.832 63.404 4.334 1.00 39.67 H new ATOM 0 HG13 ILE A 555 91.988 62.339 3.570 1.00 39.67 H new ATOM 0 HG21 ILE A 555 94.907 64.269 2.714 1.00 41.16 H new ATOM 0 HG22 ILE A 555 94.180 65.159 1.624 1.00 41.16 H new ATOM 0 HG23 ILE A 555 93.793 65.304 3.153 1.00 41.16 H new ATOM 0 HD11 ILE A 555 93.762 61.293 4.661 1.00 40.45 H new ATOM 0 HD12 ILE A 555 93.941 61.115 3.097 1.00 40.45 H new ATOM 0 HD13 ILE A 555 94.797 62.197 3.874 1.00 40.45 H new ATOM 2026 N MET A 556 91.827 66.422 0.837 1.00 38.15 N ATOM 2027 CA MET A 556 92.124 67.348 -0.260 1.00 38.03 C ATOM 2028 C MET A 556 92.744 68.638 0.250 1.00 37.08 C ATOM 2029 O MET A 556 92.231 69.251 1.190 1.00 32.84 O ATOM 2030 CB MET A 556 90.869 67.671 -1.050 1.00 41.94 C ATOM 2031 CG MET A 556 91.093 68.711 -2.141 1.00 46.75 C ATOM 2032 SD MET A 556 89.592 69.253 -2.975 1.00 49.99 S ATOM 2033 CE MET A 556 89.492 68.029 -4.252 1.00 55.20 C ATOM 0 H MET A 556 91.657 66.802 1.589 1.00 38.15 H new ATOM 0 HA MET A 556 92.763 66.905 -0.840 1.00 38.03 H new ATOM 0 HB2 MET A 556 90.530 66.857 -1.453 1.00 41.94 H new ATOM 0 HB3 MET A 556 90.185 67.992 -0.441 1.00 41.94 H new ATOM 0 HG2 MET A 556 91.530 69.484 -1.750 1.00 46.75 H new ATOM 0 HG3 MET A 556 91.702 68.345 -2.801 1.00 46.75 H new ATOM 0 HE1 MET A 556 88.852 68.313 -4.924 1.00 55.20 H new ATOM 0 HE2 MET A 556 90.364 67.918 -4.663 1.00 55.20 H new ATOM 0 HE3 MET A 556 89.205 67.185 -3.870 1.00 55.20 H new ATOM 2034 N ASN A 557 93.819 69.075 -0.417 1.00 33.66 N ATOM 2035 CA ASN A 557 94.628 70.202 0.035 1.00 32.08 C ATOM 2036 C ASN A 557 93.796 71.439 -0.003 1.00 30.39 C ATOM 2037 O ASN A 557 93.248 71.756 -1.037 1.00 33.28 O ATOM 2038 CB ASN A 557 95.850 70.363 -0.885 1.00 33.59 C ATOM 2039 CG ASN A 557 96.903 71.314 -0.337 1.00 34.78 C ATOM 2040 OD1 ASN A 557 96.617 72.420 0.116 1.00 34.14 O ATOM 2041 ND2 ASN A 557 98.151 70.882 -0.417 1.00 38.77 N ATOM 0 H ASN A 557 94.097 68.720 -1.149 1.00 33.66 H new ATOM 0 HA ASN A 557 94.937 70.045 0.941 1.00 32.08 H new ATOM 0 HB2 ASN A 557 96.254 69.493 -1.029 1.00 33.59 H new ATOM 0 HB3 ASN A 557 95.554 70.685 -1.751 1.00 33.59 H new ATOM 0 HD21 ASN A 557 98.797 71.381 -0.146 1.00 38.77 H new ATOM 0 HD22 ASN A 557 98.316 70.102 -0.740 1.00 38.77 H new ATOM 2042 N PRO A 558 93.687 72.160 1.106 1.00 29.13 N ATOM 2043 CA PRO A 558 92.907 73.395 1.010 1.00 32.42 C ATOM 2044 C PRO A 558 93.423 74.442 0.040 1.00 35.01 C ATOM 2045 O PRO A 558 92.630 75.306 -0.358 1.00 34.69 O ATOM 2046 CB PRO A 558 92.948 73.959 2.416 1.00 33.72 C ATOM 2047 CG PRO A 558 94.041 73.240 3.112 1.00 35.61 C ATOM 2048 CD PRO A 558 94.187 71.920 2.466 1.00 33.79 C ATOM 0 HA PRO A 558 92.027 73.181 0.663 1.00 32.42 H new ATOM 0 HB2 PRO A 558 93.114 74.915 2.402 1.00 33.72 H new ATOM 0 HB3 PRO A 558 92.101 73.825 2.869 1.00 33.72 H new ATOM 0 HG2 PRO A 558 94.870 73.741 3.055 1.00 35.61 H new ATOM 0 HG3 PRO A 558 93.836 73.138 4.055 1.00 35.61 H new ATOM 0 HD2 PRO A 558 95.110 71.622 2.462 1.00 33.79 H new ATOM 0 HD3 PRO A 558 93.671 71.238 2.923 1.00 33.79 H new ATOM 2049 N ASN A 559 94.719 74.391 -0.323 1.00 33.66 N ATOM 2050 CA ASN A 559 95.238 75.278 -1.376 1.00 37.30 C ATOM 2051 C ASN A 559 94.566 75.000 -2.733 1.00 35.62 C ATOM 2052 O ASN A 559 94.359 75.907 -3.518 1.00 36.62 O ATOM 2053 CB ASN A 559 96.775 75.154 -1.523 1.00 37.44 C ATOM 2054 CG ASN A 559 97.554 75.749 -0.342 1.00 39.44 C ATOM 2055 OD1 ASN A 559 98.752 75.502 -0.218 1.00 45.85 O ATOM 2056 ND2 ASN A 559 96.904 76.556 0.493 1.00 38.30 N ATOM 0 H ASN A 559 95.301 73.860 0.022 1.00 33.66 H new ATOM 0 HA ASN A 559 95.025 76.184 -1.103 1.00 37.30 H new ATOM 0 HB2 ASN A 559 97.009 74.217 -1.616 1.00 37.44 H new ATOM 0 HB3 ASN A 559 97.051 75.598 -2.340 1.00 37.44 H new ATOM 0 HD21 ASN A 559 97.323 76.925 1.147 1.00 38.30 H new ATOM 0 HD22 ASN A 559 96.065 76.708 0.378 1.00 38.30 H new ATOM 2057 N THR A 560 94.254 73.743 -3.024 1.00 39.01 N ATOM 2058 CA THR A 560 93.429 73.422 -4.185 1.00 40.00 C ATOM 2059 C THR A 560 92.105 74.185 -4.131 1.00 41.33 C ATOM 2060 O THR A 560 91.739 74.858 -5.085 1.00 40.98 O ATOM 2061 CB THR A 560 93.189 71.924 -4.266 1.00 43.40 C ATOM 2062 OG1 THR A 560 94.452 71.278 -4.431 1.00 42.83 O ATOM 2063 CG2 THR A 560 92.276 71.559 -5.434 1.00 44.91 C ATOM 0 H THR A 560 94.508 73.062 -2.564 1.00 39.01 H new ATOM 0 HA THR A 560 93.902 73.697 -4.986 1.00 40.00 H new ATOM 0 HB THR A 560 92.751 71.634 -3.451 1.00 43.40 H new ATOM 0 HG1 THR A 560 94.338 70.447 -4.476 1.00 42.83 H new ATOM 0 HG21 THR A 560 92.145 70.598 -5.455 1.00 44.91 H new ATOM 0 HG22 THR A 560 91.419 71.999 -5.325 1.00 44.91 H new ATOM 0 HG23 THR A 560 92.683 71.847 -6.266 1.00 44.91 H new ATOM 2064 N LEU A 561 91.417 74.162 -3.000 1.00 39.34 N ATOM 2065 CA LEU A 561 90.167 74.925 -2.908 1.00 39.84 C ATOM 2066 C LEU A 561 90.391 76.431 -3.056 1.00 39.86 C ATOM 2067 O LEU A 561 89.625 77.152 -3.724 1.00 37.44 O ATOM 2068 CB LEU A 561 89.478 74.620 -1.578 1.00 41.53 C ATOM 2069 CG LEU A 561 89.008 73.173 -1.420 1.00 44.10 C ATOM 2070 CD1 LEU A 561 88.687 72.873 0.034 1.00 45.81 C ATOM 2071 CD2 LEU A 561 87.799 72.896 -2.298 1.00 46.99 C ATOM 0 H LEU A 561 91.641 73.728 -2.292 1.00 39.34 H new ATOM 0 HA LEU A 561 89.599 74.650 -3.645 1.00 39.84 H new ATOM 0 HB2 LEU A 561 90.090 74.829 -0.855 1.00 41.53 H new ATOM 0 HB3 LEU A 561 88.713 75.208 -1.481 1.00 41.53 H new ATOM 0 HG LEU A 561 89.729 72.590 -1.705 1.00 44.10 H new ATOM 0 HD11 LEU A 561 88.391 71.953 0.117 1.00 45.81 H new ATOM 0 HD12 LEU A 561 89.481 73.007 0.575 1.00 45.81 H new ATOM 0 HD13 LEU A 561 87.984 73.467 0.340 1.00 45.81 H new ATOM 0 HD21 LEU A 561 87.519 71.975 -2.182 1.00 46.99 H new ATOM 0 HD22 LEU A 561 87.073 73.488 -2.046 1.00 46.99 H new ATOM 0 HD23 LEU A 561 88.032 73.048 -3.227 1.00 46.99 H new ATOM 2072 N MET A 562 91.447 76.923 -2.420 1.00 40.92 N ATOM 2073 CA MET A 562 91.738 78.356 -2.454 1.00 41.14 C ATOM 2074 C MET A 562 92.080 78.809 -3.864 1.00 38.91 C ATOM 2075 O MET A 562 91.749 79.906 -4.249 1.00 42.54 O ATOM 2076 CB MET A 562 92.867 78.691 -1.498 1.00 44.48 C ATOM 2077 CG MET A 562 92.470 78.551 -0.037 1.00 44.74 C ATOM 2078 SD MET A 562 93.909 78.221 1.005 1.00 43.28 S ATOM 2079 CE MET A 562 94.658 79.848 1.039 1.00 45.31 C ATOM 0 H MET A 562 92.005 76.451 -1.966 1.00 40.92 H new ATOM 0 HA MET A 562 90.942 78.832 -2.171 1.00 41.14 H new ATOM 0 HB2 MET A 562 93.622 78.109 -1.680 1.00 44.48 H new ATOM 0 HB3 MET A 562 93.164 79.600 -1.662 1.00 44.48 H new ATOM 0 HG2 MET A 562 92.032 79.364 0.261 1.00 44.74 H new ATOM 0 HG3 MET A 562 91.827 77.831 0.058 1.00 44.74 H new ATOM 0 HE1 MET A 562 95.464 79.822 1.578 1.00 45.31 H new ATOM 0 HE2 MET A 562 94.882 80.120 0.135 1.00 45.31 H new ATOM 0 HE3 MET A 562 94.034 80.484 1.422 1.00 45.31 H new ATOM 2080 N THR A 563 92.693 77.926 -4.635 1.00 40.18 N ATOM 2081 CA THR A 563 92.995 78.160 -6.056 1.00 44.09 C ATOM 2082 C THR A 563 91.731 78.317 -6.876 1.00 47.27 C ATOM 2083 O THR A 563 91.705 79.131 -7.790 1.00 42.50 O ATOM 2084 CB THR A 563 93.884 77.026 -6.603 1.00 44.26 C ATOM 2085 OG1 THR A 563 95.178 77.203 -6.035 1.00 49.63 O ATOM 2086 CG2 THR A 563 94.002 77.027 -8.131 1.00 49.03 C ATOM 0 H THR A 563 92.954 77.157 -4.351 1.00 40.18 H new ATOM 0 HA THR A 563 93.483 78.995 -6.129 1.00 44.09 H new ATOM 0 HB THR A 563 93.481 76.177 -6.363 1.00 44.26 H new ATOM 0 HG1 THR A 563 95.188 76.887 -5.257 1.00 49.63 H new ATOM 0 HG21 THR A 563 94.571 76.294 -8.412 1.00 49.03 H new ATOM 0 HG22 THR A 563 93.121 76.921 -8.524 1.00 49.03 H new ATOM 0 HG23 THR A 563 94.388 77.867 -8.425 1.00 49.03 H new ATOM 2087 N HIS A 564 90.681 77.568 -6.520 1.00 48.23 N ATOM 2088 CA HIS A 564 89.379 77.698 -7.163 1.00 47.29 C ATOM 2089 C HIS A 564 88.458 78.673 -6.433 1.00 48.54 C ATOM 2090 O HIS A 564 87.262 78.644 -6.619 1.00 48.89 O ATOM 2091 CB HIS A 564 88.748 76.331 -7.303 1.00 46.54 C ATOM 2092 CG HIS A 564 89.544 75.398 -8.160 1.00 50.73 C ATOM 2093 ND1 HIS A 564 89.432 75.375 -9.533 1.00 53.29 N ATOM 2094 CD2 HIS A 564 90.472 74.462 -7.845 1.00 50.68 C ATOM 2095 CE1 HIS A 564 90.245 74.454 -10.026 1.00 54.33 C ATOM 2096 NE2 HIS A 564 90.892 73.890 -9.022 1.00 52.10 N ATOM 0 H HIS A 564 90.709 76.973 -5.900 1.00 48.23 H new ATOM 0 HA HIS A 564 89.515 78.077 -8.046 1.00 47.29 H new ATOM 0 HB2 HIS A 564 88.641 75.939 -6.422 1.00 46.54 H new ATOM 0 HB3 HIS A 564 87.860 76.429 -7.680 1.00 46.54 H new ATOM 0 HD2 HIS A 564 90.770 74.247 -6.991 1.00 50.68 H new ATOM 0 HE1 HIS A 564 90.344 74.240 -10.926 1.00 54.33 H new ATOM 0 HE2 HIS A 564 91.480 73.267 -9.093 1.00 52.10 H new ATOM 2097 N GLU A 565 89.028 79.557 -5.623 1.00 50.79 N ATOM 2098 CA GLU A 565 88.302 80.628 -4.955 1.00 51.68 C ATOM 2099 C GLU A 565 87.186 80.195 -3.991 1.00 50.01 C ATOM 2100 O GLU A 565 86.247 80.948 -3.726 1.00 47.08 O ATOM 2101 CB GLU A 565 87.824 81.652 -5.988 1.00 59.30 C ATOM 2102 CG GLU A 565 88.993 82.400 -6.614 1.00 66.56 C ATOM 2103 CD GLU A 565 88.614 83.197 -7.848 1.00 73.74 C ATOM 2104 OE1 GLU A 565 87.490 83.740 -7.895 1.00 75.33 O ATOM 2105 OE2 GLU A 565 89.456 83.286 -8.770 1.00 85.03 O ATOM 0 H GLU A 565 89.869 79.550 -5.442 1.00 50.79 H new ATOM 0 HA GLU A 565 88.942 81.041 -4.355 1.00 51.68 H new ATOM 0 HB2 GLU A 565 87.318 81.201 -6.682 1.00 59.30 H new ATOM 0 HB3 GLU A 565 87.223 82.285 -5.564 1.00 59.30 H new ATOM 0 HG2 GLU A 565 89.373 83.001 -5.954 1.00 66.56 H new ATOM 0 HG3 GLU A 565 89.686 81.763 -6.850 1.00 66.56 H new ATOM 2106 N VAL A 566 87.348 79.011 -3.410 1.00 44.44 N ATOM 2107 CA VAL A 566 86.552 78.602 -2.256 1.00 44.06 C ATOM 2108 C VAL A 566 87.220 79.152 -0.997 1.00 39.92 C ATOM 2109 O VAL A 566 88.385 78.866 -0.765 1.00 43.46 O ATOM 2110 CB VAL A 566 86.492 77.080 -2.127 1.00 42.50 C ATOM 2111 CG1 VAL A 566 85.646 76.681 -0.921 1.00 45.21 C ATOM 2112 CG2 VAL A 566 85.950 76.466 -3.404 1.00 45.89 C ATOM 0 H VAL A 566 87.919 78.424 -3.671 1.00 44.44 H new ATOM 0 HA VAL A 566 85.651 78.942 -2.369 1.00 44.06 H new ATOM 0 HB VAL A 566 87.390 76.741 -1.987 1.00 42.50 H new ATOM 0 HG11 VAL A 566 85.617 75.714 -0.852 1.00 45.21 H new ATOM 0 HG12 VAL A 566 86.037 77.051 -0.114 1.00 45.21 H new ATOM 0 HG13 VAL A 566 84.745 77.024 -1.030 1.00 45.21 H new ATOM 0 HG21 VAL A 566 85.917 75.501 -3.311 1.00 45.89 H new ATOM 0 HG22 VAL A 566 85.057 76.805 -3.573 1.00 45.89 H new ATOM 0 HG23 VAL A 566 86.529 76.699 -4.146 1.00 45.89 H new ATOM 2113 N PRO A 567 86.488 79.904 -0.160 1.00 40.09 N ATOM 2114 CA PRO A 567 87.069 80.381 1.095 1.00 39.57 C ATOM 2115 C PRO A 567 87.314 79.268 2.099 1.00 42.51 C ATOM 2116 O PRO A 567 86.433 78.431 2.329 1.00 43.50 O ATOM 2117 CB PRO A 567 86.031 81.368 1.631 1.00 40.85 C ATOM 2118 CG PRO A 567 84.774 81.013 0.964 1.00 41.39 C ATOM 2119 CD PRO A 567 85.110 80.382 -0.348 1.00 42.22 C ATOM 0 HA PRO A 567 87.943 80.776 0.948 1.00 39.57 H new ATOM 0 HB2 PRO A 567 85.947 81.298 2.595 1.00 40.85 H new ATOM 0 HB3 PRO A 567 86.285 82.283 1.434 1.00 40.85 H new ATOM 0 HG2 PRO A 567 84.260 80.401 1.513 1.00 41.39 H new ATOM 0 HG3 PRO A 567 84.226 81.802 0.830 1.00 41.39 H new ATOM 0 HD2 PRO A 567 84.505 79.653 -0.559 1.00 42.22 H new ATOM 0 HD3 PRO A 567 85.050 81.020 -1.076 1.00 42.22 H new ATOM 2120 N VAL A 568 88.518 79.244 2.655 1.00 37.06 N ATOM 2121 CA VAL A 568 88.926 78.213 3.588 1.00 36.73 C ATOM 2122 C VAL A 568 89.603 78.893 4.755 1.00 36.72 C ATOM 2123 O VAL A 568 90.382 79.823 4.548 1.00 36.95 O ATOM 2124 CB VAL A 568 89.932 77.232 2.975 1.00 37.74 C ATOM 2125 CG1 VAL A 568 90.190 76.067 3.932 1.00 37.88 C ATOM 2126 CG2 VAL A 568 89.462 76.743 1.631 1.00 41.46 C ATOM 0 H VAL A 568 89.125 79.833 2.498 1.00 37.06 H new ATOM 0 HA VAL A 568 88.137 77.713 3.848 1.00 36.73 H new ATOM 0 HB VAL A 568 90.770 77.700 2.836 1.00 37.74 H new ATOM 0 HG11 VAL A 568 90.827 75.455 3.532 1.00 37.88 H new ATOM 0 HG12 VAL A 568 90.549 76.407 4.767 1.00 37.88 H new ATOM 0 HG13 VAL A 568 89.358 75.599 4.105 1.00 37.88 H new ATOM 0 HG21 VAL A 568 90.114 76.125 1.265 1.00 41.46 H new ATOM 0 HG22 VAL A 568 88.610 76.291 1.731 1.00 41.46 H new ATOM 0 HG23 VAL A 568 89.359 77.497 1.030 1.00 41.46 H new ATOM 2127 N TYR A 569 89.350 78.400 5.966 1.00 34.15 N ATOM 2128 CA TYR A 569 89.977 78.918 7.174 1.00 34.37 C ATOM 2129 C TYR A 569 90.609 77.765 7.924 1.00 34.00 C ATOM 2130 O TYR A 569 90.277 76.596 7.661 1.00 33.58 O ATOM 2131 CB TYR A 569 88.956 79.655 8.048 1.00 35.25 C ATOM 2132 CG TYR A 569 88.383 80.823 7.308 1.00 39.80 C ATOM 2133 CD1 TYR A 569 87.298 80.661 6.441 1.00 39.39 C ATOM 2134 CD2 TYR A 569 88.965 82.086 7.399 1.00 41.68 C ATOM 2135 CE1 TYR A 569 86.816 81.724 5.698 1.00 40.82 C ATOM 2136 CE2 TYR A 569 88.479 83.157 6.663 1.00 40.93 C ATOM 2137 CZ TYR A 569 87.413 82.972 5.823 1.00 42.03 C ATOM 2138 OH TYR A 569 86.934 84.035 5.110 1.00 45.50 O ATOM 0 H TYR A 569 88.805 77.750 6.108 1.00 34.15 H new ATOM 0 HA TYR A 569 90.663 79.561 6.935 1.00 34.37 H new ATOM 0 HB2 TYR A 569 88.245 79.048 8.307 1.00 35.25 H new ATOM 0 HB3 TYR A 569 89.381 79.959 8.865 1.00 35.25 H new ATOM 0 HD1 TYR A 569 86.895 79.827 6.363 1.00 39.39 H new ATOM 0 HD2 TYR A 569 89.693 82.213 7.964 1.00 41.68 H new ATOM 0 HE1 TYR A 569 86.098 81.604 5.119 1.00 40.82 H new ATOM 0 HE2 TYR A 569 88.875 83.995 6.739 1.00 40.93 H new ATOM 0 HH TYR A 569 87.389 84.719 5.286 1.00 45.50 H new ATOM 2139 N ARG A 570 91.507 78.077 8.862 1.00 31.23 N ATOM 2140 CA ARG A 570 92.204 77.038 9.622 1.00 31.47 C ATOM 2141 C ARG A 570 92.222 77.356 11.099 1.00 29.07 C ATOM 2142 O ARG A 570 92.002 78.479 11.502 1.00 33.74 O ATOM 2143 CB ARG A 570 93.647 76.848 9.088 1.00 32.45 C ATOM 2144 CG ARG A 570 94.610 77.971 9.484 1.00 35.52 C ATOM 2145 CD ARG A 570 96.079 77.722 9.123 1.00 36.54 C ATOM 2146 NE ARG A 570 96.631 76.458 9.628 1.00 35.78 N ATOM 2147 CZ ARG A 570 96.879 76.169 10.913 1.00 35.83 C ATOM 2148 NH1 ARG A 570 96.605 77.017 11.893 1.00 36.45 N ATOM 2149 NH2 ARG A 570 97.385 74.985 11.227 1.00 38.44 N ATOM 0 H ARG A 570 91.726 78.882 9.072 1.00 31.23 H new ATOM 0 HA ARG A 570 91.718 76.207 9.503 1.00 31.47 H new ATOM 0 HB2 ARG A 570 93.995 76.005 9.417 1.00 32.45 H new ATOM 0 HB3 ARG A 570 93.618 76.785 8.120 1.00 32.45 H new ATOM 0 HG2 ARG A 570 94.321 78.792 9.057 1.00 35.52 H new ATOM 0 HG3 ARG A 570 94.546 78.111 10.442 1.00 35.52 H new ATOM 0 HD2 ARG A 570 96.169 77.737 8.157 1.00 36.54 H new ATOM 0 HD3 ARG A 570 96.613 78.455 9.469 1.00 36.54 H new ATOM 0 HE ARG A 570 96.811 75.849 9.048 1.00 35.78 H new ATOM 0 HH11 ARG A 570 96.256 77.782 11.714 1.00 36.45 H new ATOM 0 HH12 ARG A 570 96.776 76.802 12.708 1.00 36.45 H new ATOM 0 HH21 ARG A 570 97.551 74.411 10.609 1.00 38.44 H new ATOM 0 HH22 ARG A 570 97.547 74.791 12.049 1.00 38.44 H new ATOM 2150 N THR A 571 92.524 76.356 11.909 1.00 31.74 N ATOM 2151 CA THR A 571 92.923 76.587 13.290 1.00 32.97 C ATOM 2152 C THR A 571 93.660 75.385 13.852 1.00 34.37 C ATOM 2153 O THR A 571 93.500 74.264 13.345 1.00 34.69 O ATOM 2154 CB THR A 571 91.706 76.909 14.177 1.00 36.61 C ATOM 2155 OG1 THR A 571 92.139 77.645 15.313 1.00 35.64 O ATOM 2156 CG2 THR A 571 90.955 75.625 14.658 1.00 36.70 C ATOM 0 H THR A 571 92.505 75.528 11.678 1.00 31.74 H new ATOM 0 HA THR A 571 93.520 77.352 13.292 1.00 32.97 H new ATOM 0 HB THR A 571 91.085 77.427 13.641 1.00 36.61 H new ATOM 0 HG1 THR A 571 91.478 77.824 15.799 1.00 35.64 H new ATOM 0 HG21 THR A 571 90.200 75.880 15.211 1.00 36.70 H new ATOM 0 HG22 THR A 571 90.638 75.128 13.888 1.00 36.70 H new ATOM 0 HG23 THR A 571 91.560 75.070 15.174 1.00 36.70 H new ATOM 2157 N ASN A 572 94.475 75.617 14.881 1.00 32.96 N ATOM 2158 CA ASN A 572 94.989 74.546 15.707 1.00 33.70 C ATOM 2159 C ASN A 572 94.172 74.596 16.982 1.00 33.42 C ATOM 2160 O ASN A 572 94.164 75.594 17.698 1.00 33.29 O ATOM 2161 CB ASN A 572 96.484 74.723 16.048 1.00 35.54 C ATOM 2162 CG ASN A 572 97.385 74.630 14.826 1.00 39.64 C ATOM 2163 OD1 ASN A 572 97.237 73.753 13.980 1.00 38.97 O ATOM 2164 ND2 ASN A 572 98.320 75.562 14.723 1.00 43.78 N ATOM 0 H ASN A 572 94.741 76.401 15.113 1.00 32.96 H new ATOM 0 HA ASN A 572 94.918 73.700 15.238 1.00 33.70 H new ATOM 0 HB2 ASN A 572 96.614 75.584 16.475 1.00 35.54 H new ATOM 0 HB3 ASN A 572 96.747 74.045 16.690 1.00 35.54 H new ATOM 0 HD21 ASN A 572 98.850 75.567 14.046 1.00 43.78 H new ATOM 0 HD22 ASN A 572 98.397 76.163 15.333 1.00 43.78 H new ATOM 2165 N GLN A 573 93.492 73.511 17.271 1.00 33.39 N ATOM 2166 CA GLN A 573 92.706 73.412 18.479 1.00 34.18 C ATOM 2167 C GLN A 573 93.604 72.733 19.490 1.00 33.02 C ATOM 2168 O GLN A 573 94.066 71.616 19.249 1.00 32.84 O ATOM 2169 CB GLN A 573 91.455 72.555 18.199 1.00 34.37 C ATOM 2170 CG GLN A 573 90.683 72.069 19.421 1.00 33.56 C ATOM 2171 CD GLN A 573 89.656 70.996 19.071 1.00 35.72 C ATOM 2172 OE1 GLN A 573 89.874 70.175 18.172 1.00 34.23 O ATOM 2173 NE2 GLN A 573 88.549 70.970 19.813 1.00 34.01 N ATOM 0 H GLN A 573 93.471 72.809 16.774 1.00 33.39 H new ATOM 0 HA GLN A 573 92.405 74.276 18.802 1.00 34.18 H new ATOM 0 HB2 GLN A 573 90.851 73.071 17.642 1.00 34.37 H new ATOM 0 HB3 GLN A 573 91.726 71.780 17.682 1.00 34.37 H new ATOM 0 HG2 GLN A 573 91.306 71.716 20.075 1.00 33.56 H new ATOM 0 HG3 GLN A 573 90.233 72.821 19.836 1.00 33.56 H new ATOM 0 HE21 GLN A 573 88.431 71.557 20.430 1.00 34.01 H new ATOM 0 HE22 GLN A 573 87.953 70.366 19.675 1.00 34.01 H new ATOM 2174 N CYS A 574 93.807 73.375 20.642 1.00 31.45 N ATOM 2175 CA CYS A 574 94.617 72.812 21.699 1.00 34.03 C ATOM 2176 C CYS A 574 93.735 72.276 22.800 1.00 32.49 C ATOM 2177 O CYS A 574 92.535 72.560 22.841 1.00 32.69 O ATOM 2178 CB CYS A 574 95.587 73.884 22.246 1.00 37.43 C ATOM 2179 SG CYS A 574 96.635 74.571 20.937 1.00 42.44 S ATOM 0 H CYS A 574 93.476 74.147 20.824 1.00 31.45 H new ATOM 0 HA CYS A 574 95.140 72.077 21.343 1.00 34.03 H new ATOM 0 HB2 CYS A 574 95.079 74.598 22.662 1.00 37.43 H new ATOM 0 HB3 CYS A 574 96.145 73.493 22.936 1.00 37.43 H new ATOM 0 HG CYS A 574 97.369 75.398 21.404 1.00 42.44 H new ATOM 2180 N ALA A 575 94.358 71.512 23.691 1.00 32.26 N ATOM 2181 CA ALA A 575 93.686 70.873 24.806 1.00 36.34 C ATOM 2182 C ALA A 575 92.885 71.922 25.585 1.00 38.00 C ATOM 2183 O ALA A 575 93.344 73.045 25.777 1.00 34.60 O ATOM 2184 CB ALA A 575 94.692 70.176 25.705 1.00 36.87 C ATOM 0 H ALA A 575 95.202 71.350 23.660 1.00 32.26 H new ATOM 0 HA ALA A 575 93.075 70.198 24.470 1.00 36.34 H new ATOM 0 HB1 ALA A 575 94.227 69.754 26.445 1.00 36.87 H new ATOM 0 HB2 ALA A 575 95.168 69.501 25.196 1.00 36.87 H new ATOM 0 HB3 ALA A 575 95.324 70.827 26.049 1.00 36.87 H new ATOM 2185 N GLY A 576 91.643 71.582 25.938 1.00 38.08 N ATOM 2186 CA GLY A 576 90.738 72.527 26.619 1.00 34.16 C ATOM 2187 C GLY A 576 90.039 73.525 25.731 1.00 35.63 C ATOM 2188 O GLY A 576 89.394 74.452 26.227 1.00 35.64 O ATOM 0 H GLY A 576 91.300 70.807 25.793 1.00 38.08 H new ATOM 0 HA2 GLY A 576 90.065 72.017 27.095 1.00 34.16 H new ATOM 0 HA3 GLY A 576 91.248 73.014 27.285 1.00 34.16 H new ATOM 2189 N GLU A 577 90.157 73.381 24.409 1.00 35.39 N ATOM 2190 CA GLU A 577 89.451 74.285 23.508 1.00 36.45 C ATOM 2191 C GLU A 577 88.345 73.544 22.742 1.00 34.50 C ATOM 2192 O GLU A 577 88.438 72.333 22.510 1.00 29.51 O ATOM 2193 CB GLU A 577 90.413 74.998 22.558 1.00 40.96 C ATOM 2194 CG GLU A 577 91.543 75.725 23.285 1.00 42.68 C ATOM 2195 CD GLU A 577 92.486 76.476 22.362 1.00 49.22 C ATOM 2196 OE1 GLU A 577 92.726 76.028 21.214 1.00 43.28 O ATOM 2197 OE2 GLU A 577 93.010 77.523 22.808 1.00 52.12 O ATOM 0 H GLU A 577 90.632 72.777 24.022 1.00 35.39 H new ATOM 0 HA GLU A 577 89.027 74.970 24.049 1.00 36.45 H new ATOM 0 HB2 GLU A 577 90.794 74.350 21.945 1.00 40.96 H new ATOM 0 HB3 GLU A 577 89.917 75.637 22.023 1.00 40.96 H new ATOM 0 HG2 GLU A 577 91.158 76.351 23.918 1.00 42.68 H new ATOM 0 HG3 GLU A 577 92.053 75.079 23.798 1.00 42.68 H new ATOM 2198 N PHE A 578 87.309 74.311 22.391 1.00 33.57 N ATOM 2199 CA PHE A 578 86.194 73.846 21.592 1.00 34.08 C ATOM 2200 C PHE A 578 86.363 74.333 20.183 1.00 33.43 C ATOM 2201 O PHE A 578 86.795 75.471 19.974 1.00 33.91 O ATOM 2202 CB PHE A 578 84.848 74.397 22.117 1.00 32.86 C ATOM 2203 CG PHE A 578 84.372 73.721 23.368 1.00 34.00 C ATOM 2204 CD1 PHE A 578 83.677 72.515 23.308 1.00 33.07 C ATOM 2205 CD2 PHE A 578 84.626 74.281 24.611 1.00 33.33 C ATOM 2206 CE1 PHE A 578 83.239 71.878 24.465 1.00 34.73 C ATOM 2207 CE2 PHE A 578 84.199 73.648 25.772 1.00 34.16 C ATOM 2208 CZ PHE A 578 83.518 72.441 25.707 1.00 36.21 C ATOM 0 H PHE A 578 87.242 75.137 22.622 1.00 33.57 H new ATOM 0 HA PHE A 578 86.182 72.877 21.638 1.00 34.08 H new ATOM 0 HB2 PHE A 578 84.940 75.348 22.287 1.00 32.86 H new ATOM 0 HB3 PHE A 578 84.174 74.296 21.427 1.00 32.86 H new ATOM 0 HD1 PHE A 578 83.503 72.129 22.480 1.00 33.07 H new ATOM 0 HD2 PHE A 578 85.086 75.087 24.668 1.00 33.33 H new ATOM 0 HE1 PHE A 578 82.763 71.081 24.409 1.00 34.73 H new ATOM 0 HE2 PHE A 578 84.371 74.037 26.599 1.00 34.16 H new ATOM 0 HZ PHE A 578 83.250 72.011 26.487 1.00 36.21 H new ATOM 2209 N VAL A 579 85.993 73.476 19.227 1.00 31.48 N ATOM 2210 CA VAL A 579 85.700 73.917 17.868 1.00 30.76 C ATOM 2211 C VAL A 579 84.202 73.664 17.601 1.00 30.97 C ATOM 2212 O VAL A 579 83.664 72.650 17.969 1.00 29.72 O ATOM 2213 CB VAL A 579 86.566 73.162 16.824 1.00 32.58 C ATOM 2214 CG1 VAL A 579 86.044 73.369 15.402 1.00 30.82 C ATOM 2215 CG2 VAL A 579 88.028 73.616 16.921 1.00 33.60 C ATOM 0 H VAL A 579 85.906 72.629 19.351 1.00 31.48 H new ATOM 0 HA VAL A 579 85.910 74.860 17.783 1.00 30.76 H new ATOM 0 HB VAL A 579 86.510 72.215 17.025 1.00 32.58 H new ATOM 0 HG11 VAL A 579 86.606 72.885 14.777 1.00 30.82 H new ATOM 0 HG12 VAL A 579 85.134 73.039 15.340 1.00 30.82 H new ATOM 0 HG13 VAL A 579 86.060 74.314 15.186 1.00 30.82 H new ATOM 0 HG21 VAL A 579 88.560 73.138 16.265 1.00 33.60 H new ATOM 0 HG22 VAL A 579 88.083 74.569 16.749 1.00 33.60 H new ATOM 0 HG23 VAL A 579 88.367 73.428 17.810 1.00 33.60 H new ATOM 2216 N ILE A 580 83.562 74.611 16.939 1.00 31.68 N ATOM 2217 CA ILE A 580 82.196 74.477 16.558 1.00 33.78 C ATOM 2218 C ILE A 580 82.148 74.571 15.042 1.00 34.60 C ATOM 2219 O ILE A 580 82.671 75.522 14.476 1.00 35.39 O ATOM 2220 CB ILE A 580 81.340 75.609 17.153 1.00 34.53 C ATOM 2221 CG1 ILE A 580 81.306 75.491 18.683 1.00 36.26 C ATOM 2222 CG2 ILE A 580 79.919 75.536 16.589 1.00 35.39 C ATOM 2223 CD1 ILE A 580 80.895 76.762 19.387 1.00 41.19 C ATOM 0 H ILE A 580 83.923 75.354 16.701 1.00 31.68 H new ATOM 0 HA ILE A 580 81.845 73.633 16.883 1.00 33.78 H new ATOM 0 HB ILE A 580 81.732 76.463 16.913 1.00 34.53 H new ATOM 0 HG12 ILE A 580 80.692 74.782 18.930 1.00 36.26 H new ATOM 0 HG13 ILE A 580 82.185 75.227 18.998 1.00 36.26 H new ATOM 0 HG21 ILE A 580 79.384 76.251 16.967 1.00 35.39 H new ATOM 0 HG22 ILE A 580 79.948 75.630 15.624 1.00 35.39 H new ATOM 0 HG23 ILE A 580 79.523 74.681 16.818 1.00 35.39 H new ATOM 0 HD11 ILE A 580 80.895 76.616 20.346 1.00 41.19 H new ATOM 0 HD12 ILE A 580 81.521 77.470 19.168 1.00 41.19 H new ATOM 0 HD13 ILE A 580 80.005 77.018 19.100 1.00 41.19 H new ATOM 2224 N THR A 581 81.478 73.618 14.401 1.00 34.28 N ATOM 2225 CA THR A 581 81.191 73.692 12.959 1.00 35.36 C ATOM 2226 C THR A 581 79.720 74.076 12.741 1.00 33.19 C ATOM 2227 O THR A 581 78.837 73.586 13.429 1.00 33.65 O ATOM 2228 CB THR A 581 81.557 72.376 12.222 1.00 36.90 C ATOM 2229 OG1 THR A 581 80.546 71.380 12.406 1.00 35.65 O ATOM 2230 CG2 THR A 581 82.899 71.790 12.734 1.00 37.36 C ATOM 0 H THR A 581 81.175 72.910 14.783 1.00 34.28 H new ATOM 0 HA THR A 581 81.752 74.382 12.573 1.00 35.36 H new ATOM 0 HB THR A 581 81.635 72.603 11.282 1.00 36.90 H new ATOM 0 HG1 THR A 581 80.738 70.905 13.071 1.00 35.65 H new ATOM 0 HG21 THR A 581 83.098 70.971 12.255 1.00 37.36 H new ATOM 0 HG22 THR A 581 83.610 72.432 12.585 1.00 37.36 H new ATOM 0 HG23 THR A 581 82.828 71.600 13.683 1.00 37.36 H new ATOM 2231 N PHE A 582 79.480 74.956 11.785 1.00 33.40 N ATOM 2232 CA PHE A 582 78.157 75.467 11.525 1.00 37.20 C ATOM 2233 C PHE A 582 77.466 74.613 10.426 1.00 39.69 C ATOM 2234 O PHE A 582 78.134 73.821 9.741 1.00 35.53 O ATOM 2235 CB PHE A 582 78.221 76.952 11.212 1.00 38.14 C ATOM 2236 CG PHE A 582 78.302 77.801 12.451 1.00 44.90 C ATOM 2237 CD1 PHE A 582 79.401 77.711 13.294 1.00 46.15 C ATOM 2238 CD2 PHE A 582 77.254 78.646 12.812 1.00 49.62 C ATOM 2239 CE1 PHE A 582 79.467 78.465 14.460 1.00 52.92 C ATOM 2240 CE2 PHE A 582 77.311 79.400 13.976 1.00 49.35 C ATOM 2241 CZ PHE A 582 78.416 79.306 14.801 1.00 52.35 C ATOM 0 H PHE A 582 80.088 75.274 11.266 1.00 33.40 H new ATOM 0 HA PHE A 582 77.601 75.388 12.316 1.00 37.20 H new ATOM 0 HB2 PHE A 582 78.993 77.128 10.652 1.00 38.14 H new ATOM 0 HB3 PHE A 582 77.437 77.206 10.701 1.00 38.14 H new ATOM 0 HD1 PHE A 582 80.102 77.139 13.076 1.00 46.15 H new ATOM 0 HD2 PHE A 582 76.505 78.706 12.264 1.00 49.62 H new ATOM 0 HE1 PHE A 582 80.214 78.406 15.011 1.00 52.92 H new ATOM 0 HE2 PHE A 582 76.608 79.966 14.200 1.00 49.35 H new ATOM 0 HZ PHE A 582 78.456 79.806 15.584 1.00 52.35 H new ATOM 2242 N PRO A 583 76.126 74.723 10.302 1.00 37.94 N ATOM 2243 CA PRO A 583 75.372 73.906 9.341 1.00 34.49 C ATOM 2244 C PRO A 583 75.916 73.995 7.927 1.00 32.15 C ATOM 2245 O PRO A 583 76.087 75.102 7.418 1.00 32.58 O ATOM 2246 CB PRO A 583 73.983 74.527 9.401 1.00 37.16 C ATOM 2247 CG PRO A 583 73.857 74.891 10.847 1.00 39.25 C ATOM 2248 CD PRO A 583 75.207 75.481 11.172 1.00 39.17 C ATOM 0 HA PRO A 583 75.410 72.962 9.561 1.00 34.49 H new ATOM 0 HB2 PRO A 583 73.909 75.304 8.825 1.00 37.16 H new ATOM 0 HB3 PRO A 583 73.295 73.902 9.124 1.00 37.16 H new ATOM 0 HG2 PRO A 583 73.142 75.529 10.995 1.00 39.25 H new ATOM 0 HG3 PRO A 583 73.663 74.115 11.396 1.00 39.25 H new ATOM 0 HD2 PRO A 583 75.237 76.432 10.983 1.00 39.17 H new ATOM 0 HD3 PRO A 583 75.429 75.371 12.110 1.00 39.17 H new ATOM 2249 N AARG A 584 76.179 72.844 7.301 0.45 32.03 N ATOM 2250 CA AARG A 584 76.647 72.774 5.907 0.45 32.01 C ATOM 2251 C AARG A 584 78.033 73.458 5.733 0.45 31.91 C ATOM 2252 O AARG A 584 78.355 73.889 4.625 0.45 30.75 O ATOM 2253 CB AARG A 584 75.537 73.319 4.955 0.45 31.94 C ATOM 2254 CG AARG A 584 75.735 73.350 3.425 0.45 32.01 C ATOM 2255 CD AARG A 584 75.646 72.013 2.668 0.45 31.31 C ATOM 2256 NE AARG A 584 75.069 72.139 1.307 0.45 25.34 N ATOM 2257 CZ AARG A 584 75.094 71.189 0.353 0.45 25.99 C ATOM 2258 NH1AARG A 584 75.680 70.000 0.536 0.45 22.95 N ATOM 2259 NH2AARG A 584 74.525 71.433 -0.832 0.45 25.51 N ATOM 2260 N BARG A 584 76.208 72.827 7.354 0.55 32.63 N ATOM 2261 CA BARG A 584 76.705 72.669 5.992 0.55 33.31 C ATOM 2262 C BARG A 584 78.138 73.191 5.747 0.55 33.25 C ATOM 2263 O BARG A 584 78.620 73.200 4.612 0.55 33.19 O ATOM 2264 CB BARG A 584 75.719 73.252 4.982 0.55 33.14 C ATOM 2265 CG BARG A 584 75.996 72.779 3.567 0.55 34.31 C ATOM 2266 CD BARG A 584 74.796 72.582 2.675 0.55 33.17 C ATOM 2267 NE BARG A 584 74.467 73.654 1.756 0.55 33.00 N ATOM 2268 CZ BARG A 584 74.074 73.516 0.483 0.55 29.75 C ATOM 2269 NH1BARG A 584 74.062 72.362 -0.148 0.55 28.82 N ATOM 2270 NH2BARG A 584 73.738 74.587 -0.188 0.55 31.24 N ATOM 0 H AARG A 584 76.091 72.074 7.675 0.45 32.63 H new ATOM 0 H BARG A 584 76.118 72.078 7.766 0.55 32.63 H new ATOM 0 HA AARG A 584 76.800 71.849 5.658 0.45 33.31 H new ATOM 0 HA BARG A 584 76.773 71.710 5.860 0.55 33.31 H new ATOM 0 HB2AARG A 584 74.737 72.797 5.126 0.45 33.14 H new ATOM 0 HB2BARG A 584 74.816 73.002 5.233 0.55 33.14 H new ATOM 0 HB3AARG A 584 75.347 74.229 5.234 0.45 33.14 H new ATOM 0 HB3BARG A 584 75.764 74.221 5.012 0.55 33.14 H new ATOM 0 HG2AARG A 584 75.072 73.951 3.050 0.45 34.31 H new ATOM 0 HG2BARG A 584 76.587 73.421 3.143 0.55 34.31 H new ATOM 0 HG3AARG A 584 76.605 73.739 3.244 0.45 34.31 H new ATOM 0 HG3BARG A 584 76.478 71.939 3.617 0.55 34.31 H new ATOM 0 HD2AARG A 584 76.534 71.628 2.600 0.45 33.17 H new ATOM 0 HD2BARG A 584 74.937 71.775 2.156 0.55 33.17 H new ATOM 0 HD3AARG A 584 75.107 71.393 3.184 0.45 33.17 H new ATOM 0 HD3BARG A 584 74.024 72.424 3.241 0.55 33.17 H new ATOM 0 HE AARG A 584 74.685 72.883 1.110 0.45 33.00 H new ATOM 0 HE BARG A 584 74.530 74.457 2.058 0.55 33.00 H new ATOM 0 HH11AARG A 584 76.060 69.819 1.286 0.45 28.82 H new ATOM 0 HH11BARG A 584 74.315 71.647 0.258 0.55 28.82 H new ATOM 0 HH12AARG A 584 75.676 69.417 -0.096 0.45 28.82 H new ATOM 0 HH12BARG A 584 73.801 72.322 -0.966 0.55 28.82 H new ATOM 0 HH21AARG A 584 74.147 72.191 -0.980 0.45 31.24 H new ATOM 0 HH21BARG A 584 73.772 75.359 0.189 0.55 31.24 H new ATOM 0 HH22AARG A 584 74.537 70.832 -1.447 0.45 31.24 H new ATOM 0 HH22BARG A 584 73.483 74.519 -1.007 0.55 31.24 H new ATOM 2271 N ALA A 585 78.826 73.551 6.820 1.00 30.47 N ATOM 2272 CA ALA A 585 80.247 73.992 6.759 1.00 30.38 C ATOM 2273 C ALA A 585 81.171 72.802 6.629 1.00 27.44 C ATOM 2274 O ALA A 585 81.349 72.018 7.560 1.00 31.26 O ATOM 2275 CB ALA A 585 80.627 74.770 8.009 1.00 29.41 C ATOM 0 H AALA A 585 78.558 73.361 7.615 0.45 30.47 H new ATOM 0 H BALA A 585 78.496 73.552 7.614 0.55 30.47 H new ATOM 0 HA ALA A 585 80.340 74.564 5.981 1.00 30.38 H new ATOM 0 HB1 ALA A 585 81.555 75.047 7.948 1.00 29.41 H new ATOM 0 HB2 ALA A 585 80.060 75.553 8.087 1.00 29.41 H new ATOM 0 HB3 ALA A 585 80.509 74.206 8.790 1.00 29.41 H new ATOM 2276 N TYR A 586 81.751 72.643 5.456 1.00 28.00 N ATOM 2277 CA TYR A 586 82.681 71.550 5.213 1.00 28.75 C ATOM 2278 C TYR A 586 83.915 71.698 6.128 1.00 28.91 C ATOM 2279 O TYR A 586 84.374 72.805 6.370 1.00 29.43 O ATOM 2280 CB TYR A 586 83.097 71.519 3.731 1.00 30.86 C ATOM 2281 CG TYR A 586 82.235 70.583 2.902 1.00 29.89 C ATOM 2282 CD1 TYR A 586 82.473 69.226 2.912 1.00 30.68 C ATOM 2283 CD2 TYR A 586 81.169 71.063 2.158 1.00 31.24 C ATOM 2284 CE1 TYR A 586 81.683 68.357 2.192 1.00 32.15 C ATOM 2285 CE2 TYR A 586 80.381 70.210 1.409 1.00 32.14 C ATOM 2286 CZ TYR A 586 80.642 68.858 1.450 1.00 32.21 C ATOM 2287 OH TYR A 586 79.882 67.987 0.732 1.00 38.64 O ATOM 0 H TYR A 586 81.621 73.159 4.780 1.00 28.00 H new ATOM 0 HA TYR A 586 82.243 70.709 5.419 1.00 28.75 H new ATOM 0 HB2 TYR A 586 83.041 72.415 3.364 1.00 30.86 H new ATOM 0 HB3 TYR A 586 84.025 71.243 3.665 1.00 30.86 H new ATOM 0 HD1 TYR A 586 83.180 68.890 3.414 1.00 30.68 H new ATOM 0 HD2 TYR A 586 80.981 71.974 2.163 1.00 31.24 H new ATOM 0 HE1 TYR A 586 81.853 67.443 2.208 1.00 32.15 H new ATOM 0 HE2 TYR A 586 79.687 70.543 0.887 1.00 32.14 H new ATOM 0 HH TYR A 586 79.241 68.399 0.379 1.00 38.64 H new ATOM 2288 N HIS A 587 84.400 70.596 6.668 1.00 28.31 N ATOM 2289 CA HIS A 587 85.611 70.631 7.449 1.00 28.68 C ATOM 2290 C HIS A 587 86.390 69.349 7.302 1.00 30.60 C ATOM 2291 O HIS A 587 85.824 68.292 6.991 1.00 29.77 O ATOM 2292 CB HIS A 587 85.327 70.936 8.923 1.00 29.63 C ATOM 2293 CG HIS A 587 84.313 70.026 9.550 1.00 30.22 C ATOM 2294 ND1 HIS A 587 82.960 70.218 9.371 1.00 30.11 N ATOM 2295 CD2 HIS A 587 84.440 68.939 10.349 1.00 29.54 C ATOM 2296 CE1 HIS A 587 82.297 69.286 10.024 1.00 32.37 C ATOM 2297 NE2 HIS A 587 83.165 68.497 10.629 1.00 32.71 N ATOM 0 H HIS A 587 84.041 69.818 6.592 1.00 28.31 H new ATOM 0 HA HIS A 587 86.156 71.355 7.103 1.00 28.68 H new ATOM 0 HB2 HIS A 587 86.156 70.874 9.422 1.00 29.63 H new ATOM 0 HB3 HIS A 587 85.018 71.852 9.000 1.00 29.63 H new ATOM 0 HD1 HIS A 587 82.604 70.848 8.906 1.00 30.11 H new ATOM 0 HD2 HIS A 587 85.235 68.563 10.651 1.00 29.54 H new ATOM 0 HE1 HIS A 587 81.372 69.198 10.054 1.00 32.37 H new ATOM 2298 N SER A 588 87.709 69.472 7.510 1.00 28.92 N ATOM 2299 CA SER A 588 88.647 68.365 7.520 1.00 26.66 C ATOM 2300 C SER A 588 89.825 68.728 8.427 1.00 27.13 C ATOM 2301 O SER A 588 89.943 69.850 8.900 1.00 28.04 O ATOM 2302 CB SER A 588 89.193 68.078 6.111 1.00 29.43 C ATOM 2303 OG SER A 588 89.965 69.187 5.663 1.00 30.14 O ATOM 0 H SER A 588 88.085 70.232 7.653 1.00 28.92 H new ATOM 0 HA SER A 588 88.183 67.576 7.840 1.00 26.66 H new ATOM 0 HB2 SER A 588 89.739 67.276 6.123 1.00 29.43 H new ATOM 0 HB3 SER A 588 88.460 67.913 5.497 1.00 29.43 H new ATOM 0 HG SER A 588 89.652 69.472 4.938 1.00 30.14 H new ATOM 2304 N GLY A 589 90.704 67.772 8.652 1.00 28.42 N ATOM 2305 CA GLY A 589 91.892 68.071 9.428 1.00 30.55 C ATOM 2306 C GLY A 589 92.685 66.857 9.769 1.00 29.34 C ATOM 2307 O GLY A 589 92.466 65.795 9.222 1.00 29.21 O ATOM 0 H GLY A 589 90.637 66.961 8.373 1.00 28.42 H new ATOM 0 HA2 GLY A 589 92.451 68.687 8.929 1.00 30.55 H new ATOM 0 HA3 GLY A 589 91.633 68.522 10.247 1.00 30.55 H new ATOM 2308 N PHE A 590 93.603 67.030 10.710 1.00 30.92 N ATOM 2309 CA PHE A 590 94.505 65.953 11.108 1.00 29.74 C ATOM 2310 C PHE A 590 95.043 66.275 12.499 1.00 28.78 C ATOM 2311 O PHE A 590 95.057 67.425 12.921 1.00 30.13 O ATOM 2312 CB PHE A 590 95.650 65.763 10.082 1.00 30.49 C ATOM 2313 CG PHE A 590 96.571 66.935 10.029 1.00 30.90 C ATOM 2314 CD1 PHE A 590 96.293 67.999 9.206 1.00 31.32 C ATOM 2315 CD2 PHE A 590 97.652 67.017 10.898 1.00 32.26 C ATOM 2316 CE1 PHE A 590 97.099 69.116 9.203 1.00 32.54 C ATOM 2317 CE2 PHE A 590 98.447 68.124 10.919 1.00 32.44 C ATOM 2318 CZ PHE A 590 98.168 69.188 10.082 1.00 33.12 C ATOM 0 H PHE A 590 93.722 67.768 11.135 1.00 30.92 H new ATOM 0 HA PHE A 590 94.022 65.112 11.132 1.00 29.74 H new ATOM 0 HB2 PHE A 590 96.156 64.968 10.311 1.00 30.49 H new ATOM 0 HB3 PHE A 590 95.270 65.614 9.202 1.00 30.49 H new ATOM 0 HD1 PHE A 590 95.552 67.965 8.645 1.00 31.32 H new ATOM 0 HD2 PHE A 590 97.835 66.308 11.472 1.00 32.26 H new ATOM 0 HE1 PHE A 590 96.927 69.816 8.616 1.00 32.54 H new ATOM 0 HE2 PHE A 590 99.176 68.163 11.495 1.00 32.44 H new ATOM 0 HZ PHE A 590 98.698 69.952 10.109 1.00 33.12 H new ATOM 2319 N ASN A 591 95.469 65.240 13.204 1.00 29.11 N ATOM 2320 CA ASN A 591 95.999 65.405 14.542 1.00 30.93 C ATOM 2321 C ASN A 591 97.518 65.583 14.480 1.00 32.27 C ATOM 2322 O ASN A 591 98.196 64.969 13.650 1.00 32.57 O ATOM 2323 CB ASN A 591 95.615 64.215 15.385 1.00 30.07 C ATOM 2324 CG ASN A 591 94.121 64.131 15.582 1.00 31.88 C ATOM 2325 OD1 ASN A 591 93.504 65.024 16.180 1.00 29.32 O ATOM 2326 ND2 ASN A 591 93.523 63.115 15.017 1.00 31.62 N ATOM 0 H ASN A 591 95.459 64.428 12.922 1.00 29.11 H new ATOM 0 HA ASN A 591 95.623 66.200 14.951 1.00 30.93 H new ATOM 0 HB2 ASN A 591 95.932 63.402 14.962 1.00 30.07 H new ATOM 0 HB3 ASN A 591 96.053 64.275 16.248 1.00 30.07 H new ATOM 0 HD21 ASN A 591 92.666 63.047 15.051 1.00 31.62 H new ATOM 0 HD22 ASN A 591 93.986 62.515 14.611 1.00 31.62 H new ATOM 2327 N GLN A 592 98.013 66.464 15.340 1.00 32.98 N ATOM 2328 CA GLN A 592 99.432 66.730 15.479 1.00 33.11 C ATOM 2329 C GLN A 592 100.142 65.625 16.212 1.00 33.96 C ATOM 2330 O GLN A 592 101.343 65.430 16.063 1.00 38.17 O ATOM 2331 CB GLN A 592 99.633 68.024 16.235 1.00 32.64 C ATOM 2332 CG GLN A 592 99.174 69.215 15.448 1.00 33.77 C ATOM 2333 CD GLN A 592 100.244 69.777 14.545 1.00 34.86 C ATOM 2334 OE1 GLN A 592 101.447 69.577 14.776 1.00 38.81 O ATOM 2335 NE2 GLN A 592 99.820 70.520 13.537 1.00 33.01 N ATOM 0 H GLN A 592 97.521 66.932 15.868 1.00 32.98 H new ATOM 0 HA GLN A 592 99.806 66.792 14.586 1.00 33.11 H new ATOM 0 HB2 GLN A 592 99.148 67.986 17.074 1.00 32.64 H new ATOM 0 HB3 GLN A 592 100.572 68.126 16.455 1.00 32.64 H new ATOM 0 HG2 GLN A 592 98.405 68.965 14.912 1.00 33.77 H new ATOM 0 HG3 GLN A 592 98.880 69.907 16.061 1.00 33.77 H new ATOM 0 HE21 GLN A 592 98.977 70.634 13.412 1.00 33.01 H new ATOM 0 HE22 GLN A 592 100.387 70.890 13.007 1.00 33.01 H new ATOM 2336 N GLY A 593 99.391 64.890 17.006 1.00 32.78 N ATOM 2337 CA GLY A 593 99.950 63.821 17.768 1.00 32.21 C ATOM 2338 C GLY A 593 98.885 63.175 18.616 1.00 33.43 C ATOM 2339 O GLY A 593 97.694 63.352 18.358 1.00 33.22 O ATOM 0 H GLY A 593 98.545 65.003 17.113 1.00 32.78 H new ATOM 0 HA2 GLY A 593 100.344 63.163 17.174 1.00 32.21 H new ATOM 0 HA3 GLY A 593 100.664 64.156 18.333 1.00 32.21 H new ATOM 2340 N PHE A 594 99.333 62.470 19.640 1.00 33.45 N ATOM 2341 CA PHE A 594 98.491 61.645 20.489 1.00 35.03 C ATOM 2342 C PHE A 594 97.533 62.585 21.219 1.00 33.84 C ATOM 2343 O PHE A 594 97.958 63.573 21.827 1.00 29.94 O ATOM 2344 CB PHE A 594 99.356 60.816 21.433 1.00 36.61 C ATOM 2345 CG PHE A 594 98.597 59.945 22.377 1.00 38.12 C ATOM 2346 CD1 PHE A 594 97.476 59.223 21.967 1.00 39.30 C ATOM 2347 CD2 PHE A 594 99.031 59.811 23.680 1.00 38.60 C ATOM 2348 CE1 PHE A 594 96.792 58.408 22.850 1.00 40.45 C ATOM 2349 CE2 PHE A 594 98.354 58.989 24.574 1.00 42.66 C ATOM 2350 CZ PHE A 594 97.237 58.278 24.157 1.00 43.06 C ATOM 0 H PHE A 594 100.162 62.457 19.868 1.00 33.45 H new ATOM 0 HA PHE A 594 97.972 61.006 19.977 1.00 35.03 H new ATOM 0 HB2 PHE A 594 99.947 60.259 20.903 1.00 36.61 H new ATOM 0 HB3 PHE A 594 99.918 61.417 21.948 1.00 36.61 H new ATOM 0 HD1 PHE A 594 97.184 59.291 21.087 1.00 39.30 H new ATOM 0 HD2 PHE A 594 99.785 60.276 23.963 1.00 38.60 H new ATOM 0 HE1 PHE A 594 96.035 57.948 22.568 1.00 40.45 H new ATOM 0 HE2 PHE A 594 98.650 58.915 25.453 1.00 42.66 H new ATOM 0 HZ PHE A 594 96.790 57.718 24.750 1.00 43.06 H new ATOM 2351 N ASN A 595 96.232 62.340 21.056 1.00 31.02 N ATOM 2352 CA ASN A 595 95.241 63.160 21.711 1.00 30.72 C ATOM 2353 C ASN A 595 93.875 62.482 21.861 1.00 33.01 C ATOM 2354 O ASN A 595 93.674 61.378 21.384 1.00 32.01 O ATOM 2355 CB ASN A 595 95.122 64.504 20.990 1.00 29.45 C ATOM 2356 CG ASN A 595 94.568 64.381 19.580 1.00 29.09 C ATOM 2357 OD1 ASN A 595 94.050 63.353 19.186 1.00 29.73 O ATOM 2358 ND2 ASN A 595 94.681 65.452 18.823 1.00 28.28 N ATOM 0 H ASN A 595 95.913 61.705 20.571 1.00 31.02 H new ATOM 0 HA ASN A 595 95.551 63.305 22.619 1.00 30.72 H new ATOM 0 HB2 ASN A 595 94.548 65.092 21.506 1.00 29.45 H new ATOM 0 HB3 ASN A 595 95.996 64.922 20.952 1.00 29.45 H new ATOM 0 HD21 ASN A 595 94.383 65.442 18.016 1.00 28.28 H new ATOM 0 HD22 ASN A 595 95.053 66.162 19.135 1.00 28.28 H new ATOM 2359 N PHE A 596 92.947 63.170 22.517 1.00 34.89 N ATOM 2360 CA PHE A 596 91.674 62.585 22.913 1.00 35.57 C ATOM 2361 C PHE A 596 90.650 63.662 22.834 1.00 33.61 C ATOM 2362 O PHE A 596 90.731 64.664 23.553 1.00 32.21 O ATOM 2363 CB PHE A 596 91.751 62.034 24.322 1.00 41.59 C ATOM 2364 CG PHE A 596 90.547 61.199 24.724 1.00 44.61 C ATOM 2365 CD1 PHE A 596 89.366 61.807 25.158 1.00 46.83 C ATOM 2366 CD2 PHE A 596 90.614 59.806 24.717 1.00 52.65 C ATOM 2367 CE1 PHE A 596 88.262 61.051 25.556 1.00 49.90 C ATOM 2368 CE2 PHE A 596 89.504 59.034 25.103 1.00 56.98 C ATOM 2369 CZ PHE A 596 88.324 59.668 25.520 1.00 51.57 C ATOM 0 H PHE A 596 93.040 63.994 22.746 1.00 34.89 H new ATOM 0 HA PHE A 596 91.444 61.847 22.327 1.00 35.57 H new ATOM 0 HB2 PHE A 596 92.551 61.492 24.404 1.00 41.59 H new ATOM 0 HB3 PHE A 596 91.843 62.773 24.944 1.00 41.59 H new ATOM 0 HD1 PHE A 596 89.314 62.735 25.182 1.00 46.83 H new ATOM 0 HD2 PHE A 596 91.400 59.384 24.455 1.00 52.65 H new ATOM 0 HE1 PHE A 596 87.486 61.475 25.845 1.00 49.90 H new ATOM 0 HE2 PHE A 596 89.552 58.105 25.082 1.00 56.98 H new ATOM 0 HZ PHE A 596 87.586 59.161 25.771 1.00 51.57 H new ATOM 2370 N ALA A 597 89.709 63.473 21.915 1.00 30.94 N ATOM 2371 CA ALA A 597 88.671 64.450 21.657 1.00 30.87 C ATOM 2372 C ALA A 597 87.306 63.808 21.748 1.00 31.46 C ATOM 2373 O ALA A 597 87.176 62.598 21.683 1.00 33.27 O ATOM 2374 CB ALA A 597 88.843 65.053 20.288 1.00 30.19 C ATOM 0 H ALA A 597 89.658 62.769 21.423 1.00 30.94 H new ATOM 0 HA ALA A 597 88.743 65.148 22.327 1.00 30.87 H new ATOM 0 HB1 ALA A 597 88.141 65.704 20.131 1.00 30.19 H new ATOM 0 HB2 ALA A 597 89.707 65.490 20.233 1.00 30.19 H new ATOM 0 HB3 ALA A 597 88.791 64.354 19.617 1.00 30.19 H new ATOM 2375 N GLU A 598 86.299 64.661 21.859 1.00 33.72 N ATOM 2376 CA GLU A 598 84.935 64.233 22.050 1.00 33.92 C ATOM 2377 C GLU A 598 84.073 65.249 21.384 1.00 32.28 C ATOM 2378 O GLU A 598 84.294 66.457 21.536 1.00 33.05 O ATOM 2379 CB GLU A 598 84.611 64.128 23.533 1.00 40.38 C ATOM 2380 CG GLU A 598 83.151 63.811 23.839 1.00 42.25 C ATOM 2381 CD GLU A 598 82.904 63.335 25.267 1.00 46.69 C ATOM 2382 OE1 GLU A 598 83.851 63.356 26.088 1.00 45.95 O ATOM 2383 OE2 GLU A 598 81.742 62.939 25.573 1.00 48.85 O ATOM 0 H GLU A 598 86.395 65.515 21.824 1.00 33.72 H new ATOM 0 HA GLU A 598 84.786 63.354 21.668 1.00 33.92 H new ATOM 0 HB2 GLU A 598 85.169 63.439 23.927 1.00 40.38 H new ATOM 0 HB3 GLU A 598 84.846 64.965 23.964 1.00 40.38 H new ATOM 0 HG2 GLU A 598 82.617 64.604 23.675 1.00 42.25 H new ATOM 0 HG3 GLU A 598 82.842 63.129 23.223 1.00 42.25 H new ATOM 2384 N ALA A 599 83.128 64.767 20.576 1.00 32.04 N ATOM 2385 CA ALA A 599 82.334 65.644 19.751 1.00 32.99 C ATOM 2386 C ALA A 599 80.885 65.156 19.665 1.00 33.66 C ATOM 2387 O ALA A 599 80.620 63.964 19.759 1.00 32.73 O ATOM 2388 CB ALA A 599 82.949 65.696 18.358 1.00 31.95 C ATOM 0 H ALA A 599 82.938 63.932 20.498 1.00 32.04 H new ATOM 0 HA ALA A 599 82.326 66.530 20.146 1.00 32.99 H new ATOM 0 HB1 ALA A 599 82.423 66.284 17.793 1.00 31.95 H new ATOM 0 HB2 ALA A 599 83.857 66.033 18.417 1.00 31.95 H new ATOM 0 HB3 ALA A 599 82.960 64.805 17.975 1.00 31.95 H new ATOM 2389 N VAL A 600 79.976 66.079 19.399 1.00 35.04 N ATOM 2390 CA VAL A 600 78.574 65.703 19.278 1.00 37.67 C ATOM 2391 C VAL A 600 77.886 66.629 18.308 1.00 35.43 C ATOM 2392 O VAL A 600 78.285 67.787 18.145 1.00 34.94 O ATOM 2393 CB VAL A 600 77.886 65.727 20.675 1.00 38.80 C ATOM 2394 CG1 VAL A 600 77.588 67.152 21.102 1.00 35.78 C ATOM 2395 CG2 VAL A 600 76.625 64.878 20.685 1.00 42.29 C ATOM 0 H VAL A 600 80.143 66.915 19.286 1.00 35.04 H new ATOM 0 HA VAL A 600 78.508 64.798 18.935 1.00 37.67 H new ATOM 0 HB VAL A 600 78.502 65.342 21.317 1.00 38.80 H new ATOM 0 HG11 VAL A 600 77.160 67.146 21.973 1.00 35.78 H new ATOM 0 HG12 VAL A 600 78.416 67.655 21.152 1.00 35.78 H new ATOM 0 HG13 VAL A 600 76.997 67.567 20.455 1.00 35.78 H new ATOM 0 HG21 VAL A 600 76.219 64.912 21.565 1.00 42.29 H new ATOM 0 HG22 VAL A 600 75.999 65.220 20.027 1.00 42.29 H new ATOM 0 HG23 VAL A 600 76.851 63.960 20.469 1.00 42.29 H new ATOM 2396 N ASN A 601 76.835 66.109 17.674 1.00 35.68 N ATOM 2397 CA ASN A 601 75.974 66.913 16.801 1.00 35.52 C ATOM 2398 C ASN A 601 74.912 67.612 17.607 1.00 35.48 C ATOM 2399 O ASN A 601 74.537 67.127 18.647 1.00 36.98 O ATOM 2400 CB ASN A 601 75.342 66.014 15.728 1.00 37.15 C ATOM 2401 CG ASN A 601 76.376 65.506 14.751 1.00 36.75 C ATOM 2402 OD1 ASN A 601 76.642 64.314 14.678 1.00 40.95 O ATOM 2403 ND2 ASN A 601 77.030 66.437 14.060 1.00 38.01 N ATOM 0 H ASN A 601 76.601 65.284 17.736 1.00 35.68 H new ATOM 0 HA ASN A 601 76.511 67.592 16.363 1.00 35.52 H new ATOM 0 HB2 ASN A 601 74.900 65.262 16.153 1.00 37.15 H new ATOM 0 HB3 ASN A 601 74.660 66.510 15.250 1.00 37.15 H new ATOM 0 HD21 ASN A 601 77.671 66.211 13.533 1.00 38.01 H new ATOM 0 HD22 ASN A 601 76.811 67.265 14.140 1.00 38.01 H new ATOM 2404 N PHE A 602 74.470 68.772 17.146 1.00 38.63 N ATOM 2405 CA PHE A 602 73.302 69.391 17.728 1.00 41.81 C ATOM 2406 C PHE A 602 72.634 70.313 16.737 1.00 41.03 C ATOM 2407 O PHE A 602 73.218 70.714 15.739 1.00 41.42 O ATOM 2408 CB PHE A 602 73.656 70.155 19.020 1.00 44.82 C ATOM 2409 CG PHE A 602 74.524 71.352 18.791 1.00 41.57 C ATOM 2410 CD1 PHE A 602 75.899 71.206 18.649 1.00 41.77 C ATOM 2411 CD2 PHE A 602 73.973 72.614 18.683 1.00 42.20 C ATOM 2412 CE1 PHE A 602 76.695 72.316 18.404 1.00 40.38 C ATOM 2413 CE2 PHE A 602 74.759 73.732 18.456 1.00 41.44 C ATOM 2414 CZ PHE A 602 76.124 73.586 18.324 1.00 44.30 C ATOM 0 H PHE A 602 74.832 69.211 16.501 1.00 38.63 H new ATOM 0 HA PHE A 602 72.680 68.683 17.959 1.00 41.81 H new ATOM 0 HB2 PHE A 602 72.836 70.438 19.454 1.00 44.82 H new ATOM 0 HB3 PHE A 602 74.106 69.551 19.631 1.00 44.82 H new ATOM 0 HD1 PHE A 602 76.286 70.363 18.718 1.00 41.77 H new ATOM 0 HD2 PHE A 602 73.052 72.716 18.765 1.00 42.20 H new ATOM 0 HE1 PHE A 602 77.613 72.213 18.293 1.00 40.38 H new ATOM 0 HE2 PHE A 602 74.369 74.574 18.393 1.00 41.44 H new ATOM 0 HZ PHE A 602 76.662 74.331 18.182 1.00 44.30 H new ATOM 2415 N CYS A 603 71.405 70.676 17.064 1.00 38.33 N ATOM 2416 CA CYS A 603 70.561 71.478 16.224 1.00 39.42 C ATOM 2417 C CYS A 603 69.838 72.527 17.050 1.00 39.25 C ATOM 2418 O CYS A 603 69.177 72.198 18.018 1.00 45.04 O ATOM 2419 CB CYS A 603 69.521 70.564 15.591 1.00 42.51 C ATOM 2420 SG CYS A 603 70.195 69.286 14.515 1.00 45.55 S ATOM 0 H CYS A 603 71.034 70.451 17.807 1.00 38.33 H new ATOM 0 HA CYS A 603 71.101 71.920 15.550 1.00 39.42 H new ATOM 0 HB2 CYS A 603 69.010 70.138 16.297 1.00 42.51 H new ATOM 0 HB3 CYS A 603 68.901 71.106 15.079 1.00 42.51 H new ATOM 0 HG CYS A 603 69.860 69.498 13.382 1.00 45.55 H new ATOM 2421 N THR A 604 69.941 73.779 16.640 1.00 40.85 N ATOM 2422 CA THR A 604 69.307 74.906 17.315 1.00 43.89 C ATOM 2423 C THR A 604 68.079 75.307 16.501 1.00 46.25 C ATOM 2424 O THR A 604 67.825 74.717 15.451 1.00 45.45 O ATOM 2425 CB THR A 604 70.261 76.119 17.354 1.00 41.19 C ATOM 2426 OG1 THR A 604 70.470 76.613 16.029 1.00 42.70 O ATOM 2427 CG2 THR A 604 71.588 75.736 17.927 1.00 46.40 C ATOM 0 H THR A 604 70.392 74.007 15.944 1.00 40.85 H new ATOM 0 HA THR A 604 69.075 74.649 18.221 1.00 43.89 H new ATOM 0 HB THR A 604 69.854 76.801 17.911 1.00 41.19 H new ATOM 0 HG1 THR A 604 71.166 76.269 15.708 1.00 42.70 H new ATOM 0 HG21 THR A 604 72.170 76.512 17.942 1.00 46.40 H new ATOM 0 HG22 THR A 604 71.467 75.405 18.831 1.00 46.40 H new ATOM 0 HG23 THR A 604 71.989 75.042 17.380 1.00 46.40 H new ATOM 2428 N VAL A 605 67.358 76.330 16.961 1.00 49.01 N ATOM 2429 CA VAL A 605 66.221 76.904 16.224 1.00 51.07 C ATOM 2430 C VAL A 605 66.628 77.573 14.933 1.00 53.05 C ATOM 2431 O VAL A 605 65.868 77.591 13.975 1.00 53.07 O ATOM 2432 CB VAL A 605 65.400 77.945 17.047 1.00 51.98 C ATOM 2433 CG1 VAL A 605 64.784 77.284 18.261 1.00 49.52 C ATOM 2434 CG2 VAL A 605 66.214 79.197 17.421 1.00 54.68 C ATOM 0 H VAL A 605 67.513 76.715 17.714 1.00 49.01 H new ATOM 0 HA VAL A 605 65.666 76.130 16.038 1.00 51.07 H new ATOM 0 HB VAL A 605 64.685 78.266 16.475 1.00 51.98 H new ATOM 0 HG11 VAL A 605 64.277 77.940 18.764 1.00 49.52 H new ATOM 0 HG12 VAL A 605 64.194 76.569 17.976 1.00 49.52 H new ATOM 0 HG13 VAL A 605 65.486 76.919 18.822 1.00 49.52 H new ATOM 0 HG21 VAL A 605 65.656 79.806 17.929 1.00 54.68 H new ATOM 0 HG22 VAL A 605 66.980 78.937 17.957 1.00 54.68 H new ATOM 0 HG23 VAL A 605 66.520 79.638 16.613 1.00 54.68 H new ATOM 2435 N ASP A 606 67.833 78.127 14.912 1.00 56.60 N ATOM 2436 CA ASP A 606 68.396 78.690 13.691 1.00 55.30 C ATOM 2437 C ASP A 606 68.543 77.646 12.567 1.00 47.59 C ATOM 2438 O ASP A 606 68.512 77.990 11.387 1.00 52.88 O ATOM 2439 CB ASP A 606 69.756 79.335 14.000 1.00 63.09 C ATOM 2440 CG ASP A 606 69.638 80.491 15.000 1.00 73.10 C ATOM 2441 OD1 ASP A 606 69.347 81.629 14.577 1.00 79.06 O ATOM 2442 OD2 ASP A 606 69.822 80.253 16.212 1.00 82.04 O ATOM 0 H ASP A 606 68.345 78.188 15.600 1.00 56.60 H new ATOM 0 HA ASP A 606 67.776 79.362 13.368 1.00 55.30 H new ATOM 0 HB2 ASP A 606 70.357 78.662 14.356 1.00 63.09 H new ATOM 0 HB3 ASP A 606 70.151 79.661 13.177 1.00 63.09 H new ATOM 2443 N TRP A 607 68.715 76.384 12.950 1.00 42.47 N ATOM 2444 CA TRP A 607 68.963 75.305 12.019 1.00 39.51 C ATOM 2445 C TRP A 607 67.680 74.786 11.343 1.00 41.19 C ATOM 2446 O TRP A 607 67.764 74.270 10.237 1.00 37.07 O ATOM 2447 CB TRP A 607 69.705 74.178 12.727 1.00 37.17 C ATOM 2448 CG TRP A 607 69.685 72.875 12.042 1.00 37.69 C ATOM 2449 CD1 TRP A 607 70.588 72.412 11.140 1.00 36.58 C ATOM 2450 CD2 TRP A 607 68.691 71.867 12.177 1.00 37.34 C ATOM 2451 NE1 TRP A 607 70.229 71.163 10.710 1.00 35.32 N ATOM 2452 CE2 TRP A 607 69.062 70.804 11.333 1.00 37.47 C ATOM 2453 CE3 TRP A 607 67.521 71.755 12.936 1.00 38.80 C ATOM 2454 CZ2 TRP A 607 68.306 69.633 11.224 1.00 38.10 C ATOM 2455 CZ3 TRP A 607 66.764 70.587 12.828 1.00 40.16 C ATOM 2456 CH2 TRP A 607 67.171 69.539 11.985 1.00 40.34 C ATOM 0 H TRP A 607 68.689 76.133 13.772 1.00 42.47 H new ATOM 0 HA TRP A 607 69.516 75.658 11.304 1.00 39.51 H new ATOM 0 HB2 TRP A 607 70.629 74.447 12.849 1.00 37.17 H new ATOM 0 HB3 TRP A 607 69.323 74.066 13.612 1.00 37.17 H new ATOM 0 HD1 TRP A 607 71.342 72.876 10.855 1.00 36.58 H new ATOM 0 HE1 TRP A 607 70.663 70.683 10.143 1.00 35.32 H new ATOM 0 HE3 TRP A 607 67.253 72.444 13.500 1.00 38.80 H new ATOM 0 HZ2 TRP A 607 68.564 68.943 10.656 1.00 38.10 H new ATOM 0 HZ3 TRP A 607 65.980 70.501 13.321 1.00 40.16 H new ATOM 0 HH2 TRP A 607 66.658 68.764 11.943 1.00 40.34 H new ATOM 2457 N LEU A 608 66.514 74.898 11.995 1.00 41.83 N ATOM 2458 CA LEU A 608 65.282 74.249 11.483 1.00 42.67 C ATOM 2459 C LEU A 608 65.041 74.394 9.987 1.00 38.46 C ATOM 2460 O LEU A 608 64.851 73.400 9.320 1.00 39.08 O ATOM 2461 CB LEU A 608 64.026 74.698 12.251 1.00 45.76 C ATOM 2462 CG LEU A 608 63.819 73.934 13.554 1.00 48.26 C ATOM 2463 CD1 LEU A 608 62.854 74.685 14.466 1.00 53.54 C ATOM 2464 CD2 LEU A 608 63.353 72.513 13.298 1.00 48.82 C ATOM 0 H LEU A 608 66.410 75.338 12.726 1.00 41.83 H new ATOM 0 HA LEU A 608 65.447 73.306 11.642 1.00 42.67 H new ATOM 0 HB2 LEU A 608 64.093 75.646 12.445 1.00 45.76 H new ATOM 0 HB3 LEU A 608 63.247 74.579 11.685 1.00 45.76 H new ATOM 0 HG LEU A 608 64.675 73.873 14.007 1.00 48.26 H new ATOM 0 HD11 LEU A 608 62.733 74.187 15.290 1.00 53.54 H new ATOM 0 HD12 LEU A 608 63.216 75.562 14.669 1.00 53.54 H new ATOM 0 HD13 LEU A 608 61.998 74.785 14.020 1.00 53.54 H new ATOM 0 HD21 LEU A 608 63.231 72.055 14.144 1.00 48.82 H new ATOM 0 HD22 LEU A 608 62.512 72.530 12.816 1.00 48.82 H new ATOM 0 HD23 LEU A 608 64.018 72.044 12.770 1.00 48.82 H new ATOM 2465 N PRO A 609 65.063 75.622 9.456 1.00 39.58 N ATOM 2466 CA PRO A 609 64.827 75.736 8.006 1.00 42.64 C ATOM 2467 C PRO A 609 65.898 75.081 7.117 1.00 45.05 C ATOM 2468 O PRO A 609 65.576 74.610 6.024 1.00 42.17 O ATOM 2469 CB PRO A 609 64.736 77.249 7.764 1.00 44.85 C ATOM 2470 CG PRO A 609 65.222 77.902 9.015 1.00 45.04 C ATOM 2471 CD PRO A 609 65.091 76.928 10.133 1.00 42.57 C ATOM 0 HA PRO A 609 64.025 75.251 7.756 1.00 42.64 H new ATOM 0 HB2 PRO A 609 65.278 77.511 7.004 1.00 44.85 H new ATOM 0 HB3 PRO A 609 63.824 77.514 7.567 1.00 44.85 H new ATOM 0 HG2 PRO A 609 66.146 78.179 8.915 1.00 45.04 H new ATOM 0 HG3 PRO A 609 64.705 78.702 9.201 1.00 45.04 H new ATOM 0 HD2 PRO A 609 65.836 76.993 10.751 1.00 42.57 H new ATOM 0 HD3 PRO A 609 64.282 77.081 10.646 1.00 42.57 H new ATOM 2472 N LEU A 610 67.141 75.025 7.599 1.00 42.41 N ATOM 2473 CA LEU A 610 68.220 74.358 6.877 1.00 42.44 C ATOM 2474 C LEU A 610 68.045 72.861 6.947 1.00 37.90 C ATOM 2475 O LEU A 610 68.340 72.152 6.004 1.00 36.15 O ATOM 2476 CB LEU A 610 69.596 74.744 7.456 1.00 43.85 C ATOM 2477 CG LEU A 610 69.896 76.243 7.404 1.00 48.68 C ATOM 2478 CD1 LEU A 610 71.020 76.585 8.364 1.00 51.01 C ATOM 2479 CD2 LEU A 610 70.228 76.694 5.986 1.00 52.00 C ATOM 0 H LEU A 610 67.379 75.371 8.349 1.00 42.41 H new ATOM 0 HA LEU A 610 68.182 74.646 5.951 1.00 42.44 H new ATOM 0 HB2 LEU A 610 69.644 74.446 8.378 1.00 43.85 H new ATOM 0 HB3 LEU A 610 70.287 74.268 6.968 1.00 43.85 H new ATOM 0 HG LEU A 610 69.099 76.723 7.679 1.00 48.68 H new ATOM 0 HD11 LEU A 610 71.202 77.537 8.323 1.00 51.01 H new ATOM 0 HD12 LEU A 610 70.759 76.344 9.267 1.00 51.01 H new ATOM 0 HD13 LEU A 610 71.818 76.093 8.117 1.00 51.01 H new ATOM 0 HD21 LEU A 610 70.413 77.646 5.984 1.00 52.00 H new ATOM 0 HD22 LEU A 610 71.008 76.213 5.667 1.00 52.00 H new ATOM 0 HD23 LEU A 610 69.475 76.510 5.403 1.00 52.00 H new ATOM 2480 N GLY A 611 67.599 72.368 8.092 1.00 36.42 N ATOM 2481 CA GLY A 611 67.171 70.977 8.212 1.00 38.31 C ATOM 2482 C GLY A 611 66.200 70.563 7.113 1.00 38.75 C ATOM 2483 O GLY A 611 66.386 69.522 6.489 1.00 38.32 O ATOM 0 H GLY A 611 67.535 72.824 8.819 1.00 36.42 H new ATOM 0 HA2 GLY A 611 67.950 70.399 8.185 1.00 38.31 H new ATOM 0 HA3 GLY A 611 66.751 70.845 9.076 1.00 38.31 H new ATOM 2484 N ARG A 612 65.197 71.406 6.858 1.00 38.25 N ATOM 2485 CA ARG A 612 64.209 71.132 5.822 1.00 39.43 C ATOM 2486 C ARG A 612 64.837 71.196 4.429 1.00 38.43 C ATOM 2487 O ARG A 612 64.584 70.324 3.580 1.00 34.73 O ATOM 2488 CB ARG A 612 63.003 72.094 5.923 1.00 38.04 C ATOM 2489 CG ARG A 612 61.942 71.836 4.829 1.00 39.41 C ATOM 2490 CD ARG A 612 60.652 72.595 5.068 1.00 36.43 C ATOM 2491 NE ARG A 612 60.130 72.180 6.354 1.00 36.69 N ATOM 2492 CZ ARG A 612 59.463 71.054 6.580 1.00 34.08 C ATOM 2493 NH1 ARG A 612 59.142 70.229 5.595 1.00 36.43 N ATOM 2494 NH2 ARG A 612 59.113 70.752 7.813 1.00 35.21 N ATOM 0 H ARG A 612 65.074 72.146 7.279 1.00 38.25 H new ATOM 0 HA ARG A 612 63.882 70.230 5.965 1.00 39.43 H new ATOM 0 HB2 ARG A 612 62.591 72.000 6.796 1.00 38.04 H new ATOM 0 HB3 ARG A 612 63.317 73.009 5.854 1.00 38.04 H new ATOM 0 HG2 ARG A 612 62.306 72.089 3.966 1.00 39.41 H new ATOM 0 HG3 ARG A 612 61.750 70.886 4.788 1.00 39.41 H new ATOM 0 HD2 ARG A 612 60.813 73.552 5.058 1.00 36.43 H new ATOM 0 HD3 ARG A 612 60.011 72.408 4.364 1.00 36.43 H new ATOM 0 HE ARG A 612 60.262 72.704 7.023 1.00 36.69 H new ATOM 0 HH11 ARG A 612 59.366 70.417 4.786 1.00 36.43 H new ATOM 0 HH12 ARG A 612 58.710 69.505 5.764 1.00 36.43 H new ATOM 0 HH21 ARG A 612 59.317 71.281 8.460 1.00 35.21 H new ATOM 0 HH22 ARG A 612 58.681 70.026 7.972 1.00 35.21 H new ATOM 2495 N GLN A 613 65.670 72.206 4.195 1.00 39.65 N ATOM 2496 CA GLN A 613 66.403 72.286 2.928 1.00 40.90 C ATOM 2497 C GLN A 613 67.316 71.099 2.729 1.00 39.79 C ATOM 2498 O GLN A 613 67.418 70.582 1.615 1.00 40.32 O ATOM 2499 CB GLN A 613 67.233 73.543 2.829 1.00 46.09 C ATOM 2500 CG GLN A 613 66.425 74.811 2.754 1.00 52.33 C ATOM 2501 CD GLN A 613 67.293 76.025 3.031 1.00 60.15 C ATOM 2502 OE1 GLN A 613 68.467 76.071 2.629 1.00 57.68 O ATOM 2503 NE2 GLN A 613 66.731 77.008 3.732 1.00 62.45 N ATOM 0 H GLN A 613 65.826 72.848 4.746 1.00 39.65 H new ATOM 0 HA GLN A 613 65.724 72.294 2.236 1.00 40.90 H new ATOM 0 HB2 GLN A 613 67.822 73.591 3.598 1.00 46.09 H new ATOM 0 HB3 GLN A 613 67.798 73.484 2.043 1.00 46.09 H new ATOM 0 HG2 GLN A 613 66.022 74.891 1.875 1.00 52.33 H new ATOM 0 HG3 GLN A 613 65.699 74.775 3.396 1.00 52.33 H new ATOM 0 HE21 GLN A 613 65.914 76.938 3.992 1.00 62.45 H new ATOM 0 HE22 GLN A 613 67.185 77.713 3.924 1.00 62.45 H new ATOM 2504 N CYS A 614 67.957 70.645 3.802 1.00 35.65 N ATOM 2505 CA CYS A 614 68.801 69.482 3.699 1.00 35.58 C ATOM 2506 C CYS A 614 68.062 68.226 3.255 1.00 36.61 C ATOM 2507 O CYS A 614 68.597 67.427 2.483 1.00 35.14 O ATOM 2508 CB CYS A 614 69.498 69.183 5.014 1.00 34.75 C ATOM 2509 SG CYS A 614 70.635 67.807 4.844 1.00 38.68 S ATOM 0 H CYS A 614 67.912 70.997 4.586 1.00 35.65 H new ATOM 0 HA CYS A 614 69.449 69.709 3.014 1.00 35.58 H new ATOM 0 HB2 CYS A 614 69.980 69.969 5.314 1.00 34.75 H new ATOM 0 HB3 CYS A 614 68.838 68.978 5.694 1.00 34.75 H new ATOM 0 HG CYS A 614 71.761 68.221 4.799 1.00 38.68 H new ATOM 2510 N VAL A 615 66.864 68.008 3.783 1.00 36.76 N ATOM 2511 CA VAL A 615 66.113 66.801 3.438 1.00 34.58 C ATOM 2512 C VAL A 615 65.679 66.842 1.976 1.00 31.07 C ATOM 2513 O VAL A 615 65.683 65.813 1.289 1.00 32.91 O ATOM 2514 CB VAL A 615 64.914 66.608 4.397 1.00 39.59 C ATOM 2515 CG1 VAL A 615 63.934 65.523 3.900 1.00 39.37 C ATOM 2516 CG2 VAL A 615 65.445 66.245 5.769 1.00 39.81 C ATOM 0 H VAL A 615 66.470 68.536 4.336 1.00 36.76 H new ATOM 0 HA VAL A 615 66.692 66.030 3.547 1.00 34.58 H new ATOM 0 HB VAL A 615 64.415 67.439 4.434 1.00 39.59 H new ATOM 0 HG11 VAL A 615 63.201 65.436 4.529 1.00 39.37 H new ATOM 0 HG12 VAL A 615 63.585 65.775 3.031 1.00 39.37 H new ATOM 0 HG13 VAL A 615 64.399 64.675 3.827 1.00 39.37 H new ATOM 0 HG21 VAL A 615 64.703 66.121 6.381 1.00 39.81 H new ATOM 0 HG22 VAL A 615 65.957 65.423 5.711 1.00 39.81 H new ATOM 0 HG23 VAL A 615 66.016 66.958 6.094 1.00 39.81 H new ATOM 2517 N GLU A 616 65.286 68.020 1.525 1.00 33.08 N ATOM 2518 CA GLU A 616 65.017 68.262 0.127 1.00 39.03 C ATOM 2519 C GLU A 616 66.239 67.981 -0.742 1.00 41.89 C ATOM 2520 O GLU A 616 66.140 67.325 -1.782 1.00 37.29 O ATOM 2521 CB GLU A 616 64.573 69.693 -0.066 1.00 47.23 C ATOM 2522 CG GLU A 616 64.471 70.104 -1.524 1.00 54.92 C ATOM 2523 CD GLU A 616 63.882 71.476 -1.692 1.00 62.54 C ATOM 2524 OE1 GLU A 616 64.100 72.347 -0.820 1.00 71.30 O ATOM 2525 OE2 GLU A 616 63.209 71.689 -2.716 1.00 75.86 O ATOM 0 H GLU A 616 65.167 68.707 2.029 1.00 33.08 H new ATOM 0 HA GLU A 616 64.311 67.656 -0.148 1.00 39.03 H new ATOM 0 HB2 GLU A 616 63.710 69.816 0.359 1.00 47.23 H new ATOM 0 HB3 GLU A 616 65.198 70.282 0.386 1.00 47.23 H new ATOM 0 HG2 GLU A 616 65.353 70.082 -1.926 1.00 54.92 H new ATOM 0 HG3 GLU A 616 63.925 69.460 -2.002 1.00 54.92 H new ATOM 2526 N HIS A 617 67.398 68.473 -0.316 1.00 42.99 N ATOM 2527 CA HIS A 617 68.649 68.196 -1.030 1.00 39.81 C ATOM 2528 C HIS A 617 68.980 66.722 -1.050 1.00 35.67 C ATOM 2529 O HIS A 617 69.365 66.186 -2.086 1.00 37.15 O ATOM 2530 CB HIS A 617 69.805 69.014 -0.427 1.00 43.61 C ATOM 2531 CG HIS A 617 71.081 68.912 -1.194 1.00 45.44 C ATOM 2532 ND1 HIS A 617 71.348 69.695 -2.296 1.00 49.22 N ATOM 2533 CD2 HIS A 617 72.165 68.121 -1.019 1.00 48.19 C ATOM 2534 CE1 HIS A 617 72.545 69.388 -2.769 1.00 50.21 C ATOM 2535 NE2 HIS A 617 73.061 68.434 -2.012 1.00 50.30 N ATOM 0 H HIS A 617 67.486 68.968 0.382 1.00 42.99 H new ATOM 0 HA HIS A 617 68.524 68.468 -1.953 1.00 39.81 H new ATOM 0 HB2 HIS A 617 69.540 69.946 -0.379 1.00 43.61 H new ATOM 0 HB3 HIS A 617 69.960 68.716 0.483 1.00 43.61 H new ATOM 0 HD2 HIS A 617 72.282 67.484 -0.351 1.00 48.19 H new ATOM 0 HE1 HIS A 617 72.954 69.777 -3.508 1.00 50.21 H new ATOM 0 HE2 HIS A 617 73.832 68.069 -2.123 1.00 50.30 H new ATOM 2536 N TYR A 618 68.795 66.021 0.063 1.00 35.38 N ATOM 2537 CA TYR A 618 68.966 64.567 0.041 1.00 34.83 C ATOM 2538 C TYR A 618 68.045 63.881 -0.983 1.00 37.82 C ATOM 2539 O TYR A 618 68.441 62.890 -1.614 1.00 35.23 O ATOM 2540 CB TYR A 618 68.715 63.927 1.413 1.00 37.63 C ATOM 2541 CG TYR A 618 69.750 64.163 2.518 1.00 39.41 C ATOM 2542 CD1 TYR A 618 70.997 64.793 2.280 1.00 40.38 C ATOM 2543 CD2 TYR A 618 69.487 63.717 3.806 1.00 40.59 C ATOM 2544 CE1 TYR A 618 71.925 64.968 3.308 1.00 38.13 C ATOM 2545 CE2 TYR A 618 70.405 63.881 4.829 1.00 42.14 C ATOM 2546 CZ TYR A 618 71.622 64.507 4.576 1.00 40.17 C ATOM 2547 OH TYR A 618 72.503 64.660 5.600 1.00 36.33 O ATOM 0 H TYR A 618 68.576 66.354 0.825 1.00 35.38 H new ATOM 0 HA TYR A 618 69.891 64.430 -0.215 1.00 34.83 H new ATOM 0 HB2 TYR A 618 67.857 64.245 1.737 1.00 37.63 H new ATOM 0 HB3 TYR A 618 68.632 62.969 1.283 1.00 37.63 H new ATOM 0 HD1 TYR A 618 71.201 65.095 1.424 1.00 40.38 H new ATOM 0 HD2 TYR A 618 68.676 63.299 3.986 1.00 40.59 H new ATOM 0 HE1 TYR A 618 72.737 65.390 3.142 1.00 38.13 H new ATOM 0 HE2 TYR A 618 70.209 63.573 5.684 1.00 42.14 H new ATOM 0 HH TYR A 618 73.172 65.092 5.332 1.00 36.33 H new ATOM 2548 N ARG A 619 66.818 64.387 -1.102 1.00 38.47 N ATOM 2549 C ARG A 619 66.366 63.880 -3.438 1.00 39.04 C ATOM 2550 O ARG A 619 66.427 62.885 -4.125 1.00 40.03 O ATOM 2551 CA AARG A 619 65.809 63.825 -2.005 0.41 40.76 C ATOM 2552 CB AARG A 619 64.484 64.616 -1.849 0.41 38.89 C ATOM 2553 CG AARG A 619 63.243 63.998 -2.468 0.41 40.25 C ATOM 2554 CD AARG A 619 61.963 64.395 -1.717 0.41 38.59 C ATOM 2555 NE AARG A 619 61.662 65.826 -1.803 0.41 38.11 N ATOM 2556 CZ AARG A 619 61.546 66.646 -0.758 0.41 38.05 C ATOM 2557 NH1AARG A 619 61.701 66.196 0.488 0.41 38.41 N ATOM 2558 NH2AARG A 619 61.280 67.929 -0.959 0.41 37.04 N ATOM 2559 CA BARG A 619 65.835 63.777 -2.008 0.59 40.26 C ATOM 2560 CB BARG A 619 64.421 64.391 -1.853 0.59 36.45 C ATOM 2561 CG BARG A 619 63.477 64.144 -3.038 0.59 36.70 C ATOM 2562 CD BARG A 619 62.013 64.338 -2.655 0.59 35.02 C ATOM 2563 NE BARG A 619 61.776 65.672 -2.118 0.59 34.35 N ATOM 2564 CZ BARG A 619 61.670 66.785 -2.841 0.59 33.87 C ATOM 2565 NH1BARG A 619 61.770 66.759 -4.165 0.59 32.68 N ATOM 2566 NH2BARG A 619 61.471 67.943 -2.221 0.59 33.54 N ATOM 0 H AARG A 619 66.544 65.071 -0.658 0.41 38.47 H new ATOM 0 H BARG A 619 66.534 65.076 -0.673 0.59 38.47 H new ATOM 0 HA AARG A 619 65.614 62.899 -1.791 0.41 40.26 H new ATOM 0 HA BARG A 619 65.725 62.842 -1.775 0.59 40.26 H new ATOM 0 HB2AARG A 619 64.318 64.744 -0.902 0.41 36.45 H new ATOM 0 HB2BARG A 619 64.012 64.031 -1.050 0.59 36.45 H new ATOM 0 HB3AARG A 619 64.609 65.496 -2.237 0.41 36.45 H new ATOM 0 HB3BARG A 619 64.511 65.348 -1.721 0.59 36.45 H new ATOM 0 HG2AARG A 619 63.172 64.276 -3.394 0.41 36.70 H new ATOM 0 HG2BARG A 619 63.704 64.748 -3.762 0.59 36.70 H new ATOM 0 HG3AARG A 619 63.330 63.032 -2.468 0.41 36.70 H new ATOM 0 HG3BARG A 619 63.606 63.242 -3.371 0.59 36.70 H new ATOM 0 HD2AARG A 619 61.216 63.891 -2.076 0.41 35.02 H new ATOM 0 HD2BARG A 619 61.452 64.196 -3.433 0.59 35.02 H new ATOM 0 HD3AARG A 619 62.052 64.145 -0.784 0.41 35.02 H new ATOM 0 HD3BARG A 619 61.758 63.673 -1.997 0.59 35.02 H new ATOM 0 HE AARG A 619 61.552 66.163 -2.587 0.41 34.35 H new ATOM 0 HE BARG A 619 61.698 65.746 -1.265 0.59 34.35 H new ATOM 0 HH11AARG A 619 61.878 65.366 0.626 0.41 32.68 H new ATOM 0 HH11BARG A 619 61.906 66.013 -4.571 0.59 32.68 H new ATOM 0 HH12AARG A 619 61.623 66.736 1.153 0.41 32.68 H new ATOM 0 HH12BARG A 619 61.699 67.488 -4.616 0.59 32.68 H new ATOM 0 HH21AARG A 619 61.183 68.228 -1.760 0.41 33.54 H new ATOM 0 HH21BARG A 619 61.412 67.967 -1.363 0.59 33.54 H new ATOM 0 HH22AARG A 619 61.204 68.463 -0.289 0.41 33.54 H new ATOM 0 HH22BARG A 619 61.401 68.669 -2.677 0.59 33.54 H new ATOM 2567 N LEU A 620 66.802 65.065 -3.838 1.00 43.49 N ATOM 2568 CA LEU A 620 67.430 65.300 -5.155 1.00 48.73 C ATOM 2569 C LEU A 620 68.618 64.388 -5.439 1.00 46.30 C ATOM 2570 O LEU A 620 68.763 63.891 -6.547 1.00 50.29 O ATOM 2571 CB LEU A 620 67.851 66.769 -5.285 1.00 53.40 C ATOM 2572 CG LEU A 620 66.764 67.796 -5.668 1.00 61.02 C ATOM 2573 CD1 LEU A 620 65.331 67.441 -5.250 1.00 65.36 C ATOM 2574 CD2 LEU A 620 67.123 69.182 -5.141 1.00 63.48 C ATOM 0 H LEU A 620 66.746 65.773 -3.353 1.00 43.49 H new ATOM 0 HA LEU A 620 66.756 65.085 -5.819 1.00 48.73 H new ATOM 0 HB2 LEU A 620 68.237 67.045 -4.439 1.00 53.40 H new ATOM 0 HB3 LEU A 620 68.557 66.820 -5.949 1.00 53.40 H new ATOM 0 HG LEU A 620 66.758 67.783 -6.638 1.00 61.02 H new ATOM 0 HD11 LEU A 620 64.727 68.145 -5.535 1.00 65.36 H new ATOM 0 HD12 LEU A 620 65.070 66.604 -5.665 1.00 65.36 H new ATOM 0 HD13 LEU A 620 65.288 67.350 -4.285 1.00 65.36 H new ATOM 0 HD21 LEU A 620 66.430 69.813 -5.391 1.00 63.48 H new ATOM 0 HD22 LEU A 620 67.199 69.151 -4.174 1.00 63.48 H new ATOM 0 HD23 LEU A 620 67.969 69.464 -5.522 1.00 63.48 H new ATOM 2575 N LEU A 621 69.426 64.113 -4.428 1.00 45.61 N ATOM 2576 CA LEU A 621 70.582 63.229 -4.571 1.00 44.95 C ATOM 2577 C LEU A 621 70.303 61.759 -4.347 1.00 45.56 C ATOM 2578 O LEU A 621 71.218 60.946 -4.483 1.00 43.51 O ATOM 2579 CB LEU A 621 71.680 63.642 -3.582 1.00 52.05 C ATOM 2580 CG LEU A 621 72.627 64.774 -3.985 1.00 58.28 C ATOM 2581 CD1 LEU A 621 71.922 65.991 -4.562 1.00 61.06 C ATOM 2582 CD2 LEU A 621 73.455 65.149 -2.762 1.00 59.15 C ATOM 0 H LEU A 621 69.323 64.432 -3.636 1.00 45.61 H new ATOM 0 HA LEU A 621 70.852 63.331 -5.497 1.00 44.95 H new ATOM 0 HB2 LEU A 621 71.250 63.897 -2.751 1.00 52.05 H new ATOM 0 HB3 LEU A 621 72.219 62.858 -3.393 1.00 52.05 H new ATOM 0 HG LEU A 621 73.192 64.452 -4.705 1.00 58.28 H new ATOM 0 HD11 LEU A 621 72.579 66.666 -4.794 1.00 61.06 H new ATOM 0 HD12 LEU A 621 71.429 65.733 -5.356 1.00 61.06 H new ATOM 0 HD13 LEU A 621 71.308 66.352 -3.904 1.00 61.06 H new ATOM 0 HD21 LEU A 621 74.065 65.867 -2.992 1.00 59.15 H new ATOM 0 HD22 LEU A 621 72.866 65.442 -2.049 1.00 59.15 H new ATOM 0 HD23 LEU A 621 73.962 64.377 -2.465 1.00 59.15 H new ATOM 2583 N HIS A 622 69.081 61.402 -3.947 1.00 43.68 N ATOM 2584 CA HIS A 622 68.744 60.030 -3.550 1.00 41.21 C ATOM 2585 C HIS A 622 69.564 59.527 -2.364 1.00 42.93 C ATOM 2586 O HIS A 622 69.902 58.351 -2.290 1.00 47.36 O ATOM 2587 CB HIS A 622 68.847 59.034 -4.720 1.00 43.66 C ATOM 2588 CG HIS A 622 68.013 59.396 -5.910 1.00 42.49 C ATOM 2589 ND1 HIS A 622 67.889 58.561 -6.998 1.00 46.32 N ATOM 2590 CD2 HIS A 622 67.251 60.484 -6.182 1.00 44.89 C ATOM 2591 CE1 HIS A 622 67.109 59.132 -7.901 1.00 47.48 C ATOM 2592 NE2 HIS A 622 66.703 60.297 -7.427 1.00 46.15 N ATOM 0 H HIS A 622 68.421 61.951 -3.898 1.00 43.68 H new ATOM 0 HA HIS A 622 67.817 60.076 -3.268 1.00 41.21 H new ATOM 0 HB2 HIS A 622 69.775 58.969 -4.996 1.00 43.66 H new ATOM 0 HB3 HIS A 622 68.582 58.155 -4.407 1.00 43.66 H new ATOM 0 HD2 HIS A 622 67.123 61.220 -5.628 1.00 44.89 H new ATOM 0 HE1 HIS A 622 66.884 58.774 -8.729 1.00 47.48 H new ATOM 0 HE2 HIS A 622 66.181 60.848 -7.832 1.00 46.15 H new ATOM 2593 N ARG A 623 69.838 60.413 -1.412 1.00 44.90 N ATOM 2594 CA ARG A 623 70.627 60.067 -0.216 1.00 47.46 C ATOM 2595 C ARG A 623 69.714 59.662 0.961 1.00 44.84 C ATOM 2596 O ARG A 623 68.673 60.294 1.178 1.00 39.26 O ATOM 2597 CB ARG A 623 71.483 61.276 0.208 1.00 53.58 C ATOM 2598 CG ARG A 623 72.549 61.693 -0.810 1.00 62.49 C ATOM 2599 CD ARG A 623 73.979 61.409 -0.339 1.00 67.38 C ATOM 2600 NE ARG A 623 74.324 62.225 0.840 1.00 76.61 N ATOM 2601 CZ ARG A 623 74.563 61.782 2.084 1.00 79.13 C ATOM 2602 NH1 ARG A 623 74.508 60.490 2.410 1.00 84.76 N ATOM 2603 NH2 ARG A 623 74.858 62.660 3.037 1.00 78.89 N ATOM 0 H ARG A 623 69.576 61.232 -1.434 1.00 44.90 H new ATOM 0 HA ARG A 623 71.195 59.314 -0.441 1.00 47.46 H new ATOM 0 HB2 ARG A 623 70.896 62.031 0.371 1.00 53.58 H new ATOM 0 HB3 ARG A 623 71.920 61.069 1.049 1.00 53.58 H new ATOM 0 HG2 ARG A 623 72.391 61.225 -1.645 1.00 62.49 H new ATOM 0 HG3 ARG A 623 72.458 62.641 -0.995 1.00 62.49 H new ATOM 0 HD2 ARG A 623 74.070 60.468 -0.122 1.00 67.38 H new ATOM 0 HD3 ARG A 623 74.602 61.596 -1.058 1.00 67.38 H new ATOM 0 HE ARG A 623 74.378 63.075 0.717 1.00 76.61 H new ATOM 0 HH11 ARG A 623 74.313 59.904 1.812 1.00 84.76 H new ATOM 0 HH12 ARG A 623 74.667 60.243 3.218 1.00 84.76 H new ATOM 0 HH21 ARG A 623 74.894 63.499 2.852 1.00 78.89 H new ATOM 0 HH22 ARG A 623 75.013 62.389 3.838 1.00 78.89 H new ATOM 2604 N TYR A 624 70.130 58.658 1.734 1.00 39.65 N ATOM 2605 CA TYR A 624 69.373 58.198 2.884 1.00 44.69 C ATOM 2606 C TYR A 624 69.375 59.252 3.998 1.00 43.34 C ATOM 2607 O TYR A 624 70.353 59.976 4.154 1.00 44.69 O ATOM 2608 CB TYR A 624 69.919 56.868 3.395 1.00 46.63 C ATOM 2609 CG TYR A 624 69.655 55.709 2.469 1.00 50.28 C ATOM 2610 CD1 TYR A 624 70.494 55.446 1.370 1.00 56.37 C ATOM 2611 CD2 TYR A 624 68.557 54.872 2.666 1.00 56.17 C ATOM 2612 CE1 TYR A 624 70.245 54.375 0.505 1.00 56.44 C ATOM 2613 CE2 TYR A 624 68.308 53.790 1.815 1.00 59.14 C ATOM 2614 CZ TYR A 624 69.158 53.544 0.739 1.00 58.11 C ATOM 2615 OH TYR A 624 68.904 52.487 -0.101 1.00 62.25 O ATOM 0 H TYR A 624 70.862 58.227 1.601 1.00 39.65 H new ATOM 0 HA TYR A 624 68.455 58.060 2.603 1.00 44.69 H new ATOM 0 HB2 TYR A 624 70.876 56.951 3.531 1.00 46.63 H new ATOM 0 HB3 TYR A 624 69.525 56.677 4.260 1.00 46.63 H new ATOM 0 HD1 TYR A 624 71.229 55.995 1.216 1.00 56.37 H new ATOM 0 HD2 TYR A 624 67.980 55.036 3.376 1.00 56.17 H new ATOM 0 HE1 TYR A 624 70.804 54.221 -0.222 1.00 56.44 H new ATOM 0 HE2 TYR A 624 67.577 53.236 1.967 1.00 59.14 H new ATOM 0 HH TYR A 624 69.625 52.102 -0.293 1.00 62.25 H new ATOM 2616 N CYS A 625 68.249 59.360 4.713 1.00 40.80 N ATOM 2617 CA CYS A 625 68.086 60.255 5.879 1.00 36.55 C ATOM 2618 C CYS A 625 68.428 59.469 7.126 1.00 35.22 C ATOM 2619 O CYS A 625 68.177 58.268 7.187 1.00 36.09 O ATOM 2620 CB CYS A 625 66.612 60.713 6.019 1.00 36.87 C ATOM 2621 SG CYS A 625 65.968 61.748 4.689 1.00 39.25 S ATOM 0 H CYS A 625 67.541 58.907 4.533 1.00 40.80 H new ATOM 0 HA CYS A 625 68.660 61.028 5.761 1.00 36.55 H new ATOM 0 HB2 CYS A 625 66.053 59.923 6.088 1.00 36.87 H new ATOM 0 HB3 CYS A 625 66.522 61.199 6.854 1.00 36.87 H new ATOM 0 HG CYS A 625 66.297 61.290 3.630 1.00 39.25 H new ATOM 2622 N VAL A 626 68.964 60.151 8.133 1.00 33.32 N ATOM 2623 CA VAL A 626 69.101 59.586 9.476 1.00 35.77 C ATOM 2624 C VAL A 626 67.751 59.530 10.232 1.00 33.70 C ATOM 2625 O VAL A 626 67.484 58.569 10.941 1.00 30.56 O ATOM 2626 CB VAL A 626 70.175 60.348 10.292 1.00 35.21 C ATOM 2627 CG1 VAL A 626 70.293 59.793 11.708 1.00 35.47 C ATOM 2628 CG2 VAL A 626 71.526 60.256 9.579 1.00 35.42 C ATOM 0 H VAL A 626 69.259 60.955 8.059 1.00 33.32 H new ATOM 0 HA VAL A 626 69.398 58.669 9.370 1.00 35.77 H new ATOM 0 HB VAL A 626 69.904 61.277 10.357 1.00 35.21 H new ATOM 0 HG11 VAL A 626 70.971 60.288 12.194 1.00 35.47 H new ATOM 0 HG12 VAL A 626 69.441 59.881 12.162 1.00 35.47 H new ATOM 0 HG13 VAL A 626 70.543 58.856 11.669 1.00 35.47 H new ATOM 0 HG21 VAL A 626 72.196 60.734 10.092 1.00 35.42 H new ATOM 0 HG22 VAL A 626 71.786 59.325 9.496 1.00 35.42 H new ATOM 0 HG23 VAL A 626 71.454 60.651 8.696 1.00 35.42 H new ATOM 2629 N PHE A 627 66.920 60.555 10.075 1.00 34.61 N ATOM 2630 CA PHE A 627 65.593 60.585 10.691 1.00 33.62 C ATOM 2631 C PHE A 627 64.671 61.397 9.794 1.00 33.82 C ATOM 2632 O PHE A 627 65.137 62.104 8.904 1.00 31.36 O ATOM 2633 CB PHE A 627 65.734 61.199 12.096 1.00 36.04 C ATOM 2634 CG PHE A 627 66.186 62.634 12.091 1.00 34.94 C ATOM 2635 CD1 PHE A 627 65.271 63.659 11.992 1.00 34.33 C ATOM 2636 CD2 PHE A 627 67.546 62.954 12.185 1.00 36.53 C ATOM 2637 CE1 PHE A 627 65.672 64.987 11.987 1.00 35.25 C ATOM 2638 CE2 PHE A 627 67.963 64.269 12.165 1.00 35.02 C ATOM 2639 CZ PHE A 627 67.027 65.292 12.062 1.00 38.50 C ATOM 0 H PHE A 627 67.107 61.253 9.609 1.00 34.61 H new ATOM 0 HA PHE A 627 65.212 59.698 10.786 1.00 33.62 H new ATOM 0 HB2 PHE A 627 64.880 61.140 12.553 1.00 36.04 H new ATOM 0 HB3 PHE A 627 66.367 60.671 12.608 1.00 36.04 H new ATOM 0 HD1 PHE A 627 64.366 63.456 11.927 1.00 34.33 H new ATOM 0 HD2 PHE A 627 68.175 62.273 12.262 1.00 36.53 H new ATOM 0 HE1 PHE A 627 65.040 65.667 11.934 1.00 35.25 H new ATOM 0 HE2 PHE A 627 68.869 64.471 12.220 1.00 35.02 H new ATOM 0 HZ PHE A 627 67.306 66.179 12.043 1.00 38.50 H new ATOM 2640 N SER A 628 63.360 61.266 9.992 1.00 31.71 N ATOM 2641 CA SER A 628 62.392 62.168 9.379 1.00 31.45 C ATOM 2642 C SER A 628 62.296 63.505 10.079 1.00 29.31 C ATOM 2643 O SER A 628 61.898 63.589 11.233 1.00 33.92 O ATOM 2644 CB SER A 628 60.993 61.504 9.328 1.00 33.37 C ATOM 2645 OG SER A 628 60.003 62.452 8.978 1.00 32.07 O ATOM 0 H SER A 628 63.010 60.654 10.484 1.00 31.71 H new ATOM 0 HA SER A 628 62.712 62.340 8.480 1.00 31.45 H new ATOM 0 HB2 SER A 628 60.997 60.780 8.683 1.00 33.37 H new ATOM 0 HB3 SER A 628 60.783 61.114 10.191 1.00 33.37 H new ATOM 0 HG SER A 628 59.981 62.539 8.143 1.00 32.07 H new ATOM 2646 N HIS A 629 62.592 64.560 9.347 1.00 28.97 N ATOM 2647 CA HIS A 629 62.416 65.928 9.804 1.00 30.00 C ATOM 2648 C HIS A 629 60.940 66.267 10.122 1.00 30.98 C ATOM 2649 O HIS A 629 60.633 66.837 11.171 1.00 31.40 O ATOM 2650 CB HIS A 629 62.945 66.860 8.731 1.00 28.21 C ATOM 2651 CG HIS A 629 62.932 68.303 9.096 1.00 31.32 C ATOM 2652 ND1 HIS A 629 64.042 68.954 9.594 1.00 32.94 N ATOM 2653 CD2 HIS A 629 61.962 69.244 8.982 1.00 35.58 C ATOM 2654 CE1 HIS A 629 63.755 70.231 9.779 1.00 34.27 C ATOM 2655 NE2 HIS A 629 62.492 70.429 9.436 1.00 37.45 N ATOM 0 H HIS A 629 62.909 64.503 8.550 1.00 28.97 H new ATOM 0 HA HIS A 629 62.907 66.038 10.633 1.00 30.00 H new ATOM 0 HB2 HIS A 629 63.855 66.602 8.516 1.00 28.21 H new ATOM 0 HB3 HIS A 629 62.418 66.738 7.926 1.00 28.21 H new ATOM 0 HD2 HIS A 629 61.100 69.113 8.658 1.00 35.58 H new ATOM 0 HE1 HIS A 629 64.341 70.880 10.096 1.00 34.27 H new ATOM 0 HE2 HIS A 629 62.071 71.177 9.489 1.00 37.45 H new ATOM 2656 N ASP A 630 60.032 65.903 9.230 1.00 32.27 N ATOM 2657 CA ASP A 630 58.587 66.148 9.485 1.00 30.34 C ATOM 2658 C ASP A 630 58.097 65.446 10.743 1.00 28.78 C ATOM 2659 O ASP A 630 57.323 66.014 11.502 1.00 29.61 O ATOM 2660 CB ASP A 630 57.753 65.753 8.290 1.00 29.46 C ATOM 2661 CG ASP A 630 57.982 66.640 7.095 1.00 31.59 C ATOM 2662 OD1 ASP A 630 58.433 67.805 7.285 1.00 31.54 O ATOM 2663 OD2 ASP A 630 57.661 66.174 5.964 1.00 35.71 O ATOM 0 H ASP A 630 60.209 65.520 8.481 1.00 32.27 H new ATOM 0 HA ASP A 630 58.483 67.101 9.631 1.00 30.34 H new ATOM 0 HB2 ASP A 630 57.956 64.835 8.049 1.00 29.46 H new ATOM 0 HB3 ASP A 630 56.814 65.782 8.533 1.00 29.46 H new ATOM 2664 N GLU A 631 58.586 64.237 10.984 1.00 27.57 N ATOM 2665 CA GLU A 631 58.247 63.503 12.186 1.00 29.64 C ATOM 2666 C GLU A 631 58.751 64.217 13.428 1.00 33.28 C ATOM 2667 O GLU A 631 58.054 64.260 14.460 1.00 31.76 O ATOM 2668 CB GLU A 631 58.798 62.095 12.133 1.00 31.10 C ATOM 2669 CG GLU A 631 58.564 61.263 13.371 1.00 30.35 C ATOM 2670 CD GLU A 631 59.122 59.864 13.260 1.00 35.48 C ATOM 2671 OE1 GLU A 631 59.616 59.449 12.174 1.00 33.53 O ATOM 2672 OE2 GLU A 631 59.076 59.168 14.281 1.00 36.81 O ATOM 0 H GLU A 631 59.122 63.822 10.455 1.00 27.57 H new ATOM 0 HA GLU A 631 57.279 63.455 12.235 1.00 29.64 H new ATOM 0 HB2 GLU A 631 58.403 61.637 11.374 1.00 31.10 H new ATOM 0 HB3 GLU A 631 59.753 62.143 11.969 1.00 31.10 H new ATOM 0 HG2 GLU A 631 58.968 61.707 14.133 1.00 30.35 H new ATOM 0 HG3 GLU A 631 57.611 61.212 13.544 1.00 30.35 H new ATOM 2673 N MET A 632 59.947 64.782 13.343 1.00 32.22 N ATOM 2674 CA MET A 632 60.470 65.565 14.457 1.00 32.54 C ATOM 2675 C MET A 632 59.573 66.778 14.724 1.00 29.43 C ATOM 2676 O MET A 632 59.275 67.066 15.857 1.00 29.71 O ATOM 2677 CB MET A 632 61.913 66.006 14.173 1.00 36.23 C ATOM 2678 CG MET A 632 62.488 67.051 15.128 1.00 39.85 C ATOM 2679 SD MET A 632 63.981 67.743 14.378 1.00 49.50 S ATOM 2680 CE MET A 632 63.230 69.001 13.350 1.00 47.52 C ATOM 0 H MET A 632 60.467 64.727 12.660 1.00 32.22 H new ATOM 0 HA MET A 632 60.474 65.009 15.252 1.00 32.54 H new ATOM 0 HB2 MET A 632 62.484 65.222 14.197 1.00 36.23 H new ATOM 0 HB3 MET A 632 61.954 66.360 13.271 1.00 36.23 H new ATOM 0 HG2 MET A 632 61.838 67.751 15.294 1.00 39.85 H new ATOM 0 HG3 MET A 632 62.696 66.648 15.985 1.00 39.85 H new ATOM 0 HE1 MET A 632 63.923 69.560 12.964 1.00 47.52 H new ATOM 0 HE2 MET A 632 62.723 68.578 12.640 1.00 47.52 H new ATOM 0 HE3 MET A 632 62.637 69.548 13.889 1.00 47.52 H new ATOM 2681 N ILE A 633 59.187 67.492 13.679 1.00 28.68 N ATOM 2682 CA ILE A 633 58.374 68.699 13.812 1.00 33.36 C ATOM 2683 C ILE A 633 57.015 68.350 14.457 1.00 33.98 C ATOM 2684 O ILE A 633 56.583 69.026 15.396 1.00 31.55 O ATOM 2685 CB ILE A 633 58.148 69.393 12.455 1.00 35.98 C ATOM 2686 CG1 ILE A 633 59.466 69.922 11.891 1.00 39.21 C ATOM 2687 CG2 ILE A 633 57.130 70.533 12.546 1.00 36.17 C ATOM 2688 CD1 ILE A 633 60.057 71.105 12.628 1.00 41.69 C ATOM 0 H ILE A 633 59.388 67.293 12.867 1.00 28.68 H new ATOM 0 HA ILE A 633 58.858 69.317 14.382 1.00 33.36 H new ATOM 0 HB ILE A 633 57.787 68.721 11.856 1.00 35.98 H new ATOM 0 HG12 ILE A 633 60.115 69.201 11.894 1.00 39.21 H new ATOM 0 HG13 ILE A 633 59.326 70.174 10.965 1.00 39.21 H new ATOM 0 HG21 ILE A 633 57.020 70.939 11.672 1.00 36.17 H new ATOM 0 HG22 ILE A 633 56.278 70.183 12.849 1.00 36.17 H new ATOM 0 HG23 ILE A 633 57.447 71.200 13.175 1.00 36.17 H new ATOM 0 HD11 ILE A 633 60.887 71.370 12.202 1.00 41.69 H new ATOM 0 HD12 ILE A 633 59.431 71.846 12.606 1.00 41.69 H new ATOM 0 HD13 ILE A 633 60.232 70.858 13.550 1.00 41.69 H new ATOM 2689 N CYS A 634 56.391 67.274 13.997 1.00 30.30 N ATOM 2690 CA CYS A 634 55.078 66.882 14.545 1.00 33.84 C ATOM 2691 C CYS A 634 55.191 66.397 15.967 1.00 34.91 C ATOM 2692 O CYS A 634 54.260 66.601 16.757 1.00 32.29 O ATOM 2693 CB CYS A 634 54.384 65.833 13.675 1.00 31.17 C ATOM 2694 SG CYS A 634 53.959 66.482 12.059 1.00 32.24 S ATOM 0 H CYS A 634 56.696 66.759 13.379 1.00 30.30 H new ATOM 0 HA CYS A 634 54.528 67.681 14.541 1.00 33.84 H new ATOM 0 HB2 CYS A 634 54.965 65.063 13.572 1.00 31.17 H new ATOM 0 HB3 CYS A 634 53.580 65.524 14.121 1.00 31.17 H new ATOM 0 HG CYS A 634 54.944 66.529 11.375 1.00 32.24 H new ATOM 2695 N LYS A 635 56.317 65.763 16.303 1.00 33.14 N ATOM 2696 CA LYS A 635 56.535 65.306 17.676 1.00 35.79 C ATOM 2697 C LYS A 635 56.595 66.517 18.598 1.00 34.29 C ATOM 2698 O LYS A 635 55.986 66.521 19.674 1.00 36.64 O ATOM 2699 CB LYS A 635 57.812 64.465 17.795 1.00 37.93 C ATOM 2700 CG LYS A 635 58.259 64.103 19.207 1.00 42.43 C ATOM 2701 CD LYS A 635 57.254 63.268 20.001 1.00 48.70 C ATOM 2702 CE LYS A 635 57.143 61.853 19.450 1.00 52.01 C ATOM 2703 NZ LYS A 635 56.228 60.997 20.268 1.00 55.78 N ATOM 0 H LYS A 635 56.959 65.590 15.758 1.00 33.14 H new ATOM 0 HA LYS A 635 55.796 64.735 17.937 1.00 35.79 H new ATOM 0 HB2 LYS A 635 57.681 63.643 17.298 1.00 37.93 H new ATOM 0 HB3 LYS A 635 58.534 64.947 17.362 1.00 37.93 H new ATOM 0 HG2 LYS A 635 59.096 63.615 19.153 1.00 42.43 H new ATOM 0 HG3 LYS A 635 58.439 64.921 19.696 1.00 42.43 H new ATOM 0 HD2 LYS A 635 57.525 63.233 20.932 1.00 48.70 H new ATOM 0 HD3 LYS A 635 56.384 63.696 19.974 1.00 48.70 H new ATOM 0 HE2 LYS A 635 56.819 61.888 18.536 1.00 52.01 H new ATOM 0 HE3 LYS A 635 58.024 61.448 19.423 1.00 52.01 H new ATOM 0 HZ1 LYS A 635 56.190 60.181 19.915 1.00 55.78 H new ATOM 0 HZ2 LYS A 635 56.536 60.945 21.101 1.00 55.78 H new ATOM 0 HZ3 LYS A 635 55.413 61.355 20.275 1.00 55.78 H new ATOM 2704 N MET A 636 57.317 67.540 18.177 1.00 34.49 N ATOM 2705 CA MET A 636 57.396 68.772 18.963 1.00 37.33 C ATOM 2706 C MET A 636 56.025 69.474 19.032 1.00 37.47 C ATOM 2707 O MET A 636 55.609 69.886 20.109 1.00 37.95 O ATOM 2708 CB MET A 636 58.453 69.702 18.401 1.00 36.89 C ATOM 2709 CG MET A 636 59.865 69.117 18.487 1.00 44.18 C ATOM 2710 SD MET A 636 61.061 70.236 17.736 1.00 50.17 S ATOM 2711 CE MET A 636 61.343 71.153 19.225 1.00 46.06 C ATOM 0 H MET A 636 57.768 67.548 17.445 1.00 34.49 H new ATOM 0 HA MET A 636 57.654 68.534 19.867 1.00 37.33 H new ATOM 0 HB2 MET A 636 58.245 69.899 17.474 1.00 36.89 H new ATOM 0 HB3 MET A 636 58.426 70.544 18.883 1.00 36.89 H new ATOM 0 HG2 MET A 636 60.100 68.960 19.415 1.00 44.18 H new ATOM 0 HG3 MET A 636 59.892 68.257 18.038 1.00 44.18 H new ATOM 0 HE1 MET A 636 62.209 71.588 19.179 1.00 46.06 H new ATOM 0 HE2 MET A 636 60.650 71.824 19.328 1.00 46.06 H new ATOM 0 HE3 MET A 636 61.325 70.550 19.985 1.00 46.06 H new ATOM 2712 N ALA A 637 55.308 69.561 17.914 1.00 36.38 N ATOM 2713 CA ALA A 637 53.915 70.072 17.934 1.00 38.78 C ATOM 2714 C ALA A 637 53.037 69.351 18.961 1.00 38.63 C ATOM 2715 O ALA A 637 52.316 69.981 19.724 1.00 38.65 O ATOM 2716 CB ALA A 637 53.288 69.979 16.556 1.00 37.01 C ATOM 0 H ALA A 637 55.596 69.335 17.136 1.00 36.38 H new ATOM 0 HA ALA A 637 53.966 71.003 18.201 1.00 38.78 H new ATOM 0 HB1 ALA A 637 52.379 70.317 16.590 1.00 37.01 H new ATOM 0 HB2 ALA A 637 53.806 70.507 15.928 1.00 37.01 H new ATOM 0 HB3 ALA A 637 53.277 69.053 16.267 1.00 37.01 H new ATOM 2717 N SER A 638 53.151 68.031 19.026 1.00 40.66 N ATOM 2718 CA SER A 638 52.385 67.257 19.989 1.00 41.21 C ATOM 2719 C SER A 638 52.829 67.516 21.437 1.00 43.55 C ATOM 2720 O SER A 638 52.155 67.083 22.352 1.00 44.39 O ATOM 2721 CB SER A 638 52.476 65.760 19.691 1.00 42.18 C ATOM 2722 OG SER A 638 53.707 65.232 20.180 1.00 46.32 O ATOM 0 H SER A 638 53.667 67.565 18.520 1.00 40.66 H new ATOM 0 HA SER A 638 51.464 67.549 19.900 1.00 41.21 H new ATOM 0 HB2 SER A 638 51.731 65.296 20.104 1.00 42.18 H new ATOM 0 HB3 SER A 638 52.409 65.610 18.735 1.00 42.18 H new ATOM 0 HG SER A 638 54.339 65.734 19.948 1.00 46.32 H new ATOM 2723 N LYS A 639 53.961 68.184 21.654 1.00 43.99 N ATOM 2724 CA LYS A 639 54.417 68.530 23.006 1.00 46.30 C ATOM 2725 C LYS A 639 54.458 70.050 23.197 1.00 46.04 C ATOM 2726 O LYS A 639 55.294 70.563 23.954 1.00 41.75 O ATOM 2727 CB LYS A 639 55.848 67.980 23.233 1.00 51.99 C ATOM 2728 CG LYS A 639 56.077 66.507 22.951 1.00 57.13 C ATOM 2729 CD LYS A 639 55.402 65.580 23.947 1.00 65.81 C ATOM 2730 CE LYS A 639 56.032 64.186 23.888 1.00 70.99 C ATOM 2731 NZ LYS A 639 55.119 63.100 24.349 1.00 80.09 N ATOM 0 H LYS A 639 54.486 68.449 21.027 1.00 43.99 H new ATOM 0 HA LYS A 639 53.794 68.139 23.639 1.00 46.30 H new ATOM 0 HB2 LYS A 639 56.458 68.491 22.678 1.00 51.99 H new ATOM 0 HB3 LYS A 639 56.093 68.151 24.156 1.00 51.99 H new ATOM 0 HG2 LYS A 639 55.752 66.303 22.060 1.00 57.13 H new ATOM 0 HG3 LYS A 639 57.031 66.330 22.953 1.00 57.13 H new ATOM 0 HD2 LYS A 639 55.486 65.942 24.843 1.00 65.81 H new ATOM 0 HD3 LYS A 639 54.454 65.521 23.752 1.00 65.81 H new ATOM 0 HE2 LYS A 639 56.307 64.002 22.976 1.00 70.99 H new ATOM 0 HE3 LYS A 639 56.834 64.178 24.434 1.00 70.99 H new ATOM 0 HZ1 LYS A 639 55.537 62.316 24.293 1.00 80.09 H new ATOM 0 HZ2 LYS A 639 54.882 63.250 25.194 1.00 80.09 H new ATOM 0 HZ3 LYS A 639 54.392 63.085 23.836 1.00 80.09 H new ATOM 2732 N ALA A 640 53.599 70.781 22.491 1.00 42.64 N ATOM 2733 CA ALA A 640 53.690 72.242 22.465 1.00 43.89 C ATOM 2734 C ALA A 640 53.639 72.888 23.854 1.00 42.99 C ATOM 2735 O ALA A 640 54.342 73.849 24.092 1.00 43.93 O ATOM 2736 CB ALA A 640 52.599 72.827 21.578 1.00 44.72 C ATOM 0 H ALA A 640 52.958 70.453 22.021 1.00 42.64 H new ATOM 0 HA ALA A 640 54.564 72.449 22.097 1.00 43.89 H new ATOM 0 HB1 ALA A 640 52.672 73.794 21.571 1.00 44.72 H new ATOM 0 HB2 ALA A 640 52.700 72.489 20.675 1.00 44.72 H new ATOM 0 HB3 ALA A 640 51.729 72.571 21.923 1.00 44.72 H new ATOM 2737 N ASP A 641 52.828 72.348 24.758 1.00 47.68 N ATOM 2738 CA ASP A 641 52.711 72.892 26.141 1.00 54.26 C ATOM 2739 C ASP A 641 54.035 72.995 26.911 1.00 57.71 C ATOM 2740 O ASP A 641 54.253 73.971 27.631 1.00 62.56 O ATOM 2741 CB ASP A 641 51.672 72.135 26.986 1.00 53.77 C ATOM 2742 CG ASP A 641 51.803 70.609 26.908 1.00 60.55 C ATOM 2743 OD1 ASP A 641 52.645 70.088 26.140 1.00 64.00 O ATOM 2744 OD2 ASP A 641 51.023 69.924 27.610 1.00 60.93 O ATOM 0 H ASP A 641 52.330 71.664 24.605 1.00 47.68 H new ATOM 0 HA ASP A 641 52.405 73.802 25.999 1.00 54.26 H new ATOM 0 HB2 ASP A 641 51.757 72.411 27.912 1.00 53.77 H new ATOM 0 HB3 ASP A 641 50.783 72.390 26.694 1.00 53.77 H new ATOM 2745 N VAL A 642 54.927 72.025 26.716 1.00 57.79 N ATOM 2746 CA VAL A 642 56.202 71.964 27.457 1.00 55.28 C ATOM 2747 C VAL A 642 57.408 72.501 26.693 1.00 55.95 C ATOM 2748 O VAL A 642 58.509 72.526 27.239 1.00 59.78 O ATOM 2749 CB VAL A 642 56.500 70.526 27.962 1.00 59.14 C ATOM 2750 CG1 VAL A 642 55.333 70.003 28.794 1.00 59.06 C ATOM 2751 CG2 VAL A 642 56.798 69.549 26.824 1.00 58.96 C ATOM 0 H VAL A 642 54.817 71.383 26.154 1.00 57.79 H new ATOM 0 HA VAL A 642 56.070 72.558 28.213 1.00 55.28 H new ATOM 0 HB VAL A 642 57.298 70.584 28.511 1.00 59.14 H new ATOM 0 HG11 VAL A 642 55.532 69.105 29.103 1.00 59.06 H new ATOM 0 HG12 VAL A 642 55.194 70.584 29.558 1.00 59.06 H new ATOM 0 HG13 VAL A 642 54.530 69.987 28.251 1.00 59.06 H new ATOM 0 HG21 VAL A 642 56.977 68.669 27.191 1.00 58.96 H new ATOM 0 HG22 VAL A 642 56.033 69.502 26.229 1.00 58.96 H new ATOM 0 HG23 VAL A 642 57.574 69.856 26.329 1.00 58.96 H new ATOM 2752 N LEU A 643 57.226 72.930 25.445 1.00 52.31 N ATOM 2753 CA LEU A 643 58.320 73.537 24.702 1.00 51.44 C ATOM 2754 C LEU A 643 58.659 74.915 25.223 1.00 57.52 C ATOM 2755 O LEU A 643 57.787 75.667 25.665 1.00 57.01 O ATOM 2756 CB LEU A 643 57.983 73.706 23.213 1.00 48.04 C ATOM 2757 CG LEU A 643 57.839 72.486 22.326 1.00 46.10 C ATOM 2758 CD1 LEU A 643 57.606 72.928 20.894 1.00 43.46 C ATOM 2759 CD2 LEU A 643 59.082 71.620 22.425 1.00 49.70 C ATOM 0 H LEU A 643 56.482 72.878 25.016 1.00 52.31 H new ATOM 0 HA LEU A 643 59.069 72.931 24.816 1.00 51.44 H new ATOM 0 HB2 LEU A 643 57.151 74.201 23.160 1.00 48.04 H new ATOM 0 HB3 LEU A 643 58.672 74.267 22.823 1.00 48.04 H new ATOM 0 HG LEU A 643 57.079 71.960 22.620 1.00 46.10 H new ATOM 0 HD11 LEU A 643 57.514 72.148 20.325 1.00 43.46 H new ATOM 0 HD12 LEU A 643 56.796 73.460 20.847 1.00 43.46 H new ATOM 0 HD13 LEU A 643 58.359 73.460 20.593 1.00 43.46 H new ATOM 0 HD21 LEU A 643 58.981 70.842 21.854 1.00 49.70 H new ATOM 0 HD22 LEU A 643 59.856 72.131 22.140 1.00 49.70 H new ATOM 0 HD23 LEU A 643 59.204 71.333 23.343 1.00 49.70 H new ATOM 2760 N ASP A 644 59.932 75.259 25.104 1.00 54.83 N ATOM 2761 CA ASP A 644 60.366 76.629 25.205 1.00 57.54 C ATOM 2762 C ASP A 644 59.578 77.436 24.193 1.00 58.42 C ATOM 2763 O ASP A 644 59.228 76.928 23.127 1.00 58.23 O ATOM 2764 CB ASP A 644 61.864 76.711 24.896 1.00 61.74 C ATOM 2765 CG ASP A 644 62.382 78.124 24.876 1.00 64.84 C ATOM 2766 OD1 ASP A 644 62.604 78.672 25.972 1.00 76.90 O ATOM 2767 OD2 ASP A 644 62.572 78.682 23.773 1.00 70.48 O ATOM 0 H ASP A 644 60.567 74.697 24.962 1.00 54.83 H new ATOM 0 HA ASP A 644 60.217 76.976 26.098 1.00 57.54 H new ATOM 0 HB2 ASP A 644 62.355 76.201 25.559 1.00 61.74 H new ATOM 0 HB3 ASP A 644 62.035 76.297 24.036 1.00 61.74 H new ATOM 2768 N VAL A 645 59.313 78.694 24.516 1.00 55.42 N ATOM 2769 CA VAL A 645 58.415 79.516 23.699 1.00 57.25 C ATOM 2770 C VAL A 645 59.059 80.015 22.416 1.00 56.16 C ATOM 2771 O VAL A 645 58.364 80.245 21.424 1.00 55.29 O ATOM 2772 CB VAL A 645 57.805 80.694 24.495 1.00 57.96 C ATOM 2773 CG1 VAL A 645 57.184 80.175 25.794 1.00 57.67 C ATOM 2774 CG2 VAL A 645 58.837 81.788 24.753 1.00 60.15 C ATOM 0 H VAL A 645 59.640 79.095 25.203 1.00 55.42 H new ATOM 0 HA VAL A 645 57.693 78.921 23.443 1.00 57.25 H new ATOM 0 HB VAL A 645 57.102 81.099 23.963 1.00 57.96 H new ATOM 0 HG11 VAL A 645 56.803 80.917 26.290 1.00 57.67 H new ATOM 0 HG12 VAL A 645 56.487 79.534 25.586 1.00 57.67 H new ATOM 0 HG13 VAL A 645 57.868 79.745 26.331 1.00 57.67 H new ATOM 0 HG21 VAL A 645 58.425 82.510 25.252 1.00 60.15 H new ATOM 0 HG22 VAL A 645 59.576 81.422 25.264 1.00 60.15 H new ATOM 0 HG23 VAL A 645 59.167 82.128 23.907 1.00 60.15 H new ATOM 2775 N VAL A 646 60.376 80.195 22.432 1.00 55.22 N ATOM 2776 CA VAL A 646 61.108 80.562 21.214 1.00 53.18 C ATOM 2777 C VAL A 646 61.236 79.359 20.281 1.00 48.91 C ATOM 2778 O VAL A 646 61.176 79.513 19.054 1.00 49.88 O ATOM 2779 CB VAL A 646 62.483 81.222 21.546 1.00 57.73 C ATOM 2780 CG1 VAL A 646 63.607 80.797 20.593 1.00 55.69 C ATOM 2781 CG2 VAL A 646 62.316 82.741 21.561 1.00 59.20 C ATOM 0 H VAL A 646 60.867 80.111 23.133 1.00 55.22 H new ATOM 0 HA VAL A 646 60.597 81.236 20.740 1.00 53.18 H new ATOM 0 HB VAL A 646 62.757 80.909 22.423 1.00 57.73 H new ATOM 0 HG11 VAL A 646 64.432 81.238 20.849 1.00 55.69 H new ATOM 0 HG12 VAL A 646 63.726 79.836 20.641 1.00 55.69 H new ATOM 0 HG13 VAL A 646 63.374 81.049 19.686 1.00 55.69 H new ATOM 0 HG21 VAL A 646 63.167 83.158 21.767 1.00 59.20 H new ATOM 0 HG22 VAL A 646 62.011 83.042 20.691 1.00 59.20 H new ATOM 0 HG23 VAL A 646 61.664 82.988 22.235 1.00 59.20 H new ATOM 2782 N VAL A 647 61.450 78.188 20.869 1.00 42.27 N ATOM 2783 CA VAL A 647 61.418 76.931 20.134 1.00 47.73 C ATOM 2784 C VAL A 647 60.029 76.769 19.470 1.00 44.36 C ATOM 2785 O VAL A 647 59.944 76.578 18.264 1.00 41.34 O ATOM 2786 CB VAL A 647 61.744 75.722 21.060 1.00 48.02 C ATOM 2787 CG1 VAL A 647 61.472 74.385 20.374 1.00 50.45 C ATOM 2788 CG2 VAL A 647 63.200 75.780 21.510 1.00 51.59 C ATOM 0 H VAL A 647 61.618 78.100 21.708 1.00 42.27 H new ATOM 0 HA VAL A 647 62.102 76.949 19.446 1.00 47.73 H new ATOM 0 HB VAL A 647 61.159 75.785 21.832 1.00 48.02 H new ATOM 0 HG11 VAL A 647 61.687 73.660 20.981 1.00 50.45 H new ATOM 0 HG12 VAL A 647 60.535 74.333 20.127 1.00 50.45 H new ATOM 0 HG13 VAL A 647 62.021 74.312 19.577 1.00 50.45 H new ATOM 0 HG21 VAL A 647 63.391 75.023 22.086 1.00 51.59 H new ATOM 0 HG22 VAL A 647 63.780 75.750 20.733 1.00 51.59 H new ATOM 0 HG23 VAL A 647 63.356 76.604 21.998 1.00 51.59 H new ATOM 2789 N ALA A 648 58.962 76.902 20.268 1.00 44.07 N ATOM 2790 CA ALA A 648 57.570 76.761 19.788 1.00 40.93 C ATOM 2791 C ALA A 648 57.282 77.679 18.636 1.00 39.29 C ATOM 2792 O ALA A 648 56.696 77.274 17.640 1.00 39.21 O ATOM 2793 CB ALA A 648 56.587 77.012 20.925 1.00 42.82 C ATOM 0 H ALA A 648 59.022 77.077 21.108 1.00 44.07 H new ATOM 0 HA ALA A 648 57.461 75.851 19.471 1.00 40.93 H new ATOM 0 HB1 ALA A 648 55.680 76.916 20.596 1.00 42.82 H new ATOM 0 HB2 ALA A 648 56.742 76.370 21.635 1.00 42.82 H new ATOM 0 HB3 ALA A 648 56.712 77.910 21.269 1.00 42.82 H new ATOM 2794 N SER A 649 57.743 78.919 18.750 1.00 41.22 N ATOM 2795 CA SER A 649 57.580 79.901 17.690 1.00 42.17 C ATOM 2796 C SER A 649 58.277 79.519 16.381 1.00 42.86 C ATOM 2797 O SER A 649 57.729 79.707 15.285 1.00 44.08 O ATOM 2798 CB SER A 649 58.108 81.261 18.156 1.00 42.22 C ATOM 2799 OG SER A 649 58.045 82.145 17.080 1.00 44.75 O ATOM 0 H SER A 649 58.158 79.213 19.443 1.00 41.22 H new ATOM 0 HA SER A 649 56.629 79.939 17.504 1.00 42.17 H new ATOM 0 HB2 SER A 649 57.579 81.593 18.898 1.00 42.22 H new ATOM 0 HB3 SER A 649 59.021 81.179 18.473 1.00 42.22 H new ATOM 0 HG SER A 649 58.330 82.898 17.319 1.00 44.75 H new ATOM 2800 N THR A 650 59.483 78.980 16.496 1.00 41.28 N ATOM 2801 CA THR A 650 60.253 78.585 15.315 1.00 41.69 C ATOM 2802 C THR A 650 59.711 77.293 14.699 1.00 37.95 C ATOM 2803 O THR A 650 59.623 77.184 13.488 1.00 38.40 O ATOM 2804 CB THR A 650 61.735 78.418 15.662 1.00 42.53 C ATOM 2805 OG1 THR A 650 62.129 79.521 16.467 1.00 43.49 O ATOM 2806 CG2 THR A 650 62.582 78.416 14.398 1.00 44.05 C ATOM 0 H THR A 650 59.877 78.833 17.246 1.00 41.28 H new ATOM 0 HA THR A 650 60.162 79.295 14.660 1.00 41.69 H new ATOM 0 HB THR A 650 61.862 77.577 16.129 1.00 42.53 H new ATOM 0 HG1 THR A 650 61.877 79.395 17.258 1.00 43.49 H new ATOM 0 HG21 THR A 650 63.517 78.310 14.635 1.00 44.05 H new ATOM 0 HG22 THR A 650 62.308 77.682 13.826 1.00 44.05 H new ATOM 0 HG23 THR A 650 62.462 79.255 13.926 1.00 44.05 H new ATOM 2807 N VAL A 651 59.307 76.343 15.530 1.00 38.89 N ATOM 2808 CA VAL A 651 58.665 75.112 15.026 1.00 40.76 C ATOM 2809 C VAL A 651 57.367 75.469 14.265 1.00 39.26 C ATOM 2810 O VAL A 651 57.100 74.943 13.173 1.00 37.97 O ATOM 2811 CB VAL A 651 58.425 74.095 16.160 1.00 38.55 C ATOM 2812 CG1 VAL A 651 57.655 72.890 15.664 1.00 40.06 C ATOM 2813 CG2 VAL A 651 59.751 73.606 16.728 1.00 40.51 C ATOM 0 H VAL A 651 59.390 76.381 16.385 1.00 38.89 H new ATOM 0 HA VAL A 651 59.265 74.678 14.400 1.00 40.76 H new ATOM 0 HB VAL A 651 57.911 74.550 16.846 1.00 38.55 H new ATOM 0 HG11 VAL A 651 57.519 72.269 16.396 1.00 40.06 H new ATOM 0 HG12 VAL A 651 56.795 73.175 15.318 1.00 40.06 H new ATOM 0 HG13 VAL A 651 58.157 72.453 14.959 1.00 40.06 H new ATOM 0 HG21 VAL A 651 59.583 72.968 17.439 1.00 40.51 H new ATOM 0 HG22 VAL A 651 60.266 73.179 16.026 1.00 40.51 H new ATOM 0 HG23 VAL A 651 60.249 74.359 17.081 1.00 40.51 H new ATOM 2814 N GLN A 652 56.598 76.401 14.820 1.00 39.26 N ATOM 2815 CA GLN A 652 55.371 76.849 14.173 1.00 41.24 C ATOM 2816 C GLN A 652 55.608 77.295 12.744 1.00 40.61 C ATOM 2817 O GLN A 652 54.836 76.908 11.863 1.00 36.31 O ATOM 2818 CB GLN A 652 54.677 77.978 14.948 1.00 43.97 C ATOM 2819 CG GLN A 652 53.618 78.699 14.113 1.00 49.54 C ATOM 2820 CD GLN A 652 52.892 79.778 14.865 1.00 57.99 C ATOM 2821 OE1 GLN A 652 53.340 80.240 15.915 1.00 64.28 O ATOM 2822 NE2 GLN A 652 51.754 80.200 14.325 1.00 66.80 N ATOM 0 H GLN A 652 56.769 76.786 15.570 1.00 39.26 H new ATOM 0 HA GLN A 652 54.786 76.075 14.167 1.00 41.24 H new ATOM 0 HB2 GLN A 652 54.262 77.611 15.744 1.00 43.97 H new ATOM 0 HB3 GLN A 652 55.342 78.619 15.244 1.00 43.97 H new ATOM 0 HG2 GLN A 652 54.042 79.088 13.332 1.00 49.54 H new ATOM 0 HG3 GLN A 652 52.973 78.050 13.791 1.00 49.54 H new ATOM 0 HE21 GLN A 652 51.472 79.853 13.590 1.00 66.80 H new ATOM 0 HE22 GLN A 652 51.299 80.820 14.710 1.00 66.80 H new ATOM 2823 N LYS A 653 56.634 78.131 12.533 1.00 39.12 N ATOM 2824 CA LYS A 653 56.992 78.627 11.202 1.00 41.93 C ATOM 2825 C LYS A 653 57.408 77.500 10.229 1.00 40.00 C ATOM 2826 O LYS A 653 57.008 77.513 9.071 1.00 42.10 O ATOM 2827 CB LYS A 653 58.139 79.660 11.286 1.00 47.38 C ATOM 2828 CG LYS A 653 57.795 80.963 12.009 1.00 53.61 C ATOM 2829 CD LYS A 653 59.041 81.798 12.329 1.00 58.02 C ATOM 0 H LYS A 653 57.141 78.425 13.162 1.00 39.12 H new ATOM 0 HA LYS A 653 56.189 79.045 10.853 1.00 41.93 H new ATOM 0 HB2 LYS A 653 58.893 79.248 11.735 1.00 47.38 H new ATOM 0 HB3 LYS A 653 58.428 79.874 10.385 1.00 47.38 H new ATOM 0 HG2 LYS A 653 57.191 81.486 11.459 1.00 53.61 H new ATOM 0 HG3 LYS A 653 57.325 80.759 12.832 1.00 53.61 H new ATOM 2830 N ASP A 654 58.215 76.544 10.680 1.00 36.69 N ATOM 2831 CA ASP A 654 58.571 75.395 9.819 1.00 37.16 C ATOM 2832 C ASP A 654 57.320 74.524 9.518 1.00 38.83 C ATOM 2833 O ASP A 654 57.108 74.084 8.377 1.00 35.40 O ATOM 2834 CB ASP A 654 59.643 74.530 10.468 1.00 37.27 C ATOM 2835 CG ASP A 654 60.285 73.541 9.484 1.00 37.10 C ATOM 2836 OD1 ASP A 654 60.610 73.911 8.352 1.00 43.60 O ATOM 2837 OD2 ASP A 654 60.461 72.373 9.829 1.00 42.84 O ATOM 0 H ASP A 654 58.566 76.532 11.465 1.00 36.69 H new ATOM 0 HA ASP A 654 58.920 75.754 8.988 1.00 37.16 H new ATOM 0 HB2 ASP A 654 60.332 75.102 10.841 1.00 37.27 H new ATOM 0 HB3 ASP A 654 59.252 74.037 11.207 1.00 37.27 H new ATOM 2838 N MET A 655 56.506 74.300 10.547 1.00 36.88 N ATOM 2839 CA MET A 655 55.264 73.560 10.390 1.00 37.28 C ATOM 2840 C MET A 655 54.323 74.185 9.358 1.00 35.60 C ATOM 2841 O MET A 655 53.704 73.463 8.579 1.00 35.48 O ATOM 2842 CB MET A 655 54.576 73.367 11.744 1.00 38.81 C ATOM 2843 CG MET A 655 53.428 72.396 11.692 1.00 40.29 C ATOM 2844 SD MET A 655 52.950 71.773 13.309 1.00 40.11 S ATOM 2845 CE MET A 655 52.041 70.326 12.790 1.00 46.09 C ATOM 0 H MET A 655 56.659 74.572 11.349 1.00 36.88 H new ATOM 0 HA MET A 655 55.496 72.686 10.039 1.00 37.28 H new ATOM 0 HB2 MET A 655 55.228 73.053 12.390 1.00 38.81 H new ATOM 0 HB3 MET A 655 54.252 74.225 12.061 1.00 38.81 H new ATOM 0 HG2 MET A 655 52.664 72.830 11.281 1.00 40.29 H new ATOM 0 HG3 MET A 655 53.670 71.649 11.123 1.00 40.29 H new ATOM 0 HE1 MET A 655 51.703 69.859 13.570 1.00 46.09 H new ATOM 0 HE2 MET A 655 51.298 70.595 12.227 1.00 46.09 H new ATOM 0 HE3 MET A 655 52.628 69.737 12.290 1.00 46.09 H new ATOM 2846 N ALA A 656 54.264 75.509 9.285 1.00 36.35 N ATOM 2847 CA ALA A 656 53.404 76.173 8.299 1.00 38.93 C ATOM 2848 C ALA A 656 53.860 75.889 6.885 1.00 41.88 C ATOM 2849 O ALA A 656 53.030 75.681 5.996 1.00 40.01 O ATOM 2850 CB ALA A 656 53.328 77.680 8.545 1.00 40.64 C ATOM 0 H ALA A 656 54.709 76.043 9.792 1.00 36.35 H new ATOM 0 HA ALA A 656 52.513 75.806 8.407 1.00 38.93 H new ATOM 0 HB1 ALA A 656 52.754 78.088 7.878 1.00 40.64 H new ATOM 0 HB2 ALA A 656 52.965 77.846 9.429 1.00 40.64 H new ATOM 0 HB3 ALA A 656 54.217 78.063 8.484 1.00 40.64 H new ATOM 2851 N ILE A 657 55.178 75.834 6.678 1.00 42.08 N ATOM 2852 CA ILE A 657 55.733 75.453 5.375 1.00 40.59 C ATOM 2853 C ILE A 657 55.432 73.985 5.048 1.00 37.35 C ATOM 2854 O ILE A 657 54.982 73.664 3.951 1.00 37.29 O ATOM 2855 CB ILE A 657 57.245 75.748 5.311 1.00 43.00 C ATOM 2856 CG1 ILE A 657 57.470 77.265 5.303 1.00 46.04 C ATOM 2857 CG2 ILE A 657 57.914 75.130 4.078 1.00 41.01 C ATOM 2858 CD1 ILE A 657 58.782 77.658 5.948 1.00 50.03 C ATOM 0 H ILE A 657 55.767 76.013 7.278 1.00 42.08 H new ATOM 0 HA ILE A 657 55.299 75.994 4.697 1.00 40.59 H new ATOM 0 HB ILE A 657 57.651 75.345 6.095 1.00 43.00 H new ATOM 0 HG12 ILE A 657 57.453 77.587 4.388 1.00 46.04 H new ATOM 0 HG13 ILE A 657 56.740 77.700 5.770 1.00 46.04 H new ATOM 0 HG21 ILE A 657 58.860 75.342 4.083 1.00 41.01 H new ATOM 0 HG22 ILE A 657 57.799 74.167 4.096 1.00 41.01 H new ATOM 0 HG23 ILE A 657 57.506 75.489 3.274 1.00 41.01 H new ATOM 0 HD11 ILE A 657 58.880 78.623 5.920 1.00 50.03 H new ATOM 0 HD12 ILE A 657 58.791 77.359 6.871 1.00 50.03 H new ATOM 0 HD13 ILE A 657 59.516 77.244 5.467 1.00 50.03 H new ATOM 2859 N MET A 658 55.678 73.100 5.996 1.00 35.29 N ATOM 2860 CA MET A 658 55.361 71.680 5.840 1.00 34.13 C ATOM 2861 C MET A 658 53.898 71.456 5.392 1.00 35.36 C ATOM 2862 O MET A 658 53.626 70.711 4.451 1.00 33.72 O ATOM 2863 CB MET A 658 55.617 70.966 7.161 1.00 34.44 C ATOM 2864 CG MET A 658 55.550 69.466 7.077 1.00 34.08 C ATOM 2865 SD MET A 658 55.612 68.654 8.686 1.00 37.45 S ATOM 2866 CE MET A 658 54.063 69.139 9.432 1.00 40.34 C ATOM 0 H MET A 658 56.034 73.299 6.753 1.00 35.29 H new ATOM 0 HA MET A 658 55.932 71.317 5.145 1.00 34.13 H new ATOM 0 HB2 MET A 658 56.493 71.222 7.491 1.00 34.44 H new ATOM 0 HB3 MET A 658 54.968 71.272 7.813 1.00 34.44 H new ATOM 0 HG2 MET A 658 54.731 69.211 6.625 1.00 34.08 H new ATOM 0 HG3 MET A 658 56.286 69.146 6.532 1.00 34.08 H new ATOM 0 HE1 MET A 658 54.237 69.614 10.260 1.00 40.34 H new ATOM 0 HE2 MET A 658 53.578 69.718 8.823 1.00 40.34 H new ATOM 0 HE3 MET A 658 53.532 68.349 9.618 1.00 40.34 H new ATOM 2867 N ILE A 659 52.973 72.120 6.063 1.00 34.37 N ATOM 2868 CA ILE A 659 51.548 71.941 5.794 1.00 38.13 C ATOM 2869 C ILE A 659 51.197 72.432 4.393 1.00 40.73 C ATOM 2870 O ILE A 659 50.510 71.735 3.639 1.00 39.20 O ATOM 2871 CB ILE A 659 50.678 72.632 6.876 1.00 38.54 C ATOM 2872 CG1 ILE A 659 50.853 71.881 8.198 1.00 36.83 C ATOM 2873 CG2 ILE A 659 49.189 72.645 6.479 1.00 40.53 C ATOM 2874 CD1 ILE A 659 50.382 72.640 9.417 1.00 39.20 C ATOM 0 H ILE A 659 53.147 72.686 6.686 1.00 34.37 H new ATOM 0 HA ILE A 659 51.352 70.992 5.833 1.00 38.13 H new ATOM 0 HB ILE A 659 50.967 73.554 6.967 1.00 38.54 H new ATOM 0 HG12 ILE A 659 50.369 71.042 8.147 1.00 36.83 H new ATOM 0 HG13 ILE A 659 51.791 71.661 8.310 1.00 36.83 H new ATOM 0 HG21 ILE A 659 48.672 73.082 7.174 1.00 40.53 H new ATOM 0 HG22 ILE A 659 49.081 73.127 5.644 1.00 40.53 H new ATOM 0 HG23 ILE A 659 48.875 71.734 6.369 1.00 40.53 H new ATOM 0 HD11 ILE A 659 50.526 72.100 10.210 1.00 39.20 H new ATOM 0 HD12 ILE A 659 50.881 73.468 9.495 1.00 39.20 H new ATOM 0 HD13 ILE A 659 49.437 72.839 9.329 1.00 39.20 H new ATOM 2875 N GLU A 660 51.685 73.611 4.033 1.00 41.42 N ATOM 2876 CA GLU A 660 51.425 74.153 2.705 1.00 44.88 C ATOM 2877 C GLU A 660 52.055 73.340 1.580 1.00 40.65 C ATOM 2878 O GLU A 660 51.436 73.175 0.539 1.00 40.23 O ATOM 2879 CB GLU A 660 51.821 75.634 2.621 1.00 49.29 C ATOM 2880 CG GLU A 660 50.925 76.518 3.493 1.00 57.71 C ATOM 2881 CD GLU A 660 49.417 76.331 3.229 1.00 65.28 C ATOM 2882 OE1 GLU A 660 48.982 76.589 2.077 1.00 69.57 O ATOM 2883 OE2 GLU A 660 48.668 75.918 4.168 1.00 64.82 O ATOM 0 H GLU A 660 52.167 74.112 4.539 1.00 41.42 H new ATOM 0 HA GLU A 660 50.467 74.086 2.572 1.00 44.88 H new ATOM 0 HB2 GLU A 660 52.745 75.737 2.899 1.00 49.29 H new ATOM 0 HB3 GLU A 660 51.767 75.930 1.699 1.00 49.29 H new ATOM 0 HG2 GLU A 660 51.107 76.327 4.426 1.00 57.71 H new ATOM 0 HG3 GLU A 660 51.158 77.448 3.343 1.00 57.71 H new ATOM 2884 N ASP A 661 53.272 72.837 1.771 1.00 40.14 N ATOM 2885 CA ASP A 661 53.849 71.893 0.809 1.00 40.24 C ATOM 2886 C ASP A 661 53.050 70.580 0.733 1.00 39.38 C ATOM 2887 O ASP A 661 52.868 70.037 -0.362 1.00 37.92 O ATOM 2888 CB ASP A 661 55.318 71.578 1.131 1.00 42.25 C ATOM 2889 CG ASP A 661 56.234 72.809 1.002 1.00 47.28 C ATOM 2890 OD1 ASP A 661 55.771 73.893 0.549 1.00 49.17 O ATOM 2891 OD2 ASP A 661 57.419 72.686 1.387 1.00 47.80 O ATOM 0 H ASP A 661 53.777 73.025 2.442 1.00 40.14 H new ATOM 0 HA ASP A 661 53.803 72.332 -0.055 1.00 40.24 H new ATOM 0 HB2 ASP A 661 55.379 71.228 2.033 1.00 42.25 H new ATOM 0 HB3 ASP A 661 55.633 70.881 0.534 1.00 42.25 H new ATOM 2892 N GLU A 662 52.618 70.059 1.882 1.00 37.72 N ATOM 2893 CA GLU A 662 51.880 68.783 1.914 1.00 38.80 C ATOM 2894 C GLU A 662 50.529 68.934 1.212 1.00 39.37 C ATOM 2895 O GLU A 662 50.106 68.050 0.464 1.00 36.33 O ATOM 2896 CB GLU A 662 51.661 68.293 3.350 1.00 39.41 C ATOM 2897 CG GLU A 662 50.956 66.928 3.478 1.00 41.90 C ATOM 2898 CD GLU A 662 51.780 65.751 2.941 1.00 42.27 C ATOM 2899 OE1 GLU A 662 52.955 65.964 2.596 1.00 39.04 O ATOM 2900 OE2 GLU A 662 51.255 64.608 2.849 1.00 38.08 O ATOM 0 H GLU A 662 52.738 70.422 2.652 1.00 37.72 H new ATOM 0 HA GLU A 662 52.417 68.124 1.447 1.00 38.80 H new ATOM 0 HB2 GLU A 662 52.522 68.239 3.793 1.00 39.41 H new ATOM 0 HB3 GLU A 662 51.138 68.957 3.827 1.00 39.41 H new ATOM 0 HG2 GLU A 662 50.749 66.767 4.412 1.00 41.90 H new ATOM 0 HG3 GLU A 662 50.111 66.964 3.002 1.00 41.90 H new ATOM 2901 N LYS A 663 49.865 70.054 1.460 1.00 38.01 N ATOM 2902 CA LYS A 663 48.594 70.357 0.808 1.00 42.95 C ATOM 2903 C LYS A 663 48.712 70.339 -0.711 1.00 43.78 C ATOM 2904 O LYS A 663 47.906 69.708 -1.409 1.00 40.60 O ATOM 2905 CB LYS A 663 48.083 71.722 1.264 1.00 46.43 C ATOM 2906 CG LYS A 663 46.746 72.115 0.660 1.00 50.86 C ATOM 2907 CD LYS A 663 46.151 73.318 1.375 1.00 59.31 C ATOM 2908 CE LYS A 663 44.683 73.490 1.010 1.00 66.04 C ATOM 2909 NZ LYS A 663 44.281 74.917 1.130 1.00 71.58 N ATOM 0 H LYS A 663 50.135 70.659 2.008 1.00 38.01 H new ATOM 0 HA LYS A 663 47.965 69.665 1.066 1.00 42.95 H new ATOM 0 HB2 LYS A 663 48.003 71.720 2.231 1.00 46.43 H new ATOM 0 HB3 LYS A 663 48.742 72.396 1.035 1.00 46.43 H new ATOM 0 HG2 LYS A 663 46.861 72.320 -0.281 1.00 50.86 H new ATOM 0 HG3 LYS A 663 46.131 71.367 0.715 1.00 50.86 H new ATOM 0 HD2 LYS A 663 46.239 73.206 2.334 1.00 59.31 H new ATOM 0 HD3 LYS A 663 46.644 74.118 1.136 1.00 59.31 H new ATOM 0 HE2 LYS A 663 44.531 73.181 0.103 1.00 66.04 H new ATOM 0 HE3 LYS A 663 44.133 72.943 1.592 1.00 66.04 H new ATOM 0 HZ1 LYS A 663 43.422 75.003 0.914 1.00 71.58 H new ATOM 0 HZ2 LYS A 663 44.405 75.191 1.968 1.00 71.58 H new ATOM 0 HZ3 LYS A 663 44.776 75.412 0.580 1.00 71.58 H new ATOM 2910 N ALA A 664 49.732 71.022 -1.219 1.00 42.07 N ATOM 2911 CA ALA A 664 49.981 71.058 -2.658 1.00 42.88 C ATOM 2912 C ALA A 664 50.316 69.673 -3.206 1.00 41.24 C ATOM 2913 O ALA A 664 49.804 69.284 -4.260 1.00 40.10 O ATOM 2914 CB ALA A 664 51.098 72.056 -2.993 1.00 44.33 C ATOM 0 H ALA A 664 50.293 71.472 -0.748 1.00 42.07 H new ATOM 0 HA ALA A 664 49.163 71.354 -3.087 1.00 42.88 H new ATOM 0 HB1 ALA A 664 51.248 72.065 -3.951 1.00 44.33 H new ATOM 0 HB2 ALA A 664 50.839 72.943 -2.698 1.00 44.33 H new ATOM 0 HB3 ALA A 664 51.915 71.792 -2.541 1.00 44.33 H new ATOM 2915 N LEU A 665 51.183 68.935 -2.512 1.00 37.35 N ATOM 2916 CA LEU A 665 51.535 67.573 -2.959 1.00 37.08 C ATOM 2917 C LEU A 665 50.303 66.661 -3.027 1.00 32.79 C ATOM 2918 O LEU A 665 50.176 65.886 -3.960 1.00 34.08 O ATOM 2919 CB LEU A 665 52.593 66.922 -2.061 1.00 37.97 C ATOM 2920 CG LEU A 665 54.048 67.364 -2.289 1.00 42.56 C ATOM 2921 CD1 LEU A 665 54.958 66.877 -1.169 1.00 41.11 C ATOM 2922 CD2 LEU A 665 54.581 66.877 -3.629 1.00 42.35 C ATOM 0 H LEU A 665 51.576 69.193 -1.792 1.00 37.35 H new ATOM 0 HA LEU A 665 51.905 67.675 -3.850 1.00 37.08 H new ATOM 0 HB2 LEU A 665 52.361 67.104 -1.137 1.00 37.97 H new ATOM 0 HB3 LEU A 665 52.545 65.961 -2.182 1.00 37.97 H new ATOM 0 HG LEU A 665 54.047 68.334 -2.292 1.00 42.56 H new ATOM 0 HD11 LEU A 665 55.867 67.170 -1.340 1.00 41.11 H new ATOM 0 HD12 LEU A 665 54.654 67.242 -0.323 1.00 41.11 H new ATOM 0 HD13 LEU A 665 54.933 65.908 -1.130 1.00 41.11 H new ATOM 0 HD21 LEU A 665 55.498 67.173 -3.739 1.00 42.35 H new ATOM 0 HD22 LEU A 665 54.549 65.908 -3.658 1.00 42.35 H new ATOM 0 HD23 LEU A 665 54.036 67.239 -4.345 1.00 42.35 H new ATOM 2923 N ARG A 666 49.417 66.750 -2.049 1.00 31.31 N ATOM 2924 CA ARG A 666 48.222 65.887 -2.041 1.00 35.73 C ATOM 2925 C ARG A 666 47.273 66.236 -3.200 1.00 37.38 C ATOM 2926 O ARG A 666 46.777 65.339 -3.865 1.00 37.38 O ATOM 2927 CB ARG A 666 47.514 65.912 -0.698 1.00 34.99 C ATOM 2928 CG ARG A 666 48.287 65.120 0.345 1.00 36.87 C ATOM 2929 CD ARG A 666 47.600 65.069 1.684 1.00 35.99 C ATOM 2930 NE ARG A 666 48.522 64.624 2.735 1.00 36.77 N ATOM 2931 CZ ARG A 666 48.217 64.528 4.023 1.00 35.79 C ATOM 2932 NH1 ARG A 666 46.984 64.775 4.447 1.00 37.63 N ATOM 2933 NH2 ARG A 666 49.141 64.153 4.900 1.00 36.01 N ATOM 0 H ARG A 666 49.477 67.292 -1.384 1.00 31.31 H new ATOM 0 HA ARG A 666 48.522 64.975 -2.179 1.00 35.73 H new ATOM 0 HB2 ARG A 666 47.411 66.830 -0.401 1.00 34.99 H new ATOM 0 HB3 ARG A 666 46.622 65.543 -0.793 1.00 34.99 H new ATOM 0 HG2 ARG A 666 48.420 64.215 0.022 1.00 36.87 H new ATOM 0 HG3 ARG A 666 49.167 65.514 0.455 1.00 36.87 H new ATOM 0 HD2 ARG A 666 47.252 65.947 1.906 1.00 35.99 H new ATOM 0 HD3 ARG A 666 46.841 64.466 1.639 1.00 35.99 H new ATOM 0 HE ARG A 666 49.320 64.409 2.498 1.00 36.77 H new ATOM 0 HH11 ARG A 666 46.373 65.000 3.885 1.00 37.63 H new ATOM 0 HH12 ARG A 666 46.796 64.710 5.284 1.00 37.63 H new ATOM 0 HH21 ARG A 666 49.938 63.972 4.634 1.00 36.01 H new ATOM 0 HH22 ARG A 666 48.942 64.091 5.734 1.00 36.01 H new ATOM 2934 N GLU A 667 47.086 67.527 -3.459 1.00 39.72 N ATOM 2935 CA GLU A 667 46.318 68.005 -4.615 1.00 42.80 C ATOM 2936 C GLU A 667 46.864 67.433 -5.912 1.00 42.04 C ATOM 2937 O GLU A 667 46.108 66.907 -6.729 1.00 40.27 O ATOM 2938 CB GLU A 667 46.306 69.545 -4.670 1.00 46.74 C ATOM 2939 CG GLU A 667 45.347 70.176 -3.660 1.00 53.92 C ATOM 2940 CD GLU A 667 45.507 71.695 -3.459 1.00 63.15 C ATOM 2941 OE1 GLU A 667 46.433 72.312 -4.044 1.00 69.22 O ATOM 2942 OE2 GLU A 667 44.703 72.278 -2.680 1.00 63.49 O ATOM 0 H GLU A 667 47.402 68.158 -2.967 1.00 39.72 H new ATOM 0 HA GLU A 667 45.405 67.695 -4.509 1.00 42.80 H new ATOM 0 HB2 GLU A 667 47.203 69.876 -4.506 1.00 46.74 H new ATOM 0 HB3 GLU A 667 46.058 69.829 -5.564 1.00 46.74 H new ATOM 0 HG2 GLU A 667 44.437 69.997 -3.945 1.00 53.92 H new ATOM 0 HG3 GLU A 667 45.468 69.737 -2.804 1.00 53.92 H new ATOM 2943 N THR A 668 48.184 67.492 -6.077 1.00 40.13 N ATOM 2944 CA THR A 668 48.834 66.945 -7.257 1.00 37.49 C ATOM 2945 C THR A 668 48.579 65.445 -7.424 1.00 38.28 C ATOM 2946 O THR A 668 48.305 65.001 -8.538 1.00 38.81 O ATOM 2947 CB THR A 668 50.366 67.211 -7.262 1.00 38.14 C ATOM 2948 OG1 THR A 668 50.609 68.613 -7.288 1.00 39.59 O ATOM 2949 CG2 THR A 668 51.044 66.595 -8.468 1.00 39.71 C ATOM 0 H THR A 668 48.722 67.849 -5.509 1.00 40.13 H new ATOM 0 HA THR A 668 48.435 67.410 -8.009 1.00 37.49 H new ATOM 0 HB THR A 668 50.729 66.807 -6.458 1.00 38.14 H new ATOM 0 HG1 THR A 668 50.434 68.942 -6.535 1.00 39.59 H new ATOM 0 HG21 THR A 668 51.995 66.782 -8.435 1.00 39.71 H new ATOM 0 HG22 THR A 668 50.903 65.635 -8.464 1.00 39.71 H new ATOM 0 HG23 THR A 668 50.668 66.973 -9.279 1.00 39.71 H new ATOM 2950 N VAL A 669 48.690 64.649 -6.361 1.00 35.95 N ATOM 2951 CA VAL A 669 48.502 63.207 -6.542 1.00 37.20 C ATOM 2952 C VAL A 669 46.998 62.869 -6.746 1.00 34.70 C ATOM 2953 O VAL A 669 46.686 61.913 -7.440 1.00 33.91 O ATOM 2954 CB VAL A 669 49.171 62.320 -5.449 1.00 38.86 C ATOM 2955 CG1 VAL A 669 50.641 62.713 -5.248 1.00 44.36 C ATOM 2956 CG2 VAL A 669 48.435 62.368 -4.138 1.00 39.90 C ATOM 0 H VAL A 669 48.866 64.907 -5.560 1.00 35.95 H new ATOM 0 HA VAL A 669 48.981 62.976 -7.353 1.00 37.20 H new ATOM 0 HB VAL A 669 49.129 61.406 -5.770 1.00 38.86 H new ATOM 0 HG11 VAL A 669 51.036 62.149 -4.565 1.00 44.36 H new ATOM 0 HG12 VAL A 669 51.124 62.598 -6.081 1.00 44.36 H new ATOM 0 HG13 VAL A 669 50.693 63.641 -4.971 1.00 44.36 H new ATOM 0 HG21 VAL A 669 48.887 61.803 -3.492 1.00 39.90 H new ATOM 0 HG22 VAL A 669 48.416 63.281 -3.811 1.00 39.90 H new ATOM 0 HG23 VAL A 669 47.527 62.051 -4.265 1.00 39.90 H new ATOM 2957 N ARG A 670 46.091 63.644 -6.159 1.00 33.14 N ATOM 2958 CA ARG A 670 44.653 63.466 -6.432 1.00 36.99 C ATOM 2959 C ARG A 670 44.371 63.675 -7.928 1.00 38.27 C ATOM 2960 O ARG A 670 43.664 62.891 -8.528 1.00 39.01 O ATOM 2961 CB ARG A 670 43.780 64.394 -5.576 1.00 38.54 C ATOM 2962 CG ARG A 670 42.268 64.293 -5.836 1.00 39.79 C ATOM 2963 CD ARG A 670 41.729 62.896 -5.561 1.00 44.12 C ATOM 2964 NE ARG A 670 40.345 62.739 -6.011 1.00 45.77 N ATOM 2965 CZ ARG A 670 39.965 62.432 -7.250 1.00 45.68 C ATOM 2966 NH1 ARG A 670 40.852 62.225 -8.230 1.00 41.92 N ATOM 2967 NH2 ARG A 670 38.667 62.319 -7.510 1.00 49.91 N ATOM 0 H ARG A 670 46.277 64.274 -5.604 1.00 33.14 H new ATOM 0 HA ARG A 670 44.418 62.557 -6.189 1.00 36.99 H new ATOM 0 HB2 ARG A 670 43.947 64.199 -4.640 1.00 38.54 H new ATOM 0 HB3 ARG A 670 44.060 65.310 -5.729 1.00 38.54 H new ATOM 0 HG2 ARG A 670 41.802 64.934 -5.276 1.00 39.79 H new ATOM 0 HG3 ARG A 670 42.083 64.534 -6.757 1.00 39.79 H new ATOM 0 HD2 ARG A 670 42.289 62.241 -6.007 1.00 44.12 H new ATOM 0 HD3 ARG A 670 41.781 62.712 -4.610 1.00 44.12 H new ATOM 0 HE ARG A 670 39.725 62.855 -5.426 1.00 45.77 H new ATOM 0 HH11 ARG A 670 41.694 62.289 -8.068 1.00 41.92 H new ATOM 0 HH12 ARG A 670 40.580 62.028 -9.022 1.00 41.92 H new ATOM 0 HH21 ARG A 670 38.091 62.443 -6.884 1.00 49.91 H new ATOM 0 HH22 ARG A 670 38.403 62.121 -8.304 1.00 49.91 H new ATOM 2968 N LYS A 671 45.010 64.663 -8.534 1.00 37.95 N ATOM 2969 CA LYS A 671 44.848 64.907 -9.960 1.00 41.00 C ATOM 2970 C LYS A 671 45.483 63.877 -10.857 1.00 40.93 C ATOM 2971 O LYS A 671 45.133 63.817 -12.034 1.00 38.67 O ATOM 2972 CB LYS A 671 45.344 66.277 -10.324 1.00 42.44 C ATOM 2973 CG LYS A 671 44.455 67.334 -9.727 1.00 47.23 C ATOM 2974 CD LYS A 671 44.970 68.729 -10.008 1.00 53.21 C ATOM 2975 CE LYS A 671 44.317 69.705 -9.042 1.00 63.60 C ATOM 2976 NZ LYS A 671 44.089 71.033 -9.668 1.00 72.32 N ATOM 0 H LYS A 671 45.545 65.207 -8.137 1.00 37.95 H new ATOM 0 HA LYS A 671 43.893 64.840 -10.117 1.00 41.00 H new ATOM 0 HB2 LYS A 671 46.253 66.393 -10.006 1.00 42.44 H new ATOM 0 HB3 LYS A 671 45.367 66.373 -11.289 1.00 42.44 H new ATOM 0 HG2 LYS A 671 43.558 67.242 -10.086 1.00 47.23 H new ATOM 0 HG3 LYS A 671 44.392 67.200 -8.768 1.00 47.23 H new ATOM 0 HD2 LYS A 671 45.935 68.756 -9.909 1.00 53.21 H new ATOM 0 HD3 LYS A 671 44.771 68.981 -10.923 1.00 53.21 H new ATOM 0 HE2 LYS A 671 43.471 69.341 -8.738 1.00 63.60 H new ATOM 0 HE3 LYS A 671 44.879 69.809 -8.258 1.00 63.60 H new ATOM 0 HZ1 LYS A 671 43.707 71.578 -9.077 1.00 72.32 H new ATOM 0 HZ2 LYS A 671 44.868 71.377 -9.928 1.00 72.32 H new ATOM 0 HZ3 LYS A 671 43.556 70.941 -10.374 1.00 72.32 H new ATOM 2977 N LEU A 672 46.397 63.071 -10.323 1.00 40.51 N ATOM 2978 CA LEU A 672 46.926 61.921 -11.051 1.00 40.21 C ATOM 2979 C LEU A 672 46.012 60.704 -11.002 1.00 38.01 C ATOM 2980 O LEU A 672 46.300 59.712 -11.661 1.00 38.55 O ATOM 2981 CB LEU A 672 48.316 61.529 -10.526 1.00 43.68 C ATOM 2982 CG LEU A 672 49.419 62.573 -10.729 1.00 47.21 C ATOM 2983 CD1 LEU A 672 50.689 62.046 -10.083 1.00 50.32 C ATOM 2984 CD2 LEU A 672 49.663 62.928 -12.202 1.00 45.91 C ATOM 0 H LEU A 672 46.726 63.174 -9.535 1.00 40.51 H new ATOM 0 HA LEU A 672 46.987 62.204 -11.977 1.00 40.21 H new ATOM 0 HB2 LEU A 672 48.244 61.338 -9.578 1.00 43.68 H new ATOM 0 HB3 LEU A 672 48.588 60.706 -10.961 1.00 43.68 H new ATOM 0 HG LEU A 672 49.133 63.401 -10.311 1.00 47.21 H new ATOM 0 HD11 LEU A 672 51.403 62.692 -10.199 1.00 50.32 H new ATOM 0 HD12 LEU A 672 50.535 61.902 -9.136 1.00 50.32 H new ATOM 0 HD13 LEU A 672 50.941 61.208 -10.501 1.00 50.32 H new ATOM 0 HD21 LEU A 672 50.369 63.590 -12.263 1.00 45.91 H new ATOM 0 HD22 LEU A 672 49.925 62.131 -12.688 1.00 45.91 H new ATOM 0 HD23 LEU A 672 48.849 63.288 -12.588 1.00 45.91 H new ATOM 2985 N GLY A 673 44.946 60.760 -10.212 1.00 38.81 N ATOM 2986 CA GLY A 673 43.949 59.684 -10.166 1.00 38.18 C ATOM 2987 C GLY A 673 44.076 58.761 -8.972 1.00 38.68 C ATOM 2988 O GLY A 673 43.441 57.713 -8.949 1.00 42.11 O ATOM 0 H GLY A 673 44.776 61.419 -9.687 1.00 38.81 H new ATOM 0 HA2 GLY A 673 43.063 60.079 -10.162 1.00 38.18 H new ATOM 0 HA3 GLY A 673 44.021 59.157 -10.977 1.00 38.18 H new ATOM 2989 N VAL A 674 44.889 59.137 -7.978 1.00 39.44 N ATOM 2990 CA VAL A 674 44.944 58.396 -6.712 1.00 36.47 C ATOM 2991 C VAL A 674 43.761 58.866 -5.902 1.00 34.79 C ATOM 2992 O VAL A 674 43.655 60.045 -5.584 1.00 37.04 O ATOM 2993 CB VAL A 674 46.239 58.656 -5.895 1.00 35.08 C ATOM 2994 CG1 VAL A 674 46.244 57.782 -4.637 1.00 36.44 C ATOM 2995 CG2 VAL A 674 47.471 58.358 -6.735 1.00 35.37 C ATOM 0 H VAL A 674 45.415 59.816 -8.017 1.00 39.44 H new ATOM 0 HA VAL A 674 44.932 57.446 -6.906 1.00 36.47 H new ATOM 0 HB VAL A 674 46.259 59.591 -5.638 1.00 35.08 H new ATOM 0 HG11 VAL A 674 47.054 57.948 -4.131 1.00 36.44 H new ATOM 0 HG12 VAL A 674 45.472 57.997 -4.090 1.00 36.44 H new ATOM 0 HG13 VAL A 674 46.209 56.847 -4.892 1.00 36.44 H new ATOM 0 HG21 VAL A 674 48.269 58.526 -6.210 1.00 35.37 H new ATOM 0 HG22 VAL A 674 47.456 57.429 -7.013 1.00 35.37 H new ATOM 0 HG23 VAL A 674 47.474 58.929 -7.519 1.00 35.37 H new ATOM 2996 N ILE A 675 42.874 57.948 -5.554 1.00 36.96 N ATOM 2997 CA ILE A 675 41.622 58.327 -4.896 1.00 38.16 C ATOM 2998 C ILE A 675 41.478 57.720 -3.522 1.00 35.05 C ATOM 2999 O ILE A 675 41.091 58.406 -2.565 1.00 38.42 O ATOM 3000 CB ILE A 675 40.409 57.930 -5.766 1.00 44.55 C ATOM 3001 CG1 ILE A 675 40.447 58.693 -7.084 1.00 45.62 C ATOM 3002 CG2 ILE A 675 39.099 58.223 -5.041 1.00 46.90 C ATOM 3003 CD1 ILE A 675 39.770 57.950 -8.209 1.00 52.15 C ATOM 0 H ILE A 675 42.971 57.104 -5.686 1.00 36.96 H new ATOM 0 HA ILE A 675 41.649 59.291 -4.789 1.00 38.16 H new ATOM 0 HB ILE A 675 40.458 56.977 -5.940 1.00 44.55 H new ATOM 0 HG12 ILE A 675 40.018 59.555 -6.967 1.00 45.62 H new ATOM 0 HG13 ILE A 675 41.370 58.867 -7.326 1.00 45.62 H new ATOM 0 HG21 ILE A 675 38.353 57.966 -5.605 1.00 46.90 H new ATOM 0 HG22 ILE A 675 39.067 57.718 -4.213 1.00 46.90 H new ATOM 0 HG23 ILE A 675 39.043 59.171 -4.843 1.00 46.90 H new ATOM 0 HD11 ILE A 675 39.822 58.476 -9.022 1.00 52.15 H new ATOM 0 HD12 ILE A 675 40.213 57.098 -8.347 1.00 52.15 H new ATOM 0 HD13 ILE A 675 38.839 57.797 -7.982 1.00 52.15 H new ATOM 3004 N ASP A 676 41.783 56.447 -3.420 1.00 34.69 N ATOM 3005 CA ASP A 676 41.681 55.732 -2.167 1.00 39.21 C ATOM 3006 C ASP A 676 42.773 56.193 -1.184 1.00 40.28 C ATOM 3007 O ASP A 676 43.873 56.584 -1.597 1.00 33.01 O ATOM 3008 CB ASP A 676 41.784 54.241 -2.455 1.00 47.85 C ATOM 3009 CG ASP A 676 41.081 53.400 -1.441 1.00 57.18 C ATOM 3010 OD1 ASP A 676 39.914 53.720 -1.107 1.00 69.25 O ATOM 3011 OD2 ASP A 676 41.687 52.396 -1.002 1.00 65.87 O ATOM 0 H ASP A 676 42.057 55.967 -4.079 1.00 34.69 H new ATOM 0 HA ASP A 676 40.827 55.919 -1.747 1.00 39.21 H new ATOM 0 HB2 ASP A 676 41.412 54.060 -3.332 1.00 47.85 H new ATOM 0 HB3 ASP A 676 42.720 53.987 -2.486 1.00 47.85 H new ATOM 3012 N SER A 677 42.455 56.207 0.110 1.00 40.01 N ATOM 3013 CA SER A 677 43.415 56.650 1.105 1.00 39.43 C ATOM 3014 C SER A 677 43.146 55.975 2.425 1.00 42.61 C ATOM 3015 O SER A 677 42.024 55.553 2.674 1.00 38.90 O ATOM 3016 CB SER A 677 43.345 58.167 1.256 1.00 39.41 C ATOM 3017 OG SER A 677 42.133 58.542 1.885 1.00 40.99 O ATOM 0 H SER A 677 41.693 55.965 0.426 1.00 40.01 H new ATOM 0 HA SER A 677 44.308 56.407 0.813 1.00 39.43 H new ATOM 0 HB2 SER A 677 44.099 58.482 1.779 1.00 39.41 H new ATOM 0 HB3 SER A 677 43.409 58.588 0.385 1.00 39.41 H new ATOM 0 HG SER A 677 42.105 59.378 1.965 1.00 40.99 H new ATOM 3018 N GLU A 678 44.187 55.858 3.256 1.00 36.09 N ATOM 3019 CA GLU A 678 44.057 55.288 4.590 1.00 36.60 C ATOM 3020 C GLU A 678 45.125 55.897 5.496 1.00 34.70 C ATOM 3021 O GLU A 678 46.264 56.126 5.047 1.00 31.83 O ATOM 3022 CB GLU A 678 44.193 53.747 4.539 1.00 38.36 C ATOM 3023 CG GLU A 678 43.794 53.085 5.855 1.00 43.88 C ATOM 3024 CD GLU A 678 43.967 51.565 5.914 1.00 52.18 C ATOM 3025 OE1 GLU A 678 44.249 50.906 4.873 1.00 60.48 O ATOM 3026 OE2 GLU A 678 43.805 51.029 7.045 1.00 58.87 O ATOM 0 H GLU A 678 44.985 56.108 3.057 1.00 36.09 H new ATOM 0 HA GLU A 678 43.179 55.494 4.946 1.00 36.60 H new ATOM 0 HB2 GLU A 678 43.638 53.399 3.823 1.00 38.36 H new ATOM 0 HB3 GLU A 678 45.110 53.512 4.327 1.00 38.36 H new ATOM 0 HG2 GLU A 678 44.318 53.481 6.569 1.00 43.88 H new ATOM 0 HG3 GLU A 678 42.864 53.295 6.035 1.00 43.88 H new ATOM 3027 N ARG A 679 44.757 56.194 6.736 1.00 32.18 N ATOM 3028 CA ARG A 679 45.687 56.687 7.732 1.00 33.99 C ATOM 3029 C ARG A 679 46.764 55.644 8.009 1.00 33.81 C ATOM 3030 O ARG A 679 46.487 54.435 7.999 1.00 31.52 O ATOM 3031 CB ARG A 679 44.988 57.049 9.050 1.00 39.38 C ATOM 3032 CG ARG A 679 45.890 57.772 10.053 1.00 44.48 C ATOM 3033 CD ARG A 679 45.207 57.991 11.399 1.00 49.08 C ATOM 3034 NE ARG A 679 44.212 59.046 11.268 1.00 53.88 N ATOM 3035 CZ ARG A 679 44.426 60.364 11.432 1.00 58.85 C ATOM 3036 NH1 ARG A 679 45.625 60.861 11.789 1.00 47.07 N ATOM 3037 NH2 ARG A 679 43.400 61.207 11.249 1.00 61.92 N ATOM 0 H ARG A 679 43.950 56.113 7.023 1.00 32.18 H new ATOM 0 HA ARG A 679 46.087 57.494 7.371 1.00 33.99 H new ATOM 0 HB2 ARG A 679 44.221 57.610 8.855 1.00 39.38 H new ATOM 0 HB3 ARG A 679 44.649 56.238 9.460 1.00 39.38 H new ATOM 0 HG2 ARG A 679 46.701 57.256 10.185 1.00 44.48 H new ATOM 0 HG3 ARG A 679 46.156 58.629 9.685 1.00 44.48 H new ATOM 0 HD2 ARG A 679 44.785 57.170 11.697 1.00 49.08 H new ATOM 0 HD3 ARG A 679 45.863 58.233 12.071 1.00 49.08 H new ATOM 0 HE ARG A 679 43.412 58.804 11.067 1.00 53.88 H new ATOM 0 HH11 ARG A 679 46.289 60.330 11.921 1.00 47.07 H new ATOM 0 HH12 ARG A 679 45.727 61.709 11.885 1.00 47.07 H new ATOM 0 HH21 ARG A 679 42.626 60.902 11.032 1.00 61.92 H new ATOM 0 HH22 ARG A 679 43.516 62.053 11.349 1.00 61.92 H new ATOM 3038 N MET A 680 47.994 56.108 8.238 1.00 32.76 N ATOM 3039 CA MET A 680 49.093 55.201 8.560 1.00 32.26 C ATOM 3040 C MET A 680 50.052 55.818 9.565 1.00 31.96 C ATOM 3041 O MET A 680 50.542 56.907 9.328 1.00 29.78 O ATOM 3042 CB MET A 680 49.874 54.855 7.311 1.00 33.40 C ATOM 3043 CG MET A 680 50.901 53.760 7.579 1.00 38.04 C ATOM 3044 SD MET A 680 51.379 52.850 6.099 1.00 43.28 S ATOM 3045 CE MET A 680 52.582 53.946 5.485 1.00 42.18 C ATOM 0 H MET A 680 48.210 56.940 8.212 1.00 32.76 H new ATOM 0 HA MET A 680 48.698 54.403 8.945 1.00 32.26 H new ATOM 0 HB2 MET A 680 49.263 54.564 6.616 1.00 33.40 H new ATOM 0 HB3 MET A 680 50.324 55.648 6.979 1.00 33.40 H new ATOM 0 HG2 MET A 680 51.692 54.158 7.976 1.00 38.04 H new ATOM 0 HG3 MET A 680 50.539 53.139 8.230 1.00 38.04 H new ATOM 0 HE1 MET A 680 52.270 54.336 4.654 1.00 42.18 H new ATOM 0 HE2 MET A 680 52.739 54.650 6.133 1.00 42.18 H new ATOM 0 HE3 MET A 680 53.408 53.464 5.325 1.00 42.18 H new ATOM 3046 N ASP A 681 50.364 55.081 10.638 1.00 30.91 N ATOM 3047 CA ASP A 681 51.315 55.538 11.663 1.00 30.06 C ATOM 3048 C ASP A 681 52.741 55.232 11.228 1.00 29.40 C ATOM 3049 O ASP A 681 53.393 54.326 11.753 1.00 26.57 O ATOM 3050 CB ASP A 681 51.004 54.895 13.019 1.00 31.38 C ATOM 3051 CG ASP A 681 49.647 55.321 13.567 1.00 34.22 C ATOM 3052 OD1 ASP A 681 49.208 56.453 13.275 1.00 35.80 O ATOM 3053 OD2 ASP A 681 49.038 54.536 14.311 1.00 33.92 O ATOM 0 H ASP A 681 50.031 54.303 10.792 1.00 30.91 H new ATOM 0 HA ASP A 681 51.225 56.499 11.764 1.00 30.06 H new ATOM 0 HB2 ASP A 681 51.025 53.929 12.929 1.00 31.38 H new ATOM 0 HB3 ASP A 681 51.696 55.135 13.654 1.00 31.38 H new ATOM 3054 N PHE A 682 53.231 56.028 10.292 1.00 28.46 N ATOM 3055 CA PHE A 682 54.554 55.841 9.714 1.00 29.51 C ATOM 3056 C PHE A 682 55.659 55.697 10.773 1.00 33.71 C ATOM 3057 O PHE A 682 56.654 54.986 10.545 1.00 31.90 O ATOM 3058 CB PHE A 682 54.914 57.012 8.816 1.00 31.30 C ATOM 3059 CG PHE A 682 54.232 57.003 7.486 1.00 30.38 C ATOM 3060 CD1 PHE A 682 53.024 57.657 7.299 1.00 31.36 C ATOM 3061 CD2 PHE A 682 54.835 56.403 6.395 1.00 31.52 C ATOM 3062 CE1 PHE A 682 52.401 57.675 6.054 1.00 31.79 C ATOM 3063 CE2 PHE A 682 54.224 56.425 5.150 1.00 32.29 C ATOM 3064 CZ PHE A 682 52.996 57.055 4.980 1.00 30.21 C ATOM 0 H PHE A 682 52.802 56.700 9.970 1.00 28.46 H new ATOM 0 HA PHE A 682 54.506 55.015 9.207 1.00 29.51 H new ATOM 0 HB2 PHE A 682 54.693 57.837 9.275 1.00 31.30 H new ATOM 0 HB3 PHE A 682 55.874 57.014 8.675 1.00 31.30 H new ATOM 0 HD1 PHE A 682 52.623 58.091 8.017 1.00 31.36 H new ATOM 0 HD2 PHE A 682 55.657 55.981 6.497 1.00 31.52 H new ATOM 0 HE1 PHE A 682 51.584 58.106 5.949 1.00 31.79 H new ATOM 0 HE2 PHE A 682 54.638 56.016 4.425 1.00 32.29 H new ATOM 0 HZ PHE A 682 52.581 57.057 4.148 1.00 30.21 H new ATOM 3065 N GLU A 683 55.491 56.348 11.930 1.00 30.83 N ATOM 3066 CA GLU A 683 56.559 56.335 12.936 1.00 32.59 C ATOM 3067 C GLU A 683 56.788 54.959 13.550 1.00 32.67 C ATOM 3068 O GLU A 683 57.826 54.737 14.155 1.00 32.48 O ATOM 3069 CB GLU A 683 56.330 57.385 14.031 1.00 33.94 C ATOM 3070 CG GLU A 683 55.167 57.121 15.002 1.00 35.07 C ATOM 3071 CD GLU A 683 53.800 57.498 14.464 1.00 36.59 C ATOM 3072 OE1 GLU A 683 53.617 57.775 13.238 1.00 36.56 O ATOM 3073 OE2 GLU A 683 52.881 57.512 15.290 1.00 41.73 O ATOM 0 H GLU A 683 54.787 56.791 12.147 1.00 30.83 H new ATOM 0 HA GLU A 683 57.369 56.569 12.456 1.00 32.59 H new ATOM 0 HB2 GLU A 683 57.146 57.466 14.549 1.00 33.94 H new ATOM 0 HB3 GLU A 683 56.180 58.242 13.603 1.00 33.94 H new ATOM 0 HG2 GLU A 683 55.162 56.179 15.234 1.00 35.07 H new ATOM 0 HG3 GLU A 683 55.327 57.614 15.822 1.00 35.07 H new ATOM 3074 N LEU A 684 55.820 54.052 13.408 1.00 29.91 N ATOM 3075 CA LEU A 684 55.946 52.692 13.908 1.00 30.00 C ATOM 3076 C LEU A 684 56.767 51.774 13.006 1.00 29.58 C ATOM 3077 O LEU A 684 57.202 50.712 13.441 1.00 31.36 O ATOM 3078 CB LEU A 684 54.552 52.069 14.107 1.00 29.18 C ATOM 3079 CG LEU A 684 53.601 52.850 15.034 1.00 30.38 C ATOM 3080 CD1 LEU A 684 52.242 52.186 15.085 1.00 31.32 C ATOM 3081 CD2 LEU A 684 54.196 52.961 16.429 1.00 30.64 C ATOM 0 H LEU A 684 55.071 54.213 13.017 1.00 29.91 H new ATOM 0 HA LEU A 684 56.421 52.766 14.750 1.00 30.00 H new ATOM 0 HB2 LEU A 684 54.129 51.978 13.239 1.00 29.18 H new ATOM 0 HB3 LEU A 684 54.663 51.174 14.464 1.00 29.18 H new ATOM 0 HG LEU A 684 53.488 53.744 14.676 1.00 30.38 H new ATOM 0 HD11 LEU A 684 51.657 52.690 15.672 1.00 31.32 H new ATOM 0 HD12 LEU A 684 51.861 52.160 14.194 1.00 31.32 H new ATOM 0 HD13 LEU A 684 52.336 51.281 15.422 1.00 31.32 H new ATOM 0 HD21 LEU A 684 53.588 53.454 17.002 1.00 30.64 H new ATOM 0 HD22 LEU A 684 54.334 52.073 16.794 1.00 30.64 H new ATOM 0 HD23 LEU A 684 55.046 53.427 16.383 1.00 30.64 H new ATOM 3082 N LEU A 685 56.905 52.128 11.736 1.00 32.54 N ATOM 3083 CA LEU A 685 57.647 51.295 10.797 1.00 34.23 C ATOM 3084 C LEU A 685 59.106 51.543 11.007 1.00 37.02 C ATOM 3085 O LEU A 685 59.492 52.706 11.092 1.00 37.62 O ATOM 3086 CB LEU A 685 57.337 51.672 9.372 1.00 34.77 C ATOM 3087 CG LEU A 685 55.976 51.222 8.877 1.00 35.88 C ATOM 3088 CD1 LEU A 685 55.657 52.009 7.623 1.00 38.78 C ATOM 3089 CD2 LEU A 685 55.970 49.722 8.594 1.00 36.56 C ATOM 0 H LEU A 685 56.577 52.847 11.396 1.00 32.54 H new ATOM 0 HA LEU A 685 57.402 50.369 10.949 1.00 34.23 H new ATOM 0 HB2 LEU A 685 57.396 52.636 9.286 1.00 34.77 H new ATOM 0 HB3 LEU A 685 58.019 51.293 8.795 1.00 34.77 H new ATOM 0 HG LEU A 685 55.302 51.386 9.555 1.00 35.88 H new ATOM 0 HD11 LEU A 685 54.789 51.740 7.284 1.00 38.78 H new ATOM 0 HD12 LEU A 685 55.643 52.957 7.830 1.00 38.78 H new ATOM 0 HD13 LEU A 685 56.334 51.835 6.951 1.00 38.78 H new ATOM 0 HD21 LEU A 685 55.092 49.455 8.279 1.00 36.56 H new ATOM 0 HD22 LEU A 685 56.632 49.518 7.915 1.00 36.56 H new ATOM 0 HD23 LEU A 685 56.182 49.238 9.408 1.00 36.56 H new ATOM 3090 N PRO A 686 59.932 50.474 11.031 1.00 38.34 N ATOM 3091 CA PRO A 686 61.381 50.697 10.949 1.00 39.67 C ATOM 3092 C PRO A 686 61.720 51.522 9.723 1.00 37.51 C ATOM 3093 O PRO A 686 60.989 51.479 8.729 1.00 36.81 O ATOM 3094 CB PRO A 686 61.964 49.280 10.807 1.00 40.92 C ATOM 3095 CG PRO A 686 60.889 48.363 11.249 1.00 43.47 C ATOM 3096 CD PRO A 686 59.593 49.049 10.904 1.00 40.87 C ATOM 0 HA PRO A 686 61.730 51.177 11.716 1.00 39.67 H new ATOM 0 HB2 PRO A 686 62.222 49.099 9.890 1.00 40.92 H new ATOM 0 HB3 PRO A 686 62.760 49.174 11.352 1.00 40.92 H new ATOM 0 HG2 PRO A 686 60.958 47.505 10.801 1.00 43.47 H new ATOM 0 HG3 PRO A 686 60.948 48.191 12.202 1.00 43.47 H new ATOM 0 HD2 PRO A 686 59.297 48.828 10.007 1.00 40.87 H new ATOM 0 HD3 PRO A 686 58.879 48.794 11.509 1.00 40.87 H new ATOM 3097 N ASP A 687 62.809 52.268 9.790 1.00 42.41 N ATOM 3098 CA ASP A 687 63.222 53.140 8.691 1.00 46.94 C ATOM 3099 C ASP A 687 63.297 52.462 7.337 1.00 50.51 C ATOM 3100 O ASP A 687 62.788 53.000 6.329 1.00 49.38 O ATOM 3101 CB ASP A 687 64.559 53.788 9.018 1.00 51.30 C ATOM 3102 CG ASP A 687 64.417 54.966 9.979 1.00 57.15 C ATOM 3103 OD1 ASP A 687 63.276 55.295 10.384 1.00 59.15 O ATOM 3104 OD2 ASP A 687 65.450 55.584 10.316 1.00 65.67 O ATOM 0 H ASP A 687 63.333 52.287 10.471 1.00 42.41 H new ATOM 0 HA ASP A 687 62.523 53.808 8.612 1.00 46.94 H new ATOM 0 HB2 ASP A 687 65.150 53.125 9.408 1.00 51.30 H new ATOM 0 HB3 ASP A 687 64.977 54.092 8.197 1.00 51.30 H new ATOM 3105 N ASP A 688 63.873 51.259 7.322 1.00 48.22 N ATOM 3106 CA ASP A 688 64.072 50.546 6.071 1.00 51.87 C ATOM 3107 C ASP A 688 62.759 50.087 5.472 1.00 50.11 C ATOM 3108 O ASP A 688 62.735 49.731 4.314 1.00 52.99 O ATOM 3109 CB ASP A 688 65.142 49.413 6.176 1.00 57.48 C ATOM 3110 CG ASP A 688 64.707 48.205 7.030 1.00 63.45 C ATOM 3111 OD1 ASP A 688 63.639 48.218 7.682 1.00 67.45 O ATOM 3112 OD2 ASP A 688 65.473 47.216 7.048 1.00 75.11 O ATOM 0 H ASP A 688 64.152 50.845 8.022 1.00 48.22 H new ATOM 0 HA ASP A 688 64.449 51.181 5.442 1.00 51.87 H new ATOM 0 HB2 ASP A 688 65.358 49.103 5.283 1.00 57.48 H new ATOM 0 HB3 ASP A 688 65.955 49.785 6.551 1.00 57.48 H new ATOM 3113 N GLU A 689 61.667 50.090 6.244 1.00 45.16 N ATOM 3114 CA GLU A 689 60.354 49.831 5.671 1.00 43.00 C ATOM 3115 C GLU A 689 59.576 51.107 5.256 1.00 39.83 C ATOM 3116 O GLU A 689 58.434 51.012 4.847 1.00 39.60 O ATOM 3117 CB GLU A 689 59.533 48.947 6.622 1.00 49.13 C ATOM 3118 CG GLU A 689 60.110 47.542 6.780 1.00 51.32 C ATOM 3119 CD GLU A 689 59.390 46.719 7.836 1.00 54.41 C ATOM 3120 OE1 GLU A 689 58.144 46.692 7.848 1.00 53.85 O ATOM 3121 OE2 GLU A 689 60.071 46.080 8.658 1.00 62.21 O ATOM 0 H GLU A 689 61.670 50.239 7.091 1.00 45.16 H new ATOM 0 HA GLU A 689 60.504 49.356 4.839 1.00 43.00 H new ATOM 0 HB2 GLU A 689 59.488 49.372 7.493 1.00 49.13 H new ATOM 0 HB3 GLU A 689 58.624 48.882 6.291 1.00 49.13 H new ATOM 0 HG2 GLU A 689 60.061 47.080 5.928 1.00 51.32 H new ATOM 0 HG3 GLU A 689 61.049 47.608 7.013 1.00 51.32 H new ATOM 3122 N ARG A 690 60.181 52.285 5.321 1.00 37.45 N ATOM 3123 CA ARG A 690 59.469 53.484 4.884 1.00 40.28 C ATOM 3124 C ARG A 690 60.297 54.499 4.101 1.00 36.80 C ATOM 3125 O ARG A 690 60.027 55.697 4.137 1.00 36.79 O ATOM 3126 CB ARG A 690 58.712 54.133 6.065 1.00 41.41 C ATOM 3127 CG ARG A 690 59.488 54.300 7.351 1.00 39.88 C ATOM 3128 CD ARG A 690 58.906 55.466 8.119 1.00 41.18 C ATOM 3129 NE ARG A 690 59.414 55.573 9.472 1.00 36.41 N ATOM 3130 CZ ARG A 690 59.463 56.702 10.182 1.00 34.38 C ATOM 3131 NH1 ARG A 690 59.046 57.882 9.699 1.00 34.77 N ATOM 3132 NH2 ARG A 690 59.957 56.652 11.418 1.00 35.09 N ATOM 0 H ARG A 690 60.982 52.414 5.606 1.00 37.45 H new ATOM 0 HA ARG A 690 58.826 53.169 4.229 1.00 40.28 H new ATOM 0 HB2 ARG A 690 58.400 55.007 5.783 1.00 41.41 H new ATOM 0 HB3 ARG A 690 57.925 53.598 6.252 1.00 41.41 H new ATOM 0 HG2 ARG A 690 59.439 53.489 7.881 1.00 39.88 H new ATOM 0 HG3 ARG A 690 60.426 54.457 7.160 1.00 39.88 H new ATOM 0 HD2 ARG A 690 59.099 56.288 7.642 1.00 41.18 H new ATOM 0 HD3 ARG A 690 57.941 55.376 8.149 1.00 41.18 H new ATOM 0 HE ARG A 690 59.706 54.855 9.845 1.00 36.41 H new ATOM 0 HH11 ARG A 690 58.731 57.933 8.900 1.00 34.77 H new ATOM 0 HH12 ARG A 690 59.094 58.588 10.188 1.00 34.77 H new ATOM 0 HH21 ARG A 690 60.235 55.905 11.740 1.00 35.09 H new ATOM 0 HH22 ARG A 690 59.998 57.367 11.894 1.00 35.09 H new ATOM 3133 N GLN A 691 61.250 54.001 3.326 1.00 34.16 N ATOM 3134 CA GLN A 691 62.004 54.831 2.402 1.00 37.11 C ATOM 3135 C GLN A 691 61.377 54.803 1.019 1.00 34.18 C ATOM 3136 O GLN A 691 60.990 53.752 0.554 1.00 36.27 O ATOM 3137 CB GLN A 691 63.452 54.329 2.324 1.00 41.58 C ATOM 3138 CG GLN A 691 64.195 54.607 3.629 1.00 47.64 C ATOM 3139 CD GLN A 691 65.288 53.601 3.951 1.00 54.46 C ATOM 3140 OE1 GLN A 691 65.391 52.526 3.342 1.00 60.90 O ATOM 3141 NE2 GLN A 691 66.117 53.953 4.920 1.00 57.99 N ATOM 0 H GLN A 691 61.477 53.172 3.321 1.00 34.16 H new ATOM 0 HA GLN A 691 61.992 55.745 2.727 1.00 37.11 H new ATOM 0 HB2 GLN A 691 63.459 53.377 2.140 1.00 41.58 H new ATOM 0 HB3 GLN A 691 63.910 54.764 1.588 1.00 41.58 H new ATOM 0 HG2 GLN A 691 64.588 55.493 3.583 1.00 47.64 H new ATOM 0 HG3 GLN A 691 63.555 54.618 4.358 1.00 47.64 H new ATOM 0 HE21 GLN A 691 66.015 54.707 5.321 1.00 57.99 H new ATOM 0 HE22 GLN A 691 66.758 53.428 5.149 1.00 57.99 H new ATOM 3142 N CYS A 692 61.303 55.946 0.360 1.00 33.73 N ATOM 3143 CA CYS A 692 60.866 55.992 -1.031 1.00 35.49 C ATOM 3144 C CYS A 692 61.779 55.116 -1.908 1.00 37.97 C ATOM 3145 O CYS A 692 63.002 55.241 -1.861 1.00 37.66 O ATOM 3146 CB CYS A 692 60.839 57.430 -1.528 1.00 33.94 C ATOM 3147 SG CYS A 692 60.410 57.694 -3.278 1.00 32.38 S ATOM 0 H CYS A 692 61.501 56.711 0.698 1.00 33.73 H new ATOM 0 HA CYS A 692 59.965 55.637 -1.090 1.00 35.49 H new ATOM 0 HB2 CYS A 692 60.206 57.925 -0.985 1.00 33.94 H new ATOM 0 HB3 CYS A 692 61.713 57.820 -1.370 1.00 33.94 H new ATOM 3148 N VAL A 693 61.166 54.232 -2.691 1.00 37.28 N ATOM 3149 CA VAL A 693 61.858 53.328 -3.624 1.00 40.59 C ATOM 3150 C VAL A 693 62.791 54.122 -4.539 1.00 40.26 C ATOM 3151 O VAL A 693 63.900 53.686 -4.839 1.00 40.30 O ATOM 3152 CB VAL A 693 60.846 52.522 -4.499 1.00 47.50 C ATOM 3153 CG1 VAL A 693 61.551 51.760 -5.622 1.00 51.17 C ATOM 3154 CG2 VAL A 693 60.036 51.544 -3.654 1.00 48.36 C ATOM 0 H VAL A 693 60.312 54.135 -2.698 1.00 37.28 H new ATOM 0 HA VAL A 693 62.373 52.702 -3.092 1.00 40.59 H new ATOM 0 HB VAL A 693 60.244 53.171 -4.895 1.00 47.50 H new ATOM 0 HG11 VAL A 693 60.895 51.272 -6.144 1.00 51.17 H new ATOM 0 HG12 VAL A 693 62.018 52.388 -6.196 1.00 51.17 H new ATOM 0 HG13 VAL A 693 62.188 51.136 -5.240 1.00 51.17 H new ATOM 0 HG21 VAL A 693 59.418 51.059 -4.223 1.00 48.36 H new ATOM 0 HG22 VAL A 693 60.636 50.917 -3.221 1.00 48.36 H new ATOM 0 HG23 VAL A 693 59.539 52.033 -2.980 1.00 48.36 H new ATOM 3155 N LYS A 694 62.326 55.288 -4.960 1.00 39.44 N ATOM 3156 CA LYS A 694 63.045 56.142 -5.864 1.00 40.98 C ATOM 3157 C LYS A 694 64.131 56.972 -5.170 1.00 43.23 C ATOM 3158 O LYS A 694 65.305 56.800 -5.476 1.00 41.55 O ATOM 3159 CB LYS A 694 62.066 57.074 -6.571 1.00 40.46 C ATOM 3160 CG LYS A 694 62.679 57.989 -7.615 1.00 45.31 C ATOM 3161 CD LYS A 694 63.516 57.202 -8.616 1.00 48.80 C ATOM 3162 CE LYS A 694 63.757 57.996 -9.889 1.00 54.25 C ATOM 3163 NZ LYS A 694 64.107 57.059 -10.998 1.00 61.21 N ATOM 0 H LYS A 694 61.564 55.605 -4.718 1.00 39.44 H new ATOM 0 HA LYS A 694 63.493 55.566 -6.503 1.00 40.98 H new ATOM 0 HB2 LYS A 694 61.380 56.536 -6.997 1.00 40.46 H new ATOM 0 HB3 LYS A 694 61.623 57.621 -5.903 1.00 40.46 H new ATOM 0 HG2 LYS A 694 61.976 58.467 -8.082 1.00 45.31 H new ATOM 0 HG3 LYS A 694 63.233 58.655 -7.179 1.00 45.31 H new ATOM 0 HD2 LYS A 694 64.367 56.967 -8.214 1.00 48.80 H new ATOM 0 HD3 LYS A 694 63.066 56.371 -8.833 1.00 48.80 H new ATOM 0 HE2 LYS A 694 62.964 58.505 -10.120 1.00 54.25 H new ATOM 0 HE3 LYS A 694 64.474 58.635 -9.753 1.00 54.25 H new ATOM 0 HZ1 LYS A 694 64.249 57.522 -11.745 1.00 61.21 H new ATOM 0 HZ2 LYS A 694 64.844 56.608 -10.785 1.00 61.21 H new ATOM 0 HZ3 LYS A 694 63.437 56.487 -11.127 1.00 61.21 H new ATOM 3164 N CYS A 695 63.737 57.881 -4.264 1.00 40.82 N ATOM 3165 CA CYS A 695 64.657 58.901 -3.739 1.00 37.15 C ATOM 3166 C CYS A 695 65.230 58.617 -2.344 1.00 35.77 C ATOM 3167 O CYS A 695 66.004 59.427 -1.808 1.00 38.84 O ATOM 3168 CB CYS A 695 63.969 60.245 -3.765 1.00 35.48 C ATOM 3169 SG CYS A 695 62.797 60.414 -2.403 1.00 35.91 S ATOM 0 H CYS A 695 62.941 57.922 -3.942 1.00 40.82 H new ATOM 0 HA CYS A 695 65.431 58.889 -4.324 1.00 37.15 H new ATOM 0 HB2 CYS A 695 64.633 60.951 -3.712 1.00 35.48 H new ATOM 0 HB3 CYS A 695 63.504 60.356 -4.609 1.00 35.48 H new ATOM 3170 N LYS A 696 64.830 57.493 -1.762 1.00 33.75 N ATOM 3171 CA LYS A 696 65.262 57.044 -0.448 1.00 35.86 C ATOM 3172 C LYS A 696 64.840 57.897 0.765 1.00 33.63 C ATOM 3173 O LYS A 696 65.257 57.597 1.868 1.00 35.41 O ATOM 3174 CB LYS A 696 66.794 56.844 -0.427 1.00 42.74 C ATOM 3175 CG LYS A 696 67.378 56.162 -1.655 1.00 45.62 C ATOM 3176 CD LYS A 696 66.766 54.791 -1.854 1.00 48.99 C ATOM 3177 CE LYS A 696 67.064 54.237 -3.241 1.00 55.69 C ATOM 3178 NZ LYS A 696 66.542 52.845 -3.327 1.00 60.75 N ATOM 0 H LYS A 696 64.278 56.951 -2.137 1.00 33.75 H new ATOM 0 HA LYS A 696 64.782 56.209 -0.330 1.00 35.86 H new ATOM 0 HB2 LYS A 696 67.217 57.711 -0.325 1.00 42.74 H new ATOM 0 HB3 LYS A 696 67.026 56.321 0.356 1.00 42.74 H new ATOM 0 HG2 LYS A 696 67.218 56.709 -2.440 1.00 45.62 H new ATOM 0 HG3 LYS A 696 68.340 56.080 -1.558 1.00 45.62 H new ATOM 0 HD2 LYS A 696 67.110 54.182 -1.181 1.00 48.99 H new ATOM 0 HD3 LYS A 696 65.806 54.843 -1.725 1.00 48.99 H new ATOM 0 HE2 LYS A 696 66.651 54.793 -3.920 1.00 55.69 H new ATOM 0 HE3 LYS A 696 68.019 54.248 -3.408 1.00 55.69 H new ATOM 0 HZ1 LYS A 696 67.100 52.348 -3.810 1.00 60.75 H new ATOM 0 HZ2 LYS A 696 66.473 52.502 -2.508 1.00 60.75 H new ATOM 0 HZ3 LYS A 696 65.741 52.852 -3.714 1.00 60.75 H new ATOM 3179 N THR A 697 64.016 58.919 0.586 1.00 32.14 N ATOM 3180 CA THR A 697 63.613 59.791 1.692 1.00 31.52 C ATOM 3181 C THR A 697 62.815 58.925 2.685 1.00 33.50 C ATOM 3182 O THR A 697 62.114 57.974 2.293 1.00 30.38 O ATOM 3183 CB THR A 697 62.825 61.015 1.161 1.00 33.56 C ATOM 3184 OG1 THR A 697 62.831 62.081 2.117 1.00 33.31 O ATOM 3185 CG2 THR A 697 61.325 60.642 0.806 1.00 33.57 C ATOM 0 H THR A 697 63.673 59.130 -0.174 1.00 32.14 H new ATOM 0 HA THR A 697 64.379 60.166 2.154 1.00 31.52 H new ATOM 0 HB THR A 697 63.272 61.304 0.350 1.00 33.56 H new ATOM 0 HG1 THR A 697 63.504 62.568 1.990 1.00 33.31 H new ATOM 0 HG21 THR A 697 60.864 61.430 0.478 1.00 33.57 H new ATOM 0 HG22 THR A 697 61.316 59.954 0.122 1.00 33.57 H new ATOM 0 HG23 THR A 697 60.876 60.313 1.601 1.00 33.57 H new ATOM 3186 N THR A 698 62.967 59.219 3.967 1.00 32.00 N ATOM 3187 CA THR A 698 62.218 58.536 4.992 1.00 33.78 C ATOM 3188 C THR A 698 60.822 59.173 5.023 1.00 30.99 C ATOM 3189 O THR A 698 60.696 60.368 5.285 1.00 30.98 O ATOM 3190 CB THR A 698 62.918 58.646 6.362 1.00 35.61 C ATOM 3191 OG1 THR A 698 64.152 57.945 6.297 1.00 39.64 O ATOM 3192 CG2 THR A 698 62.082 57.998 7.465 1.00 38.08 C ATOM 0 H THR A 698 63.507 59.820 4.262 1.00 32.00 H new ATOM 0 HA THR A 698 62.155 57.588 4.797 1.00 33.78 H new ATOM 0 HB THR A 698 63.044 59.586 6.564 1.00 35.61 H new ATOM 0 HG1 THR A 698 64.605 58.111 6.985 1.00 39.64 H new ATOM 0 HG21 THR A 698 62.545 58.081 8.313 1.00 38.08 H new ATOM 0 HG22 THR A 698 61.221 58.441 7.522 1.00 38.08 H new ATOM 0 HG23 THR A 698 61.949 57.059 7.261 1.00 38.08 H new ATOM 3193 N CYS A 699 59.792 58.377 4.726 1.00 29.49 N ATOM 3194 CA CYS A 699 58.399 58.885 4.672 1.00 28.21 C ATOM 3195 C CYS A 699 57.788 59.087 6.063 1.00 28.10 C ATOM 3196 O CYS A 699 58.104 58.364 6.999 1.00 27.65 O ATOM 3197 CB CYS A 699 57.555 57.931 3.872 1.00 30.41 C ATOM 3198 SG CYS A 699 57.990 57.881 2.106 1.00 36.12 S ATOM 0 H CYS A 699 59.870 57.539 4.551 1.00 29.49 H new ATOM 0 HA CYS A 699 58.421 59.757 4.247 1.00 28.21 H new ATOM 0 HB2 CYS A 699 57.645 57.040 4.245 1.00 30.41 H new ATOM 0 HB3 CYS A 699 56.623 58.183 3.961 1.00 30.41 H new ATOM 0 HG CYS A 699 57.277 57.099 1.540 1.00 36.12 H new ATOM 3199 N PHE A 700 56.939 60.098 6.198 1.00 26.45 N ATOM 3200 CA PHE A 700 56.206 60.328 7.420 1.00 27.89 C ATOM 3201 C PHE A 700 54.850 60.965 7.188 1.00 29.30 C ATOM 3202 O PHE A 700 53.850 60.462 7.695 1.00 29.21 O ATOM 3203 CB PHE A 700 56.971 61.208 8.407 1.00 29.04 C ATOM 3204 CG PHE A 700 56.200 61.454 9.662 1.00 28.82 C ATOM 3205 CD1 PHE A 700 56.047 60.444 10.588 1.00 28.21 C ATOM 3206 CD2 PHE A 700 55.557 62.667 9.880 1.00 28.52 C ATOM 3207 CE1 PHE A 700 55.284 60.633 11.725 1.00 29.80 C ATOM 3208 CE2 PHE A 700 54.798 62.863 11.018 1.00 29.14 C ATOM 3209 CZ PHE A 700 54.660 61.847 11.944 1.00 29.29 C ATOM 0 H PHE A 700 56.775 60.669 5.577 1.00 26.45 H new ATOM 0 HA PHE A 700 56.085 59.441 7.795 1.00 27.89 H new ATOM 0 HB2 PHE A 700 57.816 60.785 8.627 1.00 29.04 H new ATOM 0 HB3 PHE A 700 57.179 62.057 7.986 1.00 29.04 H new ATOM 0 HD1 PHE A 700 56.463 59.624 10.446 1.00 28.21 H new ATOM 0 HD2 PHE A 700 55.638 63.351 9.256 1.00 28.52 H new ATOM 0 HE1 PHE A 700 55.190 59.944 12.342 1.00 29.80 H new ATOM 0 HE2 PHE A 700 54.379 63.681 11.161 1.00 29.14 H new ATOM 0 HZ PHE A 700 54.150 61.979 12.710 1.00 29.29 H new ATOM 3210 N MET A 701 54.823 62.099 6.503 1.00 28.66 N ATOM 3211 CA MET A 701 53.568 62.777 6.231 1.00 31.89 C ATOM 3212 C MET A 701 52.646 61.948 5.328 1.00 32.01 C ATOM 3213 O MET A 701 51.448 61.802 5.635 1.00 28.46 O ATOM 3214 CB MET A 701 53.818 64.158 5.638 1.00 32.73 C ATOM 3215 CG MET A 701 54.336 65.129 6.662 1.00 35.98 C ATOM 3216 SD MET A 701 53.111 65.646 7.904 1.00 40.54 S ATOM 3217 CE MET A 701 52.363 66.851 6.870 1.00 38.60 C ATOM 0 H MET A 701 55.520 62.492 6.187 1.00 28.66 H new ATOM 0 HA MET A 701 53.110 62.885 7.079 1.00 31.89 H new ATOM 0 HB2 MET A 701 54.456 64.086 4.911 1.00 32.73 H new ATOM 0 HB3 MET A 701 52.993 64.500 5.258 1.00 32.73 H new ATOM 0 HG2 MET A 701 55.092 64.727 7.118 1.00 35.98 H new ATOM 0 HG3 MET A 701 54.667 65.917 6.204 1.00 35.98 H new ATOM 0 HE1 MET A 701 52.492 67.732 7.254 1.00 38.60 H new ATOM 0 HE2 MET A 701 52.769 66.819 5.990 1.00 38.60 H new ATOM 0 HE3 MET A 701 51.413 66.668 6.794 1.00 38.60 H new ATOM 3218 N SER A 702 53.219 61.364 4.277 1.00 28.98 N ATOM 3219 CA SER A 702 52.476 60.622 3.281 1.00 32.42 C ATOM 3220 C SER A 702 53.345 59.790 2.365 1.00 30.02 C ATOM 3221 O SER A 702 54.548 59.989 2.252 1.00 32.69 O ATOM 3222 CB SER A 702 51.606 61.558 2.439 1.00 33.13 C ATOM 3223 OG SER A 702 52.362 62.630 1.919 1.00 35.37 O ATOM 0 H SER A 702 54.065 61.392 4.126 1.00 28.98 H new ATOM 0 HA SER A 702 51.919 60.006 3.783 1.00 32.42 H new ATOM 0 HB2 SER A 702 51.203 61.060 1.711 1.00 33.13 H new ATOM 0 HB3 SER A 702 50.880 61.904 2.982 1.00 33.13 H new ATOM 0 HG SER A 702 52.234 63.316 2.387 1.00 35.37 H new ATOM 3224 N ALA A 703 52.706 58.816 1.752 1.00 29.11 N ATOM 3225 CA ALA A 703 53.318 57.938 0.757 1.00 29.43 C ATOM 3226 C ALA A 703 52.210 57.274 -0.080 1.00 29.46 C ATOM 3227 O ALA A 703 51.048 57.308 0.286 1.00 32.13 O ATOM 3228 CB ALA A 703 54.144 56.861 1.444 1.00 29.55 C ATOM 0 H ALA A 703 51.879 58.635 1.902 1.00 29.11 H new ATOM 0 HA ALA A 703 53.898 58.463 0.183 1.00 29.43 H new ATOM 0 HB1 ALA A 703 54.545 56.285 0.775 1.00 29.55 H new ATOM 0 HB2 ALA A 703 54.843 57.277 1.973 1.00 29.55 H new ATOM 0 HB3 ALA A 703 53.571 56.334 2.023 1.00 29.55 H new ATOM 3229 N ILE A 704 52.600 56.662 -1.182 1.00 29.34 N ATOM 3230 CA ILE A 704 51.725 55.912 -2.027 1.00 31.26 C ATOM 3231 C ILE A 704 52.159 54.468 -1.979 1.00 32.48 C ATOM 3232 O ILE A 704 53.364 54.164 -2.095 1.00 29.69 O ATOM 3233 CB ILE A 704 51.816 56.411 -3.474 1.00 34.00 C ATOM 3234 CG1 ILE A 704 51.487 57.911 -3.570 1.00 39.75 C ATOM 3235 CG2 ILE A 704 50.935 55.587 -4.383 1.00 37.90 C ATOM 3236 CD1 ILE A 704 50.099 58.318 -3.142 1.00 41.69 C ATOM 0 H ILE A 704 53.413 56.678 -1.461 1.00 29.34 H new ATOM 0 HA ILE A 704 50.810 56.014 -1.721 1.00 31.26 H new ATOM 0 HB ILE A 704 52.732 56.300 -3.773 1.00 34.00 H new ATOM 0 HG12 ILE A 704 52.128 58.399 -3.029 1.00 39.75 H new ATOM 0 HG13 ILE A 704 51.618 58.193 -4.489 1.00 39.75 H new ATOM 0 HG21 ILE A 704 51.007 55.919 -5.292 1.00 37.90 H new ATOM 0 HG22 ILE A 704 51.218 54.660 -4.354 1.00 37.90 H new ATOM 0 HG23 ILE A 704 50.013 55.653 -4.088 1.00 37.90 H new ATOM 0 HD11 ILE A 704 49.998 59.278 -3.242 1.00 41.69 H new ATOM 0 HD12 ILE A 704 49.444 57.865 -3.695 1.00 41.69 H new ATOM 0 HD13 ILE A 704 49.962 58.074 -2.213 1.00 41.69 H new ATOM 3237 N SER A 705 51.178 53.583 -1.849 1.00 31.56 N ATOM 3238 CA SER A 705 51.370 52.153 -1.963 1.00 33.21 C ATOM 3239 C SER A 705 50.467 51.556 -3.044 1.00 37.25 C ATOM 3240 O SER A 705 49.466 52.154 -3.461 1.00 33.38 O ATOM 3241 CB SER A 705 51.067 51.446 -0.629 1.00 34.79 C ATOM 3242 OG SER A 705 49.785 51.756 -0.149 1.00 35.86 O ATOM 0 H SER A 705 50.364 53.808 -1.688 1.00 31.56 H new ATOM 0 HA SER A 705 52.299 52.013 -2.204 1.00 33.21 H new ATOM 0 HB2 SER A 705 51.144 50.486 -0.748 1.00 34.79 H new ATOM 0 HB3 SER A 705 51.730 51.704 0.031 1.00 34.79 H new ATOM 0 HG SER A 705 49.241 51.169 -0.403 1.00 35.86 H new ATOM 3243 N CYS A 706 50.842 50.361 -3.488 1.00 38.07 N ATOM 3244 CA CYS A 706 50.014 49.557 -4.366 1.00 38.73 C ATOM 3245 C CYS A 706 50.108 48.146 -3.849 1.00 41.25 C ATOM 3246 O CYS A 706 51.212 47.658 -3.601 1.00 36.22 O ATOM 3247 CB CYS A 706 50.522 49.590 -5.803 1.00 40.48 C ATOM 3248 SG CYS A 706 49.422 48.767 -7.004 1.00 41.31 S ATOM 0 H CYS A 706 51.592 49.994 -3.284 1.00 38.07 H new ATOM 0 HA CYS A 706 49.105 49.896 -4.372 1.00 38.73 H new ATOM 0 HB2 CYS A 706 50.643 50.514 -6.071 1.00 40.48 H new ATOM 0 HB3 CYS A 706 51.395 49.168 -5.837 1.00 40.48 H new ATOM 3249 N SER A 707 48.963 47.475 -3.744 1.00 42.34 N ATOM 3250 CA SER A 707 48.920 46.071 -3.323 1.00 46.85 C ATOM 3251 C SER A 707 49.715 45.120 -4.238 1.00 45.00 C ATOM 3252 O SER A 707 50.066 44.039 -3.800 1.00 53.61 O ATOM 3253 CB SER A 707 47.470 45.589 -3.194 1.00 48.07 C ATOM 3254 OG SER A 707 46.832 45.637 -4.453 1.00 53.68 O ATOM 0 H SER A 707 48.192 47.816 -3.913 1.00 42.34 H new ATOM 0 HA SER A 707 49.355 46.043 -2.457 1.00 46.85 H new ATOM 0 HB2 SER A 707 47.452 44.683 -2.848 1.00 48.07 H new ATOM 0 HB3 SER A 707 46.992 46.145 -2.559 1.00 48.07 H new ATOM 0 HG SER A 707 46.039 45.371 -4.376 1.00 53.68 H new ATOM 3255 N CYS A 708 50.017 45.512 -5.474 1.00 43.99 N ATOM 3256 CA CYS A 708 50.895 44.693 -6.328 1.00 47.45 C ATOM 3257 C CYS A 708 52.344 44.584 -5.825 1.00 52.04 C ATOM 3258 O CYS A 708 53.035 43.642 -6.195 1.00 52.37 O ATOM 3259 CB CYS A 708 50.904 45.180 -7.779 1.00 49.08 C ATOM 3260 SG CYS A 708 52.209 46.359 -8.200 1.00 51.63 S ATOM 0 H CYS A 708 49.732 46.237 -5.838 1.00 43.99 H new ATOM 0 HA CYS A 708 50.506 43.806 -6.282 1.00 47.45 H new ATOM 0 HB2 CYS A 708 50.987 44.409 -8.362 1.00 49.08 H new ATOM 0 HB3 CYS A 708 50.046 45.590 -7.971 1.00 49.08 H new ATOM 3261 N LYS A 709 52.807 45.543 -5.016 1.00 51.01 N ATOM 3262 CA LYS A 709 54.161 45.514 -4.444 1.00 48.56 C ATOM 3263 C LYS A 709 54.109 45.718 -2.934 1.00 48.30 C ATOM 3264 O LYS A 709 54.421 46.811 -2.438 1.00 42.77 O ATOM 3265 CB LYS A 709 55.020 46.581 -5.101 1.00 51.04 C ATOM 3266 CG LYS A 709 55.132 46.387 -6.594 1.00 52.45 C ATOM 3267 CD LYS A 709 56.463 46.803 -7.168 1.00 56.18 C ATOM 3268 CE LYS A 709 56.543 46.403 -8.636 1.00 60.66 C ATOM 3269 NZ LYS A 709 57.089 47.485 -9.499 1.00 63.92 N ATOM 0 H LYS A 709 52.345 46.230 -4.783 1.00 51.01 H new ATOM 0 HA LYS A 709 54.557 44.645 -4.615 1.00 48.56 H new ATOM 0 HB2 LYS A 709 54.642 47.455 -4.918 1.00 51.04 H new ATOM 0 HB3 LYS A 709 55.907 46.567 -4.708 1.00 51.04 H new ATOM 0 HG2 LYS A 709 54.978 45.452 -6.802 1.00 52.45 H new ATOM 0 HG3 LYS A 709 54.429 46.894 -7.030 1.00 52.45 H new ATOM 0 HD2 LYS A 709 56.577 47.762 -7.079 1.00 56.18 H new ATOM 0 HD3 LYS A 709 57.183 46.385 -6.671 1.00 56.18 H new ATOM 0 HE2 LYS A 709 57.101 45.614 -8.722 1.00 60.66 H new ATOM 0 HE3 LYS A 709 55.658 46.160 -8.950 1.00 60.66 H new ATOM 0 HZ1 LYS A 709 56.844 47.344 -10.343 1.00 63.92 H new ATOM 0 HZ2 LYS A 709 56.773 48.271 -9.226 1.00 63.92 H new ATOM 0 HZ3 LYS A 709 57.977 47.488 -9.445 1.00 63.92 H new ATOM 3270 N PRO A 710 53.708 44.667 -2.191 1.00 49.10 N ATOM 3271 CA PRO A 710 53.481 44.805 -0.757 1.00 50.38 C ATOM 3272 C PRO A 710 54.714 45.318 -0.042 1.00 47.59 C ATOM 3273 O PRO A 710 55.830 44.900 -0.348 1.00 48.28 O ATOM 3274 CB PRO A 710 53.160 43.374 -0.298 1.00 54.40 C ATOM 3275 CG PRO A 710 52.742 42.650 -1.525 1.00 54.33 C ATOM 3276 CD PRO A 710 53.539 43.270 -2.634 1.00 54.09 C ATOM 0 HA PRO A 710 52.776 45.442 -0.560 1.00 50.38 H new ATOM 0 HB2 PRO A 710 53.935 42.955 0.108 1.00 54.40 H new ATOM 0 HB3 PRO A 710 52.454 43.370 0.367 1.00 54.40 H new ATOM 0 HG2 PRO A 710 52.924 41.700 -1.451 1.00 54.33 H new ATOM 0 HG3 PRO A 710 51.789 42.745 -1.682 1.00 54.33 H new ATOM 0 HD2 PRO A 710 54.393 42.826 -2.752 1.00 54.09 H new ATOM 0 HD3 PRO A 710 53.072 43.218 -3.483 1.00 54.09 H new ATOM 3277 N GLY A 711 54.511 46.267 0.860 1.00 44.81 N ATOM 3278 CA GLY A 711 55.606 46.808 1.646 1.00 42.69 C ATOM 3279 C GLY A 711 56.371 47.959 1.015 1.00 41.91 C ATOM 3280 O GLY A 711 57.031 48.685 1.739 1.00 44.69 O ATOM 0 H GLY A 711 53.742 46.612 1.032 1.00 44.81 H new ATOM 0 HA2 GLY A 711 55.253 47.106 2.499 1.00 42.69 H new ATOM 0 HA3 GLY A 711 56.232 46.091 1.834 1.00 42.69 H new ATOM 3281 N LEU A 712 56.300 48.145 -0.306 1.00 39.06 N ATOM 3282 CA LEU A 712 57.015 49.247 -0.958 1.00 40.03 C ATOM 3283 C LEU A 712 56.214 50.548 -0.927 1.00 38.74 C ATOM 3284 O LEU A 712 54.999 50.531 -0.927 1.00 39.46 O ATOM 3285 CB LEU A 712 57.384 48.878 -2.393 1.00 42.55 C ATOM 3286 CG LEU A 712 58.237 47.593 -2.522 1.00 49.13 C ATOM 3287 CD1 LEU A 712 58.662 47.382 -3.972 1.00 50.54 C ATOM 3288 CD2 LEU A 712 59.463 47.587 -1.609 1.00 48.66 C ATOM 0 H LEU A 712 55.846 47.647 -0.840 1.00 39.06 H new ATOM 0 HA LEU A 712 57.831 49.397 -0.455 1.00 40.03 H new ATOM 0 HB2 LEU A 712 56.569 48.765 -2.906 1.00 42.55 H new ATOM 0 HB3 LEU A 712 57.870 49.617 -2.791 1.00 42.55 H new ATOM 0 HG LEU A 712 57.672 46.859 -2.234 1.00 49.13 H new ATOM 0 HD11 LEU A 712 59.195 46.574 -4.039 1.00 50.54 H new ATOM 0 HD12 LEU A 712 57.874 47.296 -4.531 1.00 50.54 H new ATOM 0 HD13 LEU A 712 59.187 48.141 -4.269 1.00 50.54 H new ATOM 0 HD21 LEU A 712 59.956 46.761 -1.734 1.00 48.66 H new ATOM 0 HD22 LEU A 712 60.034 48.340 -1.829 1.00 48.66 H new ATOM 0 HD23 LEU A 712 59.178 47.657 -0.684 1.00 48.66 H new ATOM 3289 N LEU A 713 56.923 51.670 -0.919 1.00 36.37 N ATOM 3290 CA LEU A 713 56.334 52.991 -0.840 1.00 35.70 C ATOM 3291 C LEU A 713 57.127 53.914 -1.731 1.00 35.77 C ATOM 3292 O LEU A 713 58.335 53.726 -1.906 1.00 33.29 O ATOM 3293 CB LEU A 713 56.436 53.544 0.578 1.00 35.48 C ATOM 3294 CG LEU A 713 55.751 52.797 1.707 1.00 37.54 C ATOM 3295 CD1 LEU A 713 56.039 53.514 3.025 1.00 38.83 C ATOM 3296 CD2 LEU A 713 54.246 52.678 1.495 1.00 39.06 C ATOM 0 H LEU A 713 57.782 51.680 -0.961 1.00 36.37 H new ATOM 0 HA LEU A 713 55.403 52.933 -1.105 1.00 35.70 H new ATOM 0 HB2 LEU A 713 57.378 53.611 0.800 1.00 35.48 H new ATOM 0 HB3 LEU A 713 56.082 54.447 0.567 1.00 35.48 H new ATOM 0 HG LEU A 713 56.106 51.894 1.728 1.00 37.54 H new ATOM 0 HD11 LEU A 713 55.604 53.042 3.752 1.00 38.83 H new ATOM 0 HD12 LEU A 713 56.996 53.534 3.180 1.00 38.83 H new ATOM 0 HD13 LEU A 713 55.700 54.422 2.981 1.00 38.83 H new ATOM 0 HD21 LEU A 713 53.852 52.195 2.238 1.00 39.06 H new ATOM 0 HD22 LEU A 713 53.855 53.564 1.442 1.00 39.06 H new ATOM 0 HD23 LEU A 713 54.072 52.199 0.670 1.00 39.06 H new ATOM 3297 N VAL A 714 56.446 54.917 -2.266 1.00 31.15 N ATOM 3298 CA VAL A 714 57.105 56.083 -2.845 1.00 33.33 C ATOM 3299 C VAL A 714 56.561 57.289 -2.125 1.00 33.18 C ATOM 3300 O VAL A 714 55.422 57.256 -1.663 1.00 32.32 O ATOM 3301 CB VAL A 714 56.847 56.273 -4.362 1.00 33.79 C ATOM 3302 CG1 VAL A 714 57.621 55.239 -5.147 1.00 36.62 C ATOM 3303 CG2 VAL A 714 55.347 56.231 -4.714 1.00 34.48 C ATOM 0 H VAL A 714 55.587 54.943 -2.305 1.00 31.15 H new ATOM 0 HA VAL A 714 58.062 55.962 -2.744 1.00 33.33 H new ATOM 0 HB VAL A 714 57.160 57.158 -4.607 1.00 33.79 H new ATOM 0 HG11 VAL A 714 57.456 55.362 -6.095 1.00 36.62 H new ATOM 0 HG12 VAL A 714 58.569 55.340 -4.968 1.00 36.62 H new ATOM 0 HG13 VAL A 714 57.335 54.351 -4.882 1.00 36.62 H new ATOM 0 HG21 VAL A 714 55.235 56.354 -5.670 1.00 34.48 H new ATOM 0 HG22 VAL A 714 54.977 55.373 -4.453 1.00 34.48 H new ATOM 0 HG23 VAL A 714 54.883 56.940 -4.241 1.00 34.48 H new ATOM 3304 N CYS A 715 57.352 58.354 -2.067 1.00 30.99 N ATOM 3305 CA CYS A 715 56.886 59.623 -1.543 1.00 31.94 C ATOM 3306 C CYS A 715 56.006 60.260 -2.617 1.00 30.35 C ATOM 3307 O CYS A 715 55.956 59.774 -3.750 1.00 31.01 O ATOM 3308 CB CYS A 715 58.088 60.535 -1.191 1.00 32.17 C ATOM 3309 SG CYS A 715 59.015 61.164 -2.609 1.00 34.70 S ATOM 0 H CYS A 715 58.171 58.358 -2.330 1.00 30.99 H new ATOM 0 HA CYS A 715 56.378 59.496 -0.727 1.00 31.94 H new ATOM 0 HB2 CYS A 715 57.763 61.289 -0.674 1.00 32.17 H new ATOM 0 HB3 CYS A 715 58.695 60.040 -0.619 1.00 32.17 H new ATOM 3310 N LEU A 716 55.355 61.363 -2.292 1.00 29.55 N ATOM 3311 CA LEU A 716 54.447 61.992 -3.243 1.00 34.90 C ATOM 3312 C LEU A 716 55.117 62.669 -4.420 1.00 38.52 C ATOM 3313 O LEU A 716 54.443 62.985 -5.380 1.00 38.45 O ATOM 3314 CB LEU A 716 53.461 62.937 -2.576 1.00 34.67 C ATOM 3315 CG LEU A 716 52.628 62.334 -1.432 1.00 37.79 C ATOM 3316 CD1 LEU A 716 51.409 63.200 -1.139 1.00 36.45 C ATOM 3317 CD2 LEU A 716 52.203 60.915 -1.668 1.00 34.96 C ATOM 0 H LEU A 716 55.421 61.763 -1.534 1.00 29.55 H new ATOM 0 HA LEU A 716 53.956 61.241 -3.613 1.00 34.90 H new ATOM 0 HB2 LEU A 716 53.952 63.699 -2.230 1.00 34.67 H new ATOM 0 HB3 LEU A 716 52.854 63.275 -3.253 1.00 34.67 H new ATOM 0 HG LEU A 716 53.217 62.318 -0.661 1.00 37.79 H new ATOM 0 HD11 LEU A 716 50.897 62.805 -0.416 1.00 36.45 H new ATOM 0 HD12 LEU A 716 51.698 64.089 -0.881 1.00 36.45 H new ATOM 0 HD13 LEU A 716 50.855 63.258 -1.933 1.00 36.45 H new ATOM 0 HD21 LEU A 716 51.685 60.602 -0.910 1.00 34.96 H new ATOM 0 HD22 LEU A 716 51.661 60.869 -2.471 1.00 34.96 H new ATOM 0 HD23 LEU A 716 52.988 60.355 -1.775 1.00 34.96 H new ATOM 3318 N HIS A 717 56.427 62.874 -4.375 1.00 35.25 N ATOM 3319 CA HIS A 717 57.170 63.298 -5.575 1.00 35.88 C ATOM 3320 C HIS A 717 57.378 62.192 -6.591 1.00 35.33 C ATOM 3321 O HIS A 717 57.635 62.482 -7.745 1.00 38.98 O ATOM 3322 CB HIS A 717 58.542 63.873 -5.192 1.00 35.38 C ATOM 3323 CG HIS A 717 58.444 65.124 -4.391 1.00 34.03 C ATOM 3324 ND1 HIS A 717 58.498 65.128 -3.011 1.00 35.63 N ATOM 3325 CD2 HIS A 717 58.257 66.407 -4.767 1.00 34.70 C ATOM 3326 CE1 HIS A 717 58.339 66.364 -2.571 1.00 33.63 C ATOM 3327 NE2 HIS A 717 58.208 67.159 -3.617 1.00 36.24 N ATOM 0 H HIS A 717 56.909 62.776 -3.669 1.00 35.25 H new ATOM 0 HA HIS A 717 56.615 63.976 -5.990 1.00 35.88 H new ATOM 0 HB2 HIS A 717 59.036 63.209 -4.686 1.00 35.38 H new ATOM 0 HB3 HIS A 717 59.050 64.050 -5.999 1.00 35.38 H new ATOM 0 HD2 HIS A 717 58.177 66.722 -5.638 1.00 34.70 H new ATOM 0 HE1 HIS A 717 58.322 66.628 -1.679 1.00 33.63 H new ATOM 0 HE2 HIS A 717 58.108 68.013 -3.584 1.00 36.24 H new ATOM 3328 N HIS A 718 57.299 60.940 -6.169 1.00 35.72 N ATOM 3329 CA HIS A 718 57.629 59.799 -7.030 1.00 37.23 C ATOM 3330 C HIS A 718 56.495 58.800 -7.256 1.00 34.32 C ATOM 3331 O HIS A 718 56.734 57.592 -7.432 1.00 31.49 O ATOM 3332 CB HIS A 718 58.899 59.162 -6.482 1.00 36.84 C ATOM 3333 CG HIS A 718 60.046 60.104 -6.570 1.00 41.48 C ATOM 3334 ND1 HIS A 718 60.648 60.652 -5.462 1.00 43.16 N ATOM 3335 CD2 HIS A 718 60.584 60.732 -7.642 1.00 42.15 C ATOM 3336 CE1 HIS A 718 61.554 61.531 -5.847 1.00 43.07 C ATOM 3337 NE2 HIS A 718 61.536 61.596 -7.165 1.00 44.23 N ATOM 0 H HIS A 718 57.053 60.720 -5.375 1.00 35.72 H new ATOM 0 HA HIS A 718 57.779 60.130 -7.929 1.00 37.23 H new ATOM 0 HB2 HIS A 718 58.761 58.900 -5.558 1.00 36.84 H new ATOM 0 HB3 HIS A 718 59.100 58.354 -6.979 1.00 36.84 H new ATOM 0 HD2 HIS A 718 60.352 60.602 -8.533 1.00 42.15 H new ATOM 0 HE1 HIS A 718 62.110 62.021 -5.285 1.00 43.07 H new ATOM 0 HE2 HIS A 718 62.040 62.099 -7.647 1.00 44.23 H new ATOM 3338 N VAL A 719 55.279 59.340 -7.324 1.00 34.88 N ATOM 3339 CA VAL A 719 54.057 58.543 -7.580 1.00 36.97 C ATOM 3340 C VAL A 719 54.146 57.727 -8.885 1.00 38.48 C ATOM 3341 O VAL A 719 53.685 56.587 -8.935 1.00 38.53 O ATOM 3342 CB VAL A 719 52.808 59.451 -7.591 1.00 39.12 C ATOM 3343 CG1 VAL A 719 51.535 58.640 -7.791 1.00 41.32 C ATOM 3344 CG2 VAL A 719 52.686 60.205 -6.277 1.00 43.20 C ATOM 0 H VAL A 719 55.130 60.181 -7.224 1.00 34.88 H new ATOM 0 HA VAL A 719 53.978 57.906 -6.853 1.00 36.97 H new ATOM 0 HB VAL A 719 52.915 60.073 -8.328 1.00 39.12 H new ATOM 0 HG11 VAL A 719 50.769 59.235 -7.794 1.00 41.32 H new ATOM 0 HG12 VAL A 719 51.581 58.169 -8.638 1.00 41.32 H new ATOM 0 HG13 VAL A 719 51.443 57.998 -7.069 1.00 41.32 H new ATOM 0 HG21 VAL A 719 51.898 60.770 -6.300 1.00 43.20 H new ATOM 0 HG22 VAL A 719 52.608 59.572 -5.546 1.00 43.20 H new ATOM 0 HG23 VAL A 719 53.474 60.755 -6.145 1.00 43.20 H new ATOM 3345 N LYS A 720 54.782 58.286 -9.915 1.00 37.70 N ATOM 3346 CA LYS A 720 54.954 57.590 -11.183 1.00 38.82 C ATOM 3347 C LYS A 720 56.047 56.514 -11.173 1.00 44.26 C ATOM 3348 O LYS A 720 56.270 55.907 -12.210 1.00 44.65 O ATOM 3349 CB LYS A 720 55.223 58.590 -12.312 1.00 42.63 C ATOM 0 H LYS A 720 55.123 59.075 -9.896 1.00 37.70 H new ATOM 0 HA LYS A 720 54.117 57.124 -11.335 1.00 38.82 H new ATOM 3350 N GLU A 721 56.686 56.229 -10.024 1.00 41.51 N ATOM 3351 CA GLU A 721 57.838 55.313 -9.956 1.00 41.77 C ATOM 3352 C GLU A 721 57.603 54.021 -9.201 1.00 40.12 C ATOM 3353 O GLU A 721 58.530 53.257 -8.996 1.00 40.76 O ATOM 3354 CB GLU A 721 59.029 55.999 -9.270 1.00 46.15 C ATOM 3355 CG GLU A 721 59.381 57.376 -9.794 1.00 50.52 C ATOM 3356 CD GLU A 721 59.963 57.379 -11.196 1.00 52.54 C ATOM 3357 OE1 GLU A 721 60.454 56.333 -11.667 1.00 57.55 O ATOM 3358 OE2 GLU A 721 59.937 58.458 -11.815 1.00 56.27 O ATOM 0 H GLU A 721 56.462 56.562 -9.264 1.00 41.51 H new ATOM 0 HA GLU A 721 58.005 55.090 -10.885 1.00 41.77 H new ATOM 0 HB2 GLU A 721 58.838 56.070 -8.322 1.00 46.15 H new ATOM 0 HB3 GLU A 721 59.807 55.427 -9.361 1.00 46.15 H new ATOM 0 HG2 GLU A 721 58.583 57.928 -9.785 1.00 50.52 H new ATOM 0 HG3 GLU A 721 60.018 57.788 -9.189 1.00 50.52 H new ATOM 3359 N LEU A 722 56.385 53.769 -8.759 1.00 38.34 N ATOM 3360 CA LEU A 722 56.130 52.603 -7.928 1.00 39.46 C ATOM 3361 C LEU A 722 55.927 51.326 -8.743 1.00 43.14 C ATOM 3362 O LEU A 722 56.510 50.302 -8.432 1.00 45.18 O ATOM 3363 CB LEU A 722 54.910 52.854 -7.052 1.00 40.33 C ATOM 3364 CG LEU A 722 54.474 51.723 -6.125 1.00 40.33 C ATOM 3365 CD1 LEU A 722 55.592 51.305 -5.190 1.00 42.78 C ATOM 3366 CD2 LEU A 722 53.254 52.184 -5.362 1.00 41.37 C ATOM 0 H LEU A 722 55.695 54.255 -8.925 1.00 38.34 H new ATOM 0 HA LEU A 722 56.918 52.467 -7.378 1.00 39.46 H new ATOM 0 HB2 LEU A 722 55.086 53.638 -6.508 1.00 40.33 H new ATOM 0 HB3 LEU A 722 54.163 53.073 -7.631 1.00 40.33 H new ATOM 0 HG LEU A 722 54.254 50.937 -6.649 1.00 40.33 H new ATOM 0 HD11 LEU A 722 55.283 50.587 -4.616 1.00 42.78 H new ATOM 0 HD12 LEU A 722 56.351 50.999 -5.710 1.00 42.78 H new ATOM 0 HD13 LEU A 722 55.858 52.062 -4.645 1.00 42.78 H new ATOM 0 HD21 LEU A 722 52.960 51.478 -4.765 1.00 41.37 H new ATOM 0 HD22 LEU A 722 53.475 52.974 -4.844 1.00 41.37 H new ATOM 0 HD23 LEU A 722 52.543 52.397 -5.986 1.00 41.37 H new ATOM 3367 N CYS A 723 55.047 51.382 -9.739 1.00 44.11 N ATOM 3368 CA CYS A 723 54.712 50.209 -10.558 1.00 43.37 C ATOM 3369 C CYS A 723 53.930 50.676 -11.784 1.00 44.43 C ATOM 3370 O CYS A 723 53.701 51.872 -11.969 1.00 44.64 O ATOM 3371 CB CYS A 723 53.881 49.218 -9.749 1.00 44.61 C ATOM 3372 SG CYS A 723 52.264 49.904 -9.360 1.00 45.17 S ATOM 0 H CYS A 723 54.626 52.098 -9.962 1.00 44.11 H new ATOM 0 HA CYS A 723 55.526 49.762 -10.838 1.00 43.37 H new ATOM 0 HB2 CYS A 723 53.775 48.394 -10.250 1.00 44.61 H new ATOM 0 HB3 CYS A 723 54.347 48.993 -8.929 1.00 44.61 H new ATOM 3373 N SER A 724 53.530 49.742 -12.630 1.00 46.97 N ATOM 3374 CA SER A 724 52.869 50.095 -13.880 1.00 52.69 C ATOM 3375 C SER A 724 51.328 50.014 -13.802 1.00 49.78 C ATOM 3376 O SER A 724 50.677 50.214 -14.811 1.00 53.49 O ATOM 3377 CB SER A 724 53.416 49.208 -15.007 1.00 54.87 C ATOM 3378 OG SER A 724 53.383 47.846 -14.621 1.00 58.18 O ATOM 0 H SER A 724 53.630 48.897 -12.502 1.00 46.97 H new ATOM 0 HA SER A 724 53.069 51.026 -14.066 1.00 52.69 H new ATOM 0 HB2 SER A 724 52.889 49.335 -15.812 1.00 54.87 H new ATOM 0 HB3 SER A 724 54.326 49.468 -15.219 1.00 54.87 H new ATOM 0 HG SER A 724 53.683 47.370 -15.245 1.00 58.18 H new ATOM 3379 N CYS A 725 50.752 49.751 -12.621 1.00 47.51 N ATOM 3380 CA CYS A 725 49.285 49.779 -12.457 1.00 48.04 C ATOM 3381 C CYS A 725 48.762 51.198 -12.643 1.00 49.57 C ATOM 3382 O CYS A 725 49.493 52.142 -12.404 1.00 51.94 O ATOM 3383 CB CYS A 725 48.851 49.296 -11.074 1.00 43.95 C ATOM 3384 SG CYS A 725 49.311 47.612 -10.621 1.00 47.89 S ATOM 0 H CYS A 725 51.187 49.555 -11.906 1.00 47.51 H new ATOM 0 HA CYS A 725 48.919 49.183 -13.129 1.00 48.04 H new ATOM 0 HB2 CYS A 725 49.223 49.900 -10.412 1.00 43.95 H new ATOM 0 HB3 CYS A 725 47.886 49.372 -11.016 1.00 43.95 H new ATOM 3385 N PRO A 726 47.492 51.350 -13.071 1.00 52.12 N ATOM 3386 CA PRO A 726 46.935 52.695 -13.104 1.00 51.35 C ATOM 3387 C PRO A 726 46.801 53.258 -11.688 1.00 45.53 C ATOM 3388 O PRO A 726 46.528 52.500 -10.760 1.00 44.39 O ATOM 3389 CB PRO A 726 45.537 52.492 -13.708 1.00 51.28 C ATOM 3390 CG PRO A 726 45.188 51.094 -13.369 1.00 52.55 C ATOM 3391 CD PRO A 726 46.485 50.339 -13.456 1.00 52.17 C ATOM 0 HA PRO A 726 47.489 53.315 -13.604 1.00 51.35 H new ATOM 0 HB2 PRO A 726 44.896 53.117 -13.334 1.00 51.28 H new ATOM 0 HB3 PRO A 726 45.543 52.632 -14.668 1.00 51.28 H new ATOM 0 HG2 PRO A 726 44.805 51.033 -12.480 1.00 52.55 H new ATOM 0 HG3 PRO A 726 44.531 50.736 -13.986 1.00 52.55 H new ATOM 0 HD2 PRO A 726 46.496 49.576 -12.857 1.00 52.17 H new ATOM 0 HD3 PRO A 726 46.642 49.999 -14.351 1.00 52.17 H new ATOM 3392 N PRO A 727 46.976 54.576 -11.530 1.00 45.39 N ATOM 3393 CA PRO A 727 46.907 55.220 -10.218 1.00 44.37 C ATOM 3394 C PRO A 727 45.658 54.959 -9.388 1.00 45.51 C ATOM 3395 O PRO A 727 45.748 55.049 -8.151 1.00 39.36 O ATOM 3396 CB PRO A 727 47.020 56.699 -10.560 1.00 49.05 C ATOM 3397 CG PRO A 727 47.912 56.723 -11.761 1.00 50.44 C ATOM 3398 CD PRO A 727 47.574 55.478 -12.538 1.00 47.78 C ATOM 0 HA PRO A 727 47.603 54.862 -9.645 1.00 44.37 H new ATOM 0 HB2 PRO A 727 46.152 57.086 -10.754 1.00 49.05 H new ATOM 0 HB3 PRO A 727 47.399 57.206 -9.825 1.00 49.05 H new ATOM 0 HG2 PRO A 727 47.759 57.519 -12.294 1.00 50.44 H new ATOM 0 HG3 PRO A 727 48.847 56.730 -11.502 1.00 50.44 H new ATOM 0 HD2 PRO A 727 46.952 55.667 -13.258 1.00 47.78 H new ATOM 0 HD3 PRO A 727 48.364 55.086 -12.941 1.00 47.78 H new ATOM 3399 N TYR A 728 44.535 54.584 -10.021 1.00 40.41 N ATOM 3400 CA TYR A 728 43.327 54.267 -9.253 1.00 42.62 C ATOM 3401 C TYR A 728 43.476 53.031 -8.364 1.00 39.53 C ATOM 3402 O TYR A 728 42.742 52.875 -7.405 1.00 40.35 O ATOM 3403 CB TYR A 728 42.072 54.172 -10.147 1.00 43.93 C ATOM 3404 CG TYR A 728 41.959 52.997 -11.109 1.00 42.10 C ATOM 3405 CD1 TYR A 728 41.556 51.739 -10.674 1.00 42.82 C ATOM 3406 CD2 TYR A 728 42.183 53.174 -12.478 1.00 48.24 C ATOM 3407 CE1 TYR A 728 41.418 50.675 -11.569 1.00 45.51 C ATOM 3408 CE2 TYR A 728 42.031 52.121 -13.381 1.00 49.69 C ATOM 3409 CZ TYR A 728 41.655 50.876 -12.921 1.00 47.46 C ATOM 3410 OH TYR A 728 41.535 49.830 -13.817 1.00 57.90 O ATOM 0 H TYR A 728 44.455 54.509 -10.874 1.00 40.41 H new ATOM 0 HA TYR A 728 43.202 55.019 -8.653 1.00 42.62 H new ATOM 0 HB2 TYR A 728 41.295 54.155 -9.566 1.00 43.93 H new ATOM 0 HB3 TYR A 728 42.018 54.988 -10.669 1.00 43.93 H new ATOM 0 HD1 TYR A 728 41.375 51.604 -9.772 1.00 42.82 H new ATOM 0 HD2 TYR A 728 42.439 54.011 -12.793 1.00 48.24 H new ATOM 0 HE1 TYR A 728 41.168 49.834 -11.259 1.00 45.51 H new ATOM 0 HE2 TYR A 728 42.182 52.258 -14.288 1.00 49.69 H new ATOM 0 HH TYR A 728 41.707 50.104 -14.592 1.00 57.90 H new ATOM 3411 N LYS A 729 44.436 52.172 -8.665 1.00 40.81 N ATOM 3412 CA LYS A 729 44.770 51.029 -7.787 1.00 43.16 C ATOM 3413 C LYS A 729 45.601 51.394 -6.541 1.00 40.62 C ATOM 3414 O LYS A 729 45.773 50.553 -5.666 1.00 42.06 O ATOM 3415 CB LYS A 729 45.565 49.995 -8.569 1.00 48.25 C ATOM 3416 CG LYS A 729 44.898 49.469 -9.834 1.00 55.29 C ATOM 3417 CD LYS A 729 43.768 48.508 -9.514 1.00 62.05 C ATOM 3418 CE LYS A 729 44.270 47.091 -9.326 1.00 67.89 C ATOM 3419 NZ LYS A 729 44.442 46.431 -10.653 1.00 73.70 N ATOM 0 H LYS A 729 44.917 52.223 -9.376 1.00 40.81 H new ATOM 0 HA LYS A 729 43.914 50.692 -7.480 1.00 43.16 H new ATOM 0 HB2 LYS A 729 46.420 50.384 -8.811 1.00 48.25 H new ATOM 0 HB3 LYS A 729 45.751 49.244 -7.984 1.00 48.25 H new ATOM 0 HG2 LYS A 729 44.553 50.213 -10.352 1.00 55.29 H new ATOM 0 HG3 LYS A 729 45.558 49.021 -10.386 1.00 55.29 H new ATOM 0 HD2 LYS A 729 43.314 48.800 -8.708 1.00 62.05 H new ATOM 0 HD3 LYS A 729 43.115 48.527 -10.231 1.00 62.05 H new ATOM 0 HE2 LYS A 729 45.114 47.100 -8.849 1.00 67.89 H new ATOM 0 HE3 LYS A 729 43.643 46.587 -8.784 1.00 67.89 H new ATOM 0 HZ1 LYS A 729 44.737 45.600 -10.535 1.00 73.70 H new ATOM 0 HZ2 LYS A 729 43.660 46.411 -11.078 1.00 73.70 H new ATOM 0 HZ3 LYS A 729 45.031 46.888 -11.138 1.00 73.70 H new ATOM 3420 N TYR A 730 46.122 52.620 -6.480 1.00 37.33 N ATOM 3421 CA TYR A 730 47.036 53.058 -5.413 1.00 37.36 C ATOM 3422 C TYR A 730 46.287 53.550 -4.203 1.00 37.66 C ATOM 3423 O TYR A 730 45.132 53.928 -4.309 1.00 38.99 O ATOM 3424 CB TYR A 730 47.943 54.199 -5.901 1.00 34.82 C ATOM 3425 CG TYR A 730 48.891 53.887 -7.049 1.00 35.22 C ATOM 3426 CD1 TYR A 730 49.103 52.572 -7.507 1.00 37.47 C ATOM 3427 CD2 TYR A 730 49.619 54.915 -7.668 1.00 36.71 C ATOM 3428 CE1 TYR A 730 49.989 52.307 -8.537 1.00 38.83 C ATOM 3429 CE2 TYR A 730 50.509 54.652 -8.707 1.00 37.12 C ATOM 3430 CZ TYR A 730 50.695 53.346 -9.135 1.00 40.60 C ATOM 3431 OH TYR A 730 51.586 53.070 -10.159 1.00 40.33 O ATOM 0 H TYR A 730 45.955 53.230 -7.062 1.00 37.33 H new ATOM 0 HA TYR A 730 47.567 52.283 -5.173 1.00 37.36 H new ATOM 0 HB2 TYR A 730 47.377 54.939 -6.170 1.00 34.82 H new ATOM 0 HB3 TYR A 730 48.472 54.506 -5.148 1.00 34.82 H new ATOM 0 HD1 TYR A 730 48.640 51.870 -7.111 1.00 37.47 H new ATOM 0 HD2 TYR A 730 49.505 55.791 -7.378 1.00 36.71 H new ATOM 0 HE1 TYR A 730 50.113 51.433 -8.830 1.00 38.83 H new ATOM 0 HE2 TYR A 730 50.975 55.348 -9.111 1.00 37.12 H new ATOM 0 HH TYR A 730 51.856 52.278 -10.090 1.00 40.33 H new ATOM 3432 N LYS A 731 46.939 53.544 -3.043 1.00 37.46 N ATOM 3433 CA LYS A 731 46.386 54.200 -1.848 1.00 38.27 C ATOM 3434 C LYS A 731 47.318 55.292 -1.409 1.00 36.10 C ATOM 3435 O LYS A 731 48.532 55.058 -1.321 1.00 35.01 O ATOM 3436 CB LYS A 731 46.246 53.228 -0.673 1.00 43.54 C ATOM 3437 CG LYS A 731 44.958 52.448 -0.633 1.00 51.58 C ATOM 3438 CD LYS A 731 44.809 51.809 0.731 1.00 55.48 C ATOM 3439 CE LYS A 731 43.812 50.664 0.735 1.00 61.84 C ATOM 3440 NZ LYS A 731 44.114 49.684 1.824 1.00 69.56 N ATOM 0 H LYS A 731 47.703 53.167 -2.922 1.00 37.46 H new ATOM 0 HA LYS A 731 45.510 54.542 -2.087 1.00 38.27 H new ATOM 0 HB2 LYS A 731 46.986 52.601 -0.701 1.00 43.54 H new ATOM 0 HB3 LYS A 731 46.330 53.729 0.154 1.00 43.54 H new ATOM 0 HG2 LYS A 731 44.206 53.034 -0.812 1.00 51.58 H new ATOM 0 HG3 LYS A 731 44.958 51.767 -1.324 1.00 51.58 H new ATOM 0 HD2 LYS A 731 45.673 51.482 1.027 1.00 55.48 H new ATOM 0 HD3 LYS A 731 44.526 52.482 1.370 1.00 55.48 H new ATOM 0 HE2 LYS A 731 42.915 51.014 0.852 1.00 61.84 H new ATOM 0 HE3 LYS A 731 43.831 50.213 -0.123 1.00 61.84 H new ATOM 0 HZ1 LYS A 731 43.500 49.040 1.823 1.00 69.56 H new ATOM 0 HZ2 LYS A 731 44.918 49.327 1.688 1.00 69.56 H new ATOM 0 HZ3 LYS A 731 44.104 50.101 2.610 1.00 69.56 H new ATOM 3441 N LEU A 732 46.749 56.451 -1.088 1.00 32.27 N ATOM 3442 CA LEU A 732 47.442 57.472 -0.342 1.00 33.26 C ATOM 3443 C LEU A 732 47.473 57.089 1.135 1.00 31.81 C ATOM 3444 O LEU A 732 46.449 57.059 1.782 1.00 33.29 O ATOM 3445 CB LEU A 732 46.796 58.844 -0.510 1.00 32.68 C ATOM 3446 CG LEU A 732 47.439 59.921 0.398 1.00 36.01 C ATOM 3447 CD1 LEU A 732 48.863 60.234 -0.034 1.00 34.91 C ATOM 3448 CD2 LEU A 732 46.602 61.197 0.451 1.00 38.63 C ATOM 0 H LEU A 732 45.943 56.660 -1.303 1.00 32.27 H new ATOM 0 HA LEU A 732 48.345 57.533 -0.690 1.00 33.26 H new ATOM 0 HB2 LEU A 732 46.870 59.121 -1.437 1.00 32.68 H new ATOM 0 HB3 LEU A 732 45.849 58.779 -0.308 1.00 32.68 H new ATOM 0 HG LEU A 732 47.468 59.550 1.294 1.00 36.01 H new ATOM 0 HD11 LEU A 732 49.238 60.910 0.552 1.00 34.91 H new ATOM 0 HD12 LEU A 732 49.401 59.429 0.016 1.00 34.91 H new ATOM 0 HD13 LEU A 732 48.860 60.563 -0.946 1.00 34.91 H new ATOM 0 HD21 LEU A 732 47.036 61.845 1.028 1.00 38.63 H new ATOM 0 HD22 LEU A 732 46.517 61.565 -0.442 1.00 38.63 H new ATOM 0 HD23 LEU A 732 45.721 60.992 0.801 1.00 38.63 H new ATOM 3449 N ARG A 733 48.667 56.818 1.652 1.00 29.32 N ATOM 3450 C ARG A 733 49.311 57.834 3.724 1.00 30.01 C ATOM 3451 O ARG A 733 50.284 58.442 3.286 1.00 31.56 O ATOM 3452 CA AARG A 733 48.856 56.557 3.075 0.54 28.46 C ATOM 3453 CB AARG A 733 49.869 55.439 3.298 0.54 30.30 C ATOM 3454 CG AARG A 733 49.486 54.108 2.667 0.54 29.35 C ATOM 3455 CD AARG A 733 48.097 53.620 3.069 0.54 29.77 C ATOM 3456 NE AARG A 733 47.933 53.473 4.527 0.54 31.52 N ATOM 3457 CZ AARG A 733 47.797 52.312 5.193 0.54 29.87 C ATOM 3458 NH1AARG A 733 47.757 51.149 4.536 0.54 29.76 N ATOM 3459 NH2AARG A 733 47.659 52.323 6.528 0.54 26.22 N ATOM 3460 CA BARG A 733 48.867 56.530 3.060 0.46 29.47 C ATOM 3461 CB BARG A 733 49.893 55.403 3.197 0.46 32.00 C ATOM 3462 CG BARG A 733 49.469 54.100 2.509 0.46 32.44 C ATOM 3463 CD BARG A 733 48.747 53.185 3.483 0.46 34.09 C ATOM 3464 NE BARG A 733 47.966 52.080 2.913 0.46 36.06 N ATOM 3465 CZ BARG A 733 48.483 50.980 2.381 0.46 38.35 C ATOM 3466 NH1BARG A 733 49.790 50.846 2.276 0.46 39.63 N ATOM 3467 NH2BARG A 733 47.696 50.014 1.927 0.46 38.88 N ATOM 0 H AARG A 733 49.390 56.780 1.188 0.54 29.32 H new ATOM 0 H BARG A 733 49.390 56.797 1.187 0.46 29.32 H new ATOM 0 HA AARG A 733 48.021 56.262 3.471 0.54 29.47 H new ATOM 0 HA BARG A 733 48.059 56.221 3.499 0.46 29.47 H new ATOM 0 HB2AARG A 733 50.727 55.719 2.941 0.54 32.00 H new ATOM 0 HB2BARG A 733 50.738 55.698 2.822 0.46 32.00 H new ATOM 0 HB3AARG A 733 49.987 55.310 4.252 0.54 32.00 H new ATOM 0 HB3BARG A 733 50.046 55.228 4.139 0.46 32.00 H new ATOM 0 HG2AARG A 733 49.524 54.193 1.702 0.54 32.44 H new ATOM 0 HG2BARG A 733 48.890 54.300 1.757 0.46 32.44 H new ATOM 0 HG3AARG A 733 50.141 53.439 2.919 0.54 32.44 H new ATOM 0 HG3BARG A 733 50.250 53.648 2.153 0.46 32.44 H new ATOM 0 HD2AARG A 733 47.433 54.243 2.736 0.54 34.09 H new ATOM 0 HD2BARG A 733 49.406 52.807 4.086 0.46 34.09 H new ATOM 0 HD3AARG A 733 47.924 52.766 2.642 0.54 34.09 H new ATOM 0 HD3BARG A 733 48.150 53.729 4.020 0.46 34.09 H new ATOM 0 HE AARG A 733 47.923 54.195 4.994 0.54 36.06 H new ATOM 0 HE BARG A 733 47.109 52.151 2.925 0.46 36.06 H new ATOM 0 HH11AARG A 733 47.818 51.137 3.678 0.54 39.63 H new ATOM 0 HH11BARG A 733 50.310 51.473 2.553 0.46 39.63 H new ATOM 0 HH12AARG A 733 47.670 50.412 4.971 0.54 39.63 H new ATOM 0 HH12BARG A 733 50.123 50.132 1.931 0.46 39.63 H new ATOM 0 HH21AARG A 733 47.658 53.070 6.954 0.54 38.88 H new ATOM 0 HH21BARG A 733 46.841 50.097 1.976 0.46 38.88 H new ATOM 0 HH22AARG A 733 47.572 51.583 6.957 0.54 38.88 H new ATOM 0 HH22BARG A 733 48.040 49.305 1.584 0.46 38.88 H new ATOM 3468 N TYR A 734 48.587 58.286 4.756 1.00 29.15 N ATOM 3469 CA TYR A 734 48.853 59.590 5.354 1.00 29.60 C ATOM 3470 C TYR A 734 48.868 59.523 6.858 1.00 28.00 C ATOM 3471 O TYR A 734 48.118 58.742 7.462 1.00 28.32 O ATOM 3472 CB TYR A 734 47.811 60.621 4.864 1.00 32.98 C ATOM 3473 CG TYR A 734 46.392 60.266 5.273 1.00 32.14 C ATOM 3474 CD1 TYR A 734 45.601 59.434 4.485 1.00 34.17 C ATOM 3475 CD2 TYR A 734 45.870 60.719 6.458 1.00 34.32 C ATOM 3476 CE1 TYR A 734 44.316 59.091 4.860 1.00 32.47 C ATOM 3477 CE2 TYR A 734 44.581 60.393 6.843 1.00 35.92 C ATOM 3478 CZ TYR A 734 43.815 59.589 6.027 1.00 35.25 C ATOM 3479 OH TYR A 734 42.565 59.265 6.427 1.00 38.07 O ATOM 0 H TYR A 734 47.941 57.851 5.120 1.00 29.15 H new ATOM 0 HA TYR A 734 49.736 59.873 5.070 1.00 29.60 H new ATOM 0 HB2 TYR A 734 48.036 61.495 5.219 1.00 32.98 H new ATOM 0 HB3 TYR A 734 47.857 60.687 3.897 1.00 32.98 H new ATOM 0 HD1 TYR A 734 45.946 59.101 3.688 1.00 34.17 H new ATOM 0 HD2 TYR A 734 46.391 61.254 7.012 1.00 34.32 H new ATOM 0 HE1 TYR A 734 43.801 58.530 4.326 1.00 32.47 H new ATOM 0 HE2 TYR A 734 44.235 60.713 7.645 1.00 35.92 H new ATOM 0 HH TYR A 734 42.398 59.643 7.158 1.00 38.07 H new ATOM 3480 N ARG A 735 49.716 60.324 7.487 1.00 27.66 N ATOM 3481 CA ARG A 735 49.767 60.316 8.948 1.00 29.46 C ATOM 3482 C ARG A 735 48.662 61.167 9.582 1.00 29.77 C ATOM 3483 O ARG A 735 48.110 60.788 10.606 1.00 28.73 O ATOM 3484 CB ARG A 735 51.112 60.794 9.472 1.00 28.55 C ATOM 3485 CG ARG A 735 51.260 60.743 10.987 1.00 28.77 C ATOM 3486 CD ARG A 735 51.216 59.325 11.475 1.00 29.50 C ATOM 3487 NE ARG A 735 51.285 59.229 12.906 1.00 30.27 N ATOM 3488 CZ ARG A 735 50.270 59.449 13.747 1.00 33.68 C ATOM 3489 NH1 ARG A 735 49.062 59.846 13.346 1.00 32.78 N ATOM 3490 NH2 ARG A 735 50.480 59.273 15.034 1.00 36.00 N ATOM 0 H ARG A 735 50.259 60.868 7.102 1.00 27.66 H new ATOM 0 HA ARG A 735 49.631 59.390 9.203 1.00 29.46 H new ATOM 0 HB2 ARG A 735 51.811 60.253 9.073 1.00 28.55 H new ATOM 0 HB3 ARG A 735 51.255 61.707 9.176 1.00 28.55 H new ATOM 0 HG2 ARG A 735 52.098 61.155 11.249 1.00 28.77 H new ATOM 0 HG3 ARG A 735 50.550 61.256 11.404 1.00 28.77 H new ATOM 0 HD2 ARG A 735 50.398 58.906 11.166 1.00 29.50 H new ATOM 0 HD3 ARG A 735 51.954 58.830 11.085 1.00 29.50 H new ATOM 0 HE ARG A 735 52.042 59.012 13.251 1.00 30.27 H new ATOM 0 HH11 ARG A 735 48.907 59.973 12.510 1.00 32.78 H new ATOM 0 HH12 ARG A 735 48.438 59.975 13.924 1.00 32.78 H new ATOM 0 HH21 ARG A 735 51.254 59.023 15.313 1.00 36.00 H new ATOM 0 HH22 ARG A 735 49.843 59.408 15.596 1.00 36.00 H new ATOM 3491 N TYR A 736 48.415 62.326 8.993 1.00 29.41 N ATOM 3492 CA TYR A 736 47.458 63.300 9.506 1.00 30.87 C ATOM 3493 C TYR A 736 46.659 63.811 8.349 1.00 31.43 C ATOM 3494 O TYR A 736 47.209 63.991 7.254 1.00 31.63 O ATOM 3495 CB TYR A 736 48.176 64.498 10.114 1.00 29.95 C ATOM 3496 CG TYR A 736 48.984 64.170 11.319 1.00 31.22 C ATOM 3497 CD1 TYR A 736 48.372 63.762 12.498 1.00 29.99 C ATOM 3498 CD2 TYR A 736 50.386 64.263 11.284 1.00 33.20 C ATOM 3499 CE1 TYR A 736 49.115 63.438 13.607 1.00 32.49 C ATOM 3500 CE2 TYR A 736 51.139 63.960 12.389 1.00 33.71 C ATOM 3501 CZ TYR A 736 50.523 63.545 13.538 1.00 35.20 C ATOM 3502 OH TYR A 736 51.303 63.237 14.618 1.00 38.81 O ATOM 0 H TYR A 736 48.805 62.576 8.269 1.00 29.41 H new ATOM 0 HA TYR A 736 46.907 62.873 10.180 1.00 30.87 H new ATOM 0 HB2 TYR A 736 48.757 64.890 9.443 1.00 29.95 H new ATOM 0 HB3 TYR A 736 47.519 65.172 10.350 1.00 29.95 H new ATOM 0 HD1 TYR A 736 47.444 63.707 12.537 1.00 29.99 H new ATOM 0 HD2 TYR A 736 50.809 64.534 10.501 1.00 33.20 H new ATOM 0 HE1 TYR A 736 48.699 63.153 14.389 1.00 32.49 H new ATOM 0 HE2 TYR A 736 52.065 64.036 12.358 1.00 33.71 H new ATOM 0 HH TYR A 736 52.112 63.349 14.421 1.00 38.81 H new ATOM 3503 N THR A 737 45.375 64.081 8.591 1.00 32.31 N ATOM 3504 CA THR A 737 44.590 64.862 7.642 1.00 33.46 C ATOM 3505 C THR A 737 45.038 66.310 7.832 1.00 35.69 C ATOM 3506 O THR A 737 45.541 66.684 8.907 1.00 34.70 O ATOM 3507 CB THR A 737 43.075 64.800 7.938 1.00 33.60 C ATOM 3508 OG1 THR A 737 42.825 65.408 9.197 1.00 33.45 O ATOM 3509 CG2 THR A 737 42.551 63.342 7.987 1.00 34.06 C ATOM 0 H THR A 737 44.946 63.824 9.291 1.00 32.31 H new ATOM 0 HA THR A 737 44.728 64.517 6.746 1.00 33.46 H new ATOM 0 HB THR A 737 42.615 65.266 7.222 1.00 33.60 H new ATOM 0 HG1 THR A 737 42.002 65.379 9.364 1.00 33.45 H new ATOM 0 HG21 THR A 737 41.599 63.346 8.175 1.00 34.06 H new ATOM 0 HG22 THR A 737 42.710 62.912 7.132 1.00 34.06 H new ATOM 0 HG23 THR A 737 43.016 62.854 8.685 1.00 34.06 H new ATOM 3510 N LEU A 738 44.811 67.127 6.815 1.00 41.11 N ATOM 3511 CA LEU A 738 45.042 68.571 6.906 1.00 46.93 C ATOM 3512 C LEU A 738 44.302 69.181 8.088 1.00 48.04 C ATOM 3513 O LEU A 738 44.873 70.000 8.806 1.00 48.26 O ATOM 3514 CB LEU A 738 44.675 69.274 5.604 1.00 51.61 C ATOM 3515 CG LEU A 738 45.513 68.809 4.406 1.00 55.75 C ATOM 3516 CD1 LEU A 738 44.879 69.236 3.095 1.00 59.51 C ATOM 3517 CD2 LEU A 738 46.953 69.295 4.499 1.00 60.79 C ATOM 0 H LEU A 738 44.518 66.865 6.050 1.00 41.11 H new ATOM 0 HA LEU A 738 45.991 68.704 7.056 1.00 46.93 H new ATOM 0 HB2 LEU A 738 43.737 69.119 5.414 1.00 51.61 H new ATOM 0 HB3 LEU A 738 44.788 70.231 5.718 1.00 51.61 H new ATOM 0 HG LEU A 738 45.533 67.839 4.430 1.00 55.75 H new ATOM 0 HD11 LEU A 738 45.427 68.930 2.355 1.00 59.51 H new ATOM 0 HD12 LEU A 738 43.993 68.848 3.022 1.00 59.51 H new ATOM 0 HD13 LEU A 738 44.811 70.203 3.068 1.00 59.51 H new ATOM 0 HD21 LEU A 738 47.451 68.983 3.727 1.00 60.79 H new ATOM 0 HD22 LEU A 738 46.967 70.265 4.521 1.00 60.79 H new ATOM 0 HD23 LEU A 738 47.360 68.948 5.308 1.00 60.79 H new ATOM 3518 N ASP A 739 43.077 68.724 8.344 1.00 48.37 N ATOM 3519 CA ASP A 739 42.319 69.153 9.532 1.00 49.14 C ATOM 3520 C ASP A 739 42.919 68.739 10.870 1.00 46.95 C ATOM 3521 O ASP A 739 42.647 69.402 11.862 1.00 47.38 O ATOM 3522 CB ASP A 739 40.872 68.623 9.498 1.00 57.50 C ATOM 3523 CG ASP A 739 40.044 69.186 8.336 1.00 63.19 C ATOM 3524 OD1 ASP A 739 40.417 70.221 7.741 1.00 61.77 O ATOM 3525 OD2 ASP A 739 38.998 68.569 8.016 1.00 75.74 O ATOM 0 H ASP A 739 42.661 68.162 7.843 1.00 48.37 H new ATOM 0 HA ASP A 739 42.351 70.121 9.479 1.00 49.14 H new ATOM 0 HB2 ASP A 739 40.891 67.655 9.434 1.00 57.50 H new ATOM 0 HB3 ASP A 739 40.434 68.844 10.335 1.00 57.50 H new ATOM 3526 N ASP A 740 43.656 67.625 10.941 1.00 42.39 N ATOM 3527 CA ASP A 740 44.425 67.297 12.164 1.00 41.85 C ATOM 3528 C ASP A 740 45.599 68.271 12.349 1.00 36.22 C ATOM 3529 O ASP A 740 46.000 68.553 13.455 1.00 37.35 O ATOM 3530 CB ASP A 740 45.059 65.890 12.136 1.00 46.05 C ATOM 3531 CG ASP A 740 44.058 64.758 12.049 1.00 53.22 C ATOM 3532 OD1 ASP A 740 42.926 64.893 12.588 1.00 52.32 O ATOM 3533 OD2 ASP A 740 44.439 63.703 11.440 1.00 49.02 O ATOM 0 H ASP A 740 43.728 67.050 10.306 1.00 42.39 H new ATOM 0 HA ASP A 740 43.775 67.353 12.881 1.00 41.85 H new ATOM 0 HB2 ASP A 740 45.662 65.833 11.378 1.00 46.05 H new ATOM 0 HB3 ASP A 740 45.596 65.773 12.935 1.00 46.05 H new ATOM 3534 N LEU A 741 46.177 68.733 11.255 1.00 36.93 N ATOM 3535 CA LEU A 741 47.435 69.483 11.317 1.00 37.09 C ATOM 3536 C LEU A 741 47.276 70.916 11.776 1.00 38.93 C ATOM 3537 O LEU A 741 48.106 71.421 12.525 1.00 37.16 O ATOM 3538 CB LEU A 741 48.143 69.443 9.967 1.00 35.66 C ATOM 3539 CG LEU A 741 48.717 68.065 9.625 1.00 37.39 C ATOM 3540 CD1 LEU A 741 48.971 67.983 8.132 1.00 40.04 C ATOM 3541 CD2 LEU A 741 49.979 67.741 10.417 1.00 37.04 C ATOM 0 H LEU A 741 45.863 68.627 10.462 1.00 36.93 H new ATOM 0 HA LEU A 741 47.974 69.041 11.991 1.00 37.09 H new ATOM 0 HB2 LEU A 741 47.519 69.708 9.273 1.00 35.66 H new ATOM 0 HB3 LEU A 741 48.861 70.095 9.966 1.00 35.66 H new ATOM 0 HG LEU A 741 48.062 67.396 9.880 1.00 37.39 H new ATOM 0 HD11 LEU A 741 49.335 67.111 7.913 1.00 40.04 H new ATOM 0 HD12 LEU A 741 48.137 68.115 7.654 1.00 40.04 H new ATOM 0 HD13 LEU A 741 49.604 68.671 7.873 1.00 40.04 H new ATOM 0 HD21 LEU A 741 50.302 66.862 10.166 1.00 37.04 H new ATOM 0 HD22 LEU A 741 50.661 68.403 10.224 1.00 37.04 H new ATOM 0 HD23 LEU A 741 49.778 67.752 11.366 1.00 37.04 H new ATOM 3542 N TYR A 742 46.217 71.583 11.327 1.00 41.28 N ATOM 3543 CA TYR A 742 46.022 72.992 11.688 1.00 41.08 C ATOM 3544 C TYR A 742 45.907 73.240 13.208 1.00 40.23 C ATOM 3545 O TYR A 742 46.539 74.148 13.725 1.00 44.14 O ATOM 3546 CB TYR A 742 44.887 73.618 10.853 1.00 43.24 C ATOM 3547 CG TYR A 742 45.263 73.832 9.396 1.00 43.05 C ATOM 3548 CD1 TYR A 742 46.195 74.819 9.030 1.00 44.88 C ATOM 3549 CD2 TYR A 742 44.671 73.075 8.370 1.00 47.95 C ATOM 3550 CE1 TYR A 742 46.532 75.035 7.687 1.00 47.06 C ATOM 3551 CE2 TYR A 742 45.006 73.272 7.027 1.00 46.70 C ATOM 3552 CZ TYR A 742 45.935 74.255 6.679 1.00 48.32 C ATOM 3553 OH TYR A 742 46.278 74.467 5.338 1.00 49.54 O ATOM 0 H TYR A 742 45.607 71.249 10.821 1.00 41.28 H new ATOM 0 HA TYR A 742 46.836 73.464 11.452 1.00 41.08 H new ATOM 0 HB2 TYR A 742 44.106 73.045 10.898 1.00 43.24 H new ATOM 0 HB3 TYR A 742 44.637 74.469 11.245 1.00 43.24 H new ATOM 0 HD1 TYR A 742 46.595 75.337 9.691 1.00 44.88 H new ATOM 0 HD2 TYR A 742 44.041 72.427 8.590 1.00 47.95 H new ATOM 0 HE1 TYR A 742 47.149 75.693 7.462 1.00 47.06 H new ATOM 0 HE2 TYR A 742 44.611 72.750 6.367 1.00 46.70 H new ATOM 0 HH TYR A 742 46.988 74.914 5.297 1.00 49.54 H new ATOM 3554 N PRO A 743 45.180 72.396 13.948 1.00 43.04 N ATOM 3555 CA PRO A 743 45.161 72.550 15.412 1.00 39.46 C ATOM 3556 C PRO A 743 46.504 72.263 16.132 1.00 43.20 C ATOM 3557 O PRO A 743 46.741 72.789 17.228 1.00 39.99 O ATOM 3558 CB PRO A 743 44.128 71.519 15.867 1.00 42.23 C ATOM 3559 CG PRO A 743 43.293 71.250 14.670 1.00 44.48 C ATOM 3560 CD PRO A 743 44.154 71.461 13.469 1.00 44.52 C ATOM 0 HA PRO A 743 44.966 73.474 15.635 1.00 39.46 H new ATOM 0 HB2 PRO A 743 44.557 70.709 16.184 1.00 42.23 H new ATOM 0 HB3 PRO A 743 43.591 71.860 16.599 1.00 42.23 H new ATOM 0 HG2 PRO A 743 42.950 70.343 14.689 1.00 44.48 H new ATOM 0 HG3 PRO A 743 42.526 71.843 14.649 1.00 44.48 H new ATOM 0 HD2 PRO A 743 44.545 70.629 13.158 1.00 44.52 H new ATOM 0 HD3 PRO A 743 43.650 71.832 12.728 1.00 44.52 H new ATOM 3561 N MET A 744 47.347 71.409 15.548 1.00 40.66 N ATOM 3562 CA MET A 744 48.675 71.132 16.117 1.00 41.22 C ATOM 3563 C MET A 744 49.520 72.377 15.992 1.00 38.76 C ATOM 3564 O MET A 744 50.178 72.791 16.950 1.00 38.40 O ATOM 3565 CB MET A 744 49.359 69.953 15.408 1.00 43.54 C ATOM 3566 CG MET A 744 48.651 68.622 15.632 1.00 45.27 C ATOM 3567 SD MET A 744 49.228 67.308 14.521 1.00 49.48 S ATOM 3568 CE MET A 744 50.853 67.062 15.248 1.00 48.24 C ATOM 0 H MET A 744 47.172 70.979 14.824 1.00 40.66 H new ATOM 0 HA MET A 744 48.573 70.886 17.050 1.00 41.22 H new ATOM 0 HB2 MET A 744 49.398 70.135 14.456 1.00 43.54 H new ATOM 0 HB3 MET A 744 50.274 69.882 15.721 1.00 43.54 H new ATOM 0 HG2 MET A 744 48.785 68.342 16.551 1.00 45.27 H new ATOM 0 HG3 MET A 744 47.697 68.745 15.509 1.00 45.27 H new ATOM 0 HE1 MET A 744 51.260 66.267 14.869 1.00 48.24 H new ATOM 0 HE2 MET A 744 51.412 67.832 15.060 1.00 48.24 H new ATOM 0 HE3 MET A 744 50.765 66.954 16.208 1.00 48.24 H new ATOM 3569 N MET A 745 49.454 73.009 14.828 1.00 37.10 N ATOM 3570 CA MET A 745 50.178 74.248 14.610 1.00 41.47 C ATOM 3571 C MET A 745 49.665 75.387 15.500 1.00 45.67 C ATOM 3572 O MET A 745 50.441 76.212 15.998 1.00 44.97 O ATOM 3573 CB MET A 745 50.100 74.659 13.161 1.00 42.76 C ATOM 3574 CG MET A 745 50.963 75.856 12.896 1.00 45.72 C ATOM 3575 SD MET A 745 51.337 75.948 11.171 1.00 48.78 S ATOM 3576 CE MET A 745 49.765 76.540 10.527 1.00 48.96 C ATOM 0 H MET A 745 48.996 72.736 14.153 1.00 37.10 H new ATOM 0 HA MET A 745 51.102 74.079 14.851 1.00 41.47 H new ATOM 0 HB2 MET A 745 50.381 73.922 12.596 1.00 42.76 H new ATOM 0 HB3 MET A 745 49.180 74.861 12.927 1.00 42.76 H new ATOM 0 HG2 MET A 745 50.508 76.664 13.181 1.00 45.72 H new ATOM 0 HG3 MET A 745 51.783 75.796 13.411 1.00 45.72 H new ATOM 0 HE1 MET A 745 49.426 75.910 9.872 1.00 48.96 H new ATOM 0 HE2 MET A 745 49.128 76.624 11.254 1.00 48.96 H new ATOM 0 HE3 MET A 745 49.892 77.405 10.108 1.00 48.96 H new ATOM 3577 N ASN A 746 48.357 75.411 15.705 1.00 44.46 N ATOM 3578 CA ASN A 746 47.756 76.367 16.586 1.00 43.00 C ATOM 3579 C ASN A 746 48.129 76.200 18.056 1.00 41.33 C ATOM 3580 O ASN A 746 48.225 77.183 18.790 1.00 39.47 O ATOM 3581 CB ASN A 746 46.257 76.271 16.455 1.00 49.69 C ATOM 3582 CG ASN A 746 45.581 77.452 17.057 1.00 56.93 C ATOM 3583 OD1 ASN A 746 44.918 77.340 18.083 1.00 58.97 O ATOM 3584 ND2 ASN A 746 45.816 78.620 16.467 1.00 58.44 N ATOM 0 H ASN A 746 47.801 74.870 15.333 1.00 44.46 H new ATOM 0 HA ASN A 746 48.097 77.234 16.316 1.00 43.00 H new ATOM 0 HB2 ASN A 746 46.017 76.202 15.518 1.00 49.69 H new ATOM 0 HB3 ASN A 746 45.944 75.462 16.889 1.00 49.69 H new ATOM 0 HD21 ASN A 746 45.497 79.344 16.804 1.00 58.44 H new ATOM 0 HD22 ASN A 746 46.287 78.652 15.748 1.00 58.44 H new ATOM 3585 N ALA A 747 48.331 74.966 18.505 1.00 38.89 N ATOM 3586 CA ALA A 747 48.848 74.749 19.867 1.00 39.64 C ATOM 3587 C ALA A 747 50.213 75.414 20.042 1.00 37.19 C ATOM 3588 O ALA A 747 50.490 76.023 21.085 1.00 38.59 O ATOM 3589 CB ALA A 747 48.920 73.254 20.199 1.00 40.48 C ATOM 0 H ALA A 747 48.181 74.250 18.053 1.00 38.89 H new ATOM 0 HA ALA A 747 48.230 75.161 20.490 1.00 39.64 H new ATOM 0 HB1 ALA A 747 49.263 73.138 21.099 1.00 40.48 H new ATOM 0 HB2 ALA A 747 48.033 72.866 20.139 1.00 40.48 H new ATOM 0 HB3 ALA A 747 49.510 72.811 19.569 1.00 40.48 H new ATOM 3590 N LEU A 748 51.047 75.337 19.007 1.00 36.15 N ATOM 3591 CA LEU A 748 52.337 76.030 19.002 1.00 37.02 C ATOM 3592 C LEU A 748 52.175 77.536 19.061 1.00 37.02 C ATOM 3593 O LEU A 748 52.940 78.212 19.744 1.00 36.71 O ATOM 3594 CB LEU A 748 53.180 75.658 17.768 1.00 37.59 C ATOM 3595 CG LEU A 748 53.649 74.213 17.672 1.00 39.16 C ATOM 3596 CD1 LEU A 748 54.113 73.892 16.254 1.00 42.29 C ATOM 3597 CD2 LEU A 748 54.758 73.966 18.681 1.00 40.30 C ATOM 0 H LEU A 748 50.884 74.886 18.293 1.00 36.15 H new ATOM 0 HA LEU A 748 52.801 75.736 19.802 1.00 37.02 H new ATOM 0 HB2 LEU A 748 52.661 75.861 16.974 1.00 37.59 H new ATOM 0 HB3 LEU A 748 53.962 76.232 17.751 1.00 37.59 H new ATOM 0 HG LEU A 748 52.907 73.624 17.879 1.00 39.16 H new ATOM 0 HD11 LEU A 748 54.408 72.969 16.211 1.00 42.29 H new ATOM 0 HD12 LEU A 748 53.378 74.025 15.635 1.00 42.29 H new ATOM 0 HD13 LEU A 748 54.848 74.477 16.014 1.00 42.29 H new ATOM 0 HD21 LEU A 748 55.054 73.045 18.617 1.00 40.30 H new ATOM 0 HD22 LEU A 748 55.503 74.559 18.495 1.00 40.30 H new ATOM 0 HD23 LEU A 748 54.425 74.137 19.576 1.00 40.30 H new ATOM 3598 N LYS A 749 51.208 78.065 18.326 1.00 39.01 N ATOM 3599 CA LYS A 749 50.964 79.508 18.320 1.00 41.89 C ATOM 3600 C LYS A 749 50.602 80.004 19.713 1.00 42.15 C ATOM 3601 O LYS A 749 51.137 81.018 20.175 1.00 43.18 O ATOM 3602 CB LYS A 749 49.878 79.889 17.313 1.00 46.57 C ATOM 3603 CG LYS A 749 49.777 81.398 17.063 1.00 51.04 C ATOM 3604 CD LYS A 749 48.858 81.735 15.889 1.00 54.48 C ATOM 0 H LYS A 749 50.680 77.610 17.823 1.00 39.01 H new ATOM 0 HA LYS A 749 51.787 79.941 18.045 1.00 41.89 H new ATOM 0 HB2 LYS A 749 50.056 79.440 16.472 1.00 46.57 H new ATOM 0 HB3 LYS A 749 49.022 79.564 17.633 1.00 46.57 H new ATOM 0 HG2 LYS A 749 49.447 81.834 17.864 1.00 51.04 H new ATOM 0 HG3 LYS A 749 50.662 81.754 16.890 1.00 51.04 H new ATOM 3605 N LEU A 750 49.718 79.269 20.377 1.00 39.91 N ATOM 3606 CA LEU A 750 49.322 79.577 21.749 1.00 42.02 C ATOM 3607 C LEU A 750 50.498 79.531 22.705 1.00 43.69 C ATOM 3608 O LEU A 750 50.679 80.454 23.489 1.00 40.90 O ATOM 3609 CB LEU A 750 48.238 78.613 22.231 1.00 42.61 C ATOM 3610 CG LEU A 750 46.877 78.834 21.575 1.00 45.60 C ATOM 3611 CD1 LEU A 750 45.912 77.750 22.019 1.00 46.25 C ATOM 3612 CD2 LEU A 750 46.321 80.224 21.890 1.00 47.65 C ATOM 0 H LEU A 750 49.330 78.577 20.046 1.00 39.91 H new ATOM 0 HA LEU A 750 48.972 80.482 21.742 1.00 42.02 H new ATOM 0 HB2 LEU A 750 48.527 77.703 22.058 1.00 42.61 H new ATOM 0 HB3 LEU A 750 48.142 78.702 23.192 1.00 42.61 H new ATOM 0 HG LEU A 750 46.989 78.783 20.613 1.00 45.60 H new ATOM 0 HD11 LEU A 750 45.049 77.894 21.600 1.00 46.25 H new ATOM 0 HD12 LEU A 750 46.257 76.882 21.757 1.00 46.25 H new ATOM 0 HD13 LEU A 750 45.812 77.780 22.983 1.00 46.25 H new ATOM 0 HD21 LEU A 750 45.458 80.333 21.460 1.00 47.65 H new ATOM 0 HD22 LEU A 750 46.218 80.322 22.850 1.00 47.65 H new ATOM 0 HD23 LEU A 750 46.933 80.900 21.560 1.00 47.65 H new ATOM 3613 N ARG A 751 51.309 78.473 22.632 1.00 43.41 N ATOM 3614 CA ARG A 751 52.493 78.383 23.476 1.00 46.09 C ATOM 3615 C ARG A 751 53.438 79.581 23.251 1.00 47.80 C ATOM 3616 O ARG A 751 53.976 80.136 24.204 1.00 49.57 O ATOM 3617 CB ARG A 751 53.217 77.060 23.253 1.00 46.64 C ATOM 3618 CG ARG A 751 54.473 76.895 24.079 1.00 51.25 C ATOM 3619 CD ARG A 751 54.184 76.683 25.555 1.00 50.19 C ATOM 3620 NE ARG A 751 55.432 76.778 26.287 1.00 58.75 N ATOM 3621 CZ ARG A 751 55.562 76.738 27.609 1.00 64.62 C ATOM 3622 NH1 ARG A 751 54.510 76.588 28.409 1.00 65.10 N ATOM 3623 NH2 ARG A 751 56.774 76.847 28.135 1.00 68.73 N ATOM 0 H ARG A 751 51.190 77.805 22.104 1.00 43.41 H new ATOM 0 HA ARG A 751 52.201 78.414 24.401 1.00 46.09 H new ATOM 0 HB2 ARG A 751 52.610 76.332 23.457 1.00 46.64 H new ATOM 0 HB3 ARG A 751 53.447 76.983 22.314 1.00 46.64 H new ATOM 0 HG2 ARG A 751 54.980 76.140 23.741 1.00 51.25 H new ATOM 0 HG3 ARG A 751 55.031 77.682 23.973 1.00 51.25 H new ATOM 0 HD2 ARG A 751 53.555 77.349 25.874 1.00 50.19 H new ATOM 0 HD3 ARG A 751 53.775 75.815 25.697 1.00 50.19 H new ATOM 0 HE ARG A 751 56.152 76.868 25.825 1.00 58.75 H new ATOM 0 HH11 ARG A 751 53.722 76.514 28.073 1.00 65.10 H new ATOM 0 HH12 ARG A 751 54.618 76.565 29.262 1.00 65.10 H new ATOM 0 HH21 ARG A 751 57.458 76.942 27.623 1.00 68.73 H new ATOM 0 HH22 ARG A 751 56.876 76.823 28.989 1.00 68.73 H new ATOM 3624 N ALA A 752 53.603 79.987 21.999 1.00 48.02 N ATOM 3625 CA ALA A 752 54.481 81.089 21.649 1.00 50.92 C ATOM 3626 C ALA A 752 53.933 82.491 21.975 1.00 58.68 C ATOM 3627 O ALA A 752 54.719 83.427 21.999 1.00 61.03 O ATOM 3628 CB ALA A 752 54.826 81.017 20.173 1.00 49.27 C ATOM 0 H ALA A 752 53.206 79.628 21.326 1.00 48.02 H new ATOM 0 HA ALA A 752 55.267 80.978 22.206 1.00 50.92 H new ATOM 0 HB1 ALA A 752 55.413 81.754 19.941 1.00 49.27 H new ATOM 0 HB2 ALA A 752 55.273 80.177 19.986 1.00 49.27 H new ATOM 0 HB3 ALA A 752 54.013 81.074 19.647 1.00 49.27 H new ATOM 3629 N GLU A 753 52.616 82.630 22.203 1.00 64.50 N ATOM 3630 CA GLU A 753 51.915 83.932 22.391 1.00 67.38 C ATOM 3631 C GLU A 753 52.070 84.849 21.192 1.00 68.58 C ATOM 3632 O GLU A 753 51.450 84.618 20.156 1.00 76.70 O ATOM 3633 CB GLU A 753 52.337 84.669 23.675 1.00 68.39 C ATOM 3634 CG GLU A 753 51.676 84.150 24.940 1.00 70.63 C ATOM 3635 CD GLU A 753 52.527 83.152 25.719 1.00 78.55 C ATOM 3636 OE1 GLU A 753 53.641 83.528 26.168 1.00 84.10 O ATOM 3637 OE2 GLU A 753 52.069 82.001 25.922 1.00 72.80 O ATOM 0 H GLU A 753 52.086 81.955 22.255 1.00 64.50 H new ATOM 0 HA GLU A 753 50.978 83.700 22.482 1.00 67.38 H new ATOM 0 HB2 GLU A 753 53.299 84.599 23.774 1.00 68.39 H new ATOM 0 HB3 GLU A 753 52.129 85.611 23.577 1.00 68.39 H new ATOM 0 HG2 GLU A 753 51.466 84.902 25.516 1.00 70.63 H new ATOM 0 HG3 GLU A 753 50.834 83.729 24.705 1.00 70.63 H new TER 3638 GLU A 753 HETATM 3639 ZN ZN A1754 60.669 59.897 -3.409 1.00 34.46 ZN HETATM 3640 ZN ZN A1755 50.865 48.121 -8.686 1.00 47.63 ZN HETATM 3641 C1 OGA A1756 83.573 67.017 14.207 1.00 34.82 C HETATM 3642 C2 OGA A1756 84.491 66.089 13.461 1.00 35.38 C HETATM 3643 C4 OGA A1756 86.446 64.510 13.626 1.00 38.18 C HETATM 3644 C5 OGA A1756 87.689 64.409 14.505 1.00 35.42 C HETATM 3645 O1 OGA A1756 82.600 67.562 13.601 1.00 32.34 O1- HETATM 3646 O2 OGA A1756 83.814 67.211 15.431 1.00 34.45 O HETATM 3647 O2' OGA A1756 84.306 65.907 12.280 1.00 35.73 O HETATM 3648 O3 OGA A1756 88.566 63.553 14.271 1.00 39.05 O1- HETATM 3649 N1 OGA A1756 85.496 65.419 14.198 1.00 36.42 N HETATM 3650 O4 OGA A1756 87.848 65.154 15.510 1.00 35.61 O HETATM 0 H4C2 OGA A1756 86.695 64.811 12.738 1.00 38.18 H new HETATM 0 H4C1 OGA A1756 86.043 63.634 13.526 1.00 38.18 H new HETATM 0 H1 OGA A1756 85.540 65.567 15.044 1.00 36.42 H new HETATM 3651 MN MN A1757 100.915 59.191 0.114 1.00 85.36 MN HETATM 3652 MN MN A1758 82.515 66.670 11.597 1.00 29.70 MN HETATM 3653 P PO4 A1759 64.185 62.425 -9.748 1.00 83.23 P HETATM 3654 O1 PO4 A1759 65.185 62.176 -8.634 1.00 84.86 O HETATM 3655 O2 PO4 A1759 64.915 62.951 -10.963 1.00 88.37 O HETATM 3656 O3 PO4 A1759 63.120 63.431 -9.348 1.00 73.99 O HETATM 3657 O4 PO4 A1759 63.543 61.098 -10.080 1.00 79.57 O HETATM 3658 N1 EPE A1760 77.902 64.490 -0.234 1.00 82.33 N HETATM 3659 C2 EPE A1760 78.792 65.362 -1.031 1.00 84.48 C HETATM 3660 C3 EPE A1760 80.237 64.891 -0.960 1.00 78.77 C HETATM 3661 N4 EPE A1760 80.262 63.574 -1.638 1.00 78.11 N HETATM 3662 C5 EPE A1760 79.456 62.614 -0.852 1.00 82.68 C HETATM 3663 C6 EPE A1760 78.000 63.097 -0.744 1.00 83.43 C HETATM 3664 C7 EPE A1760 81.604 63.036 -1.992 1.00 77.53 C HETATM 3665 C8 EPE A1760 82.838 63.714 -1.383 1.00 74.05 C HETATM 3666 O8 EPE A1760 82.890 63.455 0.012 1.00 65.60 O HETATM 3667 C9 EPE A1760 76.480 64.916 -0.290 1.00 74.03 C HETATM 3668 C10 EPE A1760 76.165 66.356 0.187 1.00 69.20 C HETATM 3669 S EPE A1760 74.800 66.390 1.189 1.00 61.91 S HETATM 3670 O1S EPE A1760 75.207 65.824 2.493 1.00 58.76 O HETATM 3671 O2S EPE A1760 73.755 65.536 0.558 1.00 70.33 O HETATM 3672 O3S EPE A1760 74.258 67.746 1.381 1.00 49.10 O HETATM 0 H102 EPE A1760 76.929 66.714 0.666 1.00 69.20 H new HETATM 0 H101 EPE A1760 76.018 66.929 -0.582 1.00 69.20 H new HETATM 0 HO8 EPE A1760 82.709 62.647 0.154 1.00 65.60 H new HETATM 0 H92 EPE A1760 76.173 64.827 -1.206 1.00 74.03 H new HETATM 0 H91 EPE A1760 75.958 64.299 0.246 1.00 74.03 H new HETATM 0 H82 EPE A1760 83.643 63.384 -1.812 1.00 74.05 H new HETATM 0 H81 EPE A1760 82.803 64.670 -1.542 1.00 74.05 H new HETATM 0 H72 EPE A1760 81.625 62.100 -1.739 1.00 77.53 H new HETATM 0 H71 EPE A1760 81.692 63.071 -2.957 1.00 77.53 H new HETATM 0 H62 EPE A1760 77.508 62.504 -0.155 1.00 83.43 H new HETATM 0 H61 EPE A1760 77.579 63.044 -1.616 1.00 83.43 H new HETATM 0 H52 EPE A1760 79.483 61.740 -1.272 1.00 82.68 H new HETATM 0 H51 EPE A1760 79.836 62.514 0.035 1.00 82.68 H new HETATM 0 H32 EPE A1760 80.831 65.520 -1.399 1.00 78.77 H new HETATM 0 H31 EPE A1760 80.534 64.815 -0.040 1.00 78.77 H new HETATM 0 H22 EPE A1760 78.497 65.370 -1.955 1.00 84.48 H new HETATM 0 H21 EPE A1760 78.731 66.274 -0.706 1.00 84.48 H new HETATM 3673 C1 EDO A1761 62.292 60.754 12.665 1.00 54.41 C HETATM 3674 O1 EDO A1761 62.356 59.386 12.192 1.00 39.84 O HETATM 3675 C2 EDO A1761 62.329 60.999 14.157 1.00 55.94 C HETATM 3676 O2 EDO A1761 62.110 62.404 14.295 1.00 54.31 O HETATM 0 HO2 EDO A1761 61.847 62.572 15.075 1.00 54.31 H new HETATM 0 HO1 EDO A1761 61.577 59.087 12.093 1.00 39.84 H new HETATM 0 H22 EDO A1761 61.644 60.488 14.616 1.00 55.94 H new HETATM 0 H21 EDO A1761 63.182 60.736 14.537 1.00 55.94 H new HETATM 0 H12 EDO A1761 63.031 61.240 12.267 1.00 54.41 H new HETATM 0 H11 EDO A1761 61.475 61.148 12.321 1.00 54.41 H new HETATM 3677 C1 EDO A1762 59.468 51.141 1.225 1.00 52.30 C HETATM 3678 O1 EDO A1762 59.815 51.388 -0.159 1.00 40.71 O HETATM 3679 C2 EDO A1762 60.439 50.188 1.946 1.00 53.33 C HETATM 3680 O2 EDO A1762 61.537 50.938 2.531 1.00 52.66 O HETATM 0 HO2 EDO A1762 62.111 50.405 2.833 1.00 52.66 H new HETATM 0 HO1 EDO A1762 60.234 52.114 -0.218 1.00 40.71 H new HETATM 0 H22 EDO A1762 59.968 49.699 2.638 1.00 53.33 H new HETATM 0 H21 EDO A1762 60.784 49.532 1.320 1.00 53.33 H new HETATM 0 H12 EDO A1762 59.445 51.986 1.700 1.00 52.30 H new HETATM 0 H11 EDO A1762 58.573 50.769 1.264 1.00 52.30 H new HETATM 3681 C1 EDO A1763 43.599 60.796 -2.044 1.00 49.98 C HETATM 3682 O1 EDO A1763 44.272 61.253 -3.242 1.00 46.61 O HETATM 3683 C2 EDO A1763 42.295 61.576 -1.770 1.00 51.69 C HETATM 3684 O2 EDO A1763 41.164 60.953 -2.409 1.00 52.57 O HETATM 0 HO2 EDO A1763 41.253 60.118 -2.385 1.00 52.57 H new HETATM 0 HO1 EDO A1763 44.003 60.808 -3.902 1.00 46.61 H new HETATM 0 H22 EDO A1763 42.141 61.626 -0.814 1.00 51.69 H new HETATM 0 H21 EDO A1763 42.388 62.487 -2.090 1.00 51.69 H new HETATM 0 H12 EDO A1763 43.396 59.851 -2.130 1.00 49.98 H new HETATM 0 H11 EDO A1763 44.195 60.890 -1.285 1.00 49.98 H new HETATM 3685 C1 EDO A1764 102.329 61.522 18.069 1.00 47.26 C HETATM 3686 O1 EDO A1764 101.496 60.634 17.319 1.00 38.29 O HETATM 3687 C2 EDO A1764 102.370 61.444 19.585 1.00 41.25 C HETATM 3688 O2 EDO A1764 102.220 62.719 20.185 1.00 45.33 O HETATM 0 HO2 EDO A1764 102.524 63.309 19.670 1.00 45.33 H new HETATM 0 HO1 EDO A1764 101.831 59.864 17.324 1.00 38.29 H new HETATM 0 H22 EDO A1764 101.665 60.855 19.897 1.00 41.25 H new HETATM 0 H21 EDO A1764 103.212 61.052 19.866 1.00 41.25 H new HETATM 0 H12 EDO A1764 103.237 61.399 17.751 1.00 47.26 H new HETATM 0 H11 EDO A1764 102.067 62.426 17.836 1.00 47.26 H new HETATM 3689 C1 EDO A1765 91.647 60.764 13.950 1.00 49.86 C HETATM 3690 O1 EDO A1765 90.871 60.121 12.920 1.00 58.34 O HETATM 3691 C2 EDO A1765 90.796 61.220 15.152 1.00 50.93 C HETATM 3692 O2 EDO A1765 90.678 62.666 15.304 1.00 40.75 O HETATM 0 HO2 EDO A1765 89.866 62.883 15.302 1.00 40.75 H new HETATM 0 HO1 EDO A1765 90.929 59.287 13.005 1.00 58.34 H new HETATM 0 H22 EDO A1765 89.907 60.843 15.064 1.00 50.93 H new HETATM 0 H21 EDO A1765 91.181 60.852 15.963 1.00 50.93 H new HETATM 0 H12 EDO A1765 92.333 60.152 14.260 1.00 49.86 H new HETATM 0 H11 EDO A1765 92.102 61.533 13.572 1.00 49.86 H new HETATM 3693 C1 EDO A1766 80.701 64.776 15.490 1.00 54.68 C HETATM 3694 O1 EDO A1766 81.943 64.163 15.101 1.00 48.70 O HETATM 3695 C2 EDO A1766 79.649 63.683 15.715 1.00 55.36 C HETATM 3696 O2 EDO A1766 79.120 63.227 14.457 1.00 55.21 O HETATM 0 HO2 EDO A1766 78.327 63.492 14.373 1.00 55.21 H new HETATM 0 HO1 EDO A1766 82.094 64.326 14.291 1.00 48.70 H new HETATM 0 H22 EDO A1766 80.045 62.939 16.194 1.00 55.36 H new HETATM 0 H21 EDO A1766 78.931 64.027 16.269 1.00 55.36 H new HETATM 0 H12 EDO A1766 80.823 65.294 16.301 1.00 54.68 H new HETATM 0 H11 EDO A1766 80.402 65.391 14.802 1.00 54.68 H new HETATM 3697 C1 EDO A1767 57.270 62.508 3.171 1.00 42.23 C HETATM 3698 O1 EDO A1767 56.385 61.447 3.669 1.00 32.90 O HETATM 3699 C2 EDO A1767 57.259 63.807 3.997 1.00 39.98 C HETATM 3700 O2 EDO A1767 57.228 63.591 5.450 1.00 31.21 O HETATM 0 HO2 EDO A1767 57.353 64.322 5.845 1.00 31.21 H new HETATM 0 HO1 EDO A1767 55.913 61.156 3.038 1.00 32.90 H new HETATM 0 H22 EDO A1767 58.046 64.328 3.774 1.00 39.98 H new HETATM 0 H21 EDO A1767 56.487 64.335 3.741 1.00 39.98 H new HETATM 0 H12 EDO A1767 58.177 62.167 3.143 1.00 42.23 H new HETATM 0 H11 EDO A1767 57.018 62.719 2.258 1.00 42.23 H new HETATM 3701 O HOH A2001 96.987 81.461 8.719 1.00 55.74 O HETATM 3702 O HOH A2002 91.914 85.495 9.584 1.00 57.63 O HETATM 3703 O HOH A2003 94.983 84.487 9.354 1.00 49.88 O HETATM 3704 O HOH A2004 92.126 80.114 14.649 1.00 44.79 O HETATM 3705 O HOH A2005 95.391 78.417 15.171 1.00 40.34 O HETATM 3706 O HOH A2006 91.309 84.448 14.211 1.00 49.16 O HETATM 3707 O HOH A2007 89.709 85.764 16.126 1.00 50.51 O HETATM 3708 O HOH A2008 87.065 82.732 27.572 1.00 49.39 O HETATM 3709 O HOH A2009 71.720 78.747 19.593 1.00 51.25 O HETATM 3710 O HOH A2010 78.923 78.227 7.874 1.00 36.11 O HETATM 3711 O HOH A2011 77.532 80.631 5.389 1.00 45.30 O HETATM 3712 O HOH A2012 74.375 78.878 10.095 1.00 58.70 O HETATM 3713 O HOH A2013 83.836 84.020 4.194 1.00 46.75 O HETATM 3714 O HOH A2014 78.052 85.198 2.247 1.00 61.32 O HETATM 3715 O HOH A2015 94.453 68.006 -7.174 1.00 57.74 O HETATM 3716 O HOH A2016 94.677 77.777 20.361 1.00 46.41 O HETATM 3717 O HOH A2017 94.573 80.964 18.177 1.00 52.42 O HETATM 3718 O HOH A2018 89.617 76.709 30.809 1.00 42.98 O HETATM 3719 O HOH A2019 91.881 79.840 36.432 1.00 66.97 O HETATM 3720 O HOH A2020 88.588 73.642 29.182 1.00 51.59 O HETATM 3721 O HOH A2021 91.529 73.159 38.227 1.00 69.11 O HETATM 3722 O HOH A2022 88.385 66.990 30.162 1.00 41.68 O HETATM 3723 O HOH A2023 89.313 69.618 29.945 1.00 63.17 O HETATM 3724 O HOH A2024 90.512 70.543 32.450 1.00 73.36 O HETATM 3725 O HOH A2025 93.646 65.449 31.853 1.00 58.94 O HETATM 3726 O HOH A2026 86.859 61.809 32.501 1.00 60.42 O HETATM 3727 O HOH A2027 86.982 57.585 32.012 1.00 70.96 O HETATM 3728 O HOH A2028 95.552 55.604 34.188 1.00 56.07 O HETATM 3729 O HOH A2029 94.345 49.165 35.667 1.00 53.15 O HETATM 3730 O HOH A2030 96.288 52.316 35.109 1.00 58.54 O HETATM 3731 O HOH A2031 91.733 51.385 37.802 1.00 50.77 O HETATM 3732 O HOH A2032 95.579 46.501 30.185 1.00 60.36 O HETATM 3733 O HOH A2033 97.643 48.830 28.684 1.00 42.62 O HETATM 3734 O HOH A2034 88.882 46.417 20.897 1.00 60.57 O HETATM 3735 O HOH A2035 86.366 50.103 19.471 1.00 62.77 O HETATM 3736 O HOH A2036 87.742 53.063 16.659 1.00 59.87 O HETATM 3737 O HOH A2037 87.830 52.923 13.636 1.00 58.96 O HETATM 3738 O HOH A2038 89.855 54.212 8.636 1.00 64.10 O HETATM 3739 O HOH A2039 92.465 54.614 4.111 1.00 53.20 O HETATM 3740 O HOH A2040 93.585 57.854 1.632 1.00 53.57 O HETATM 3741 O HOH A2041 91.997 60.268 1.080 1.00 39.89 O HETATM 3742 O HOH A2042 99.390 60.066 -2.767 1.00 56.92 O HETATM 3743 O HOH A2043 98.657 68.221 -0.859 1.00 46.26 O HETATM 3744 O HOH A2044 94.090 68.814 -4.453 1.00 47.98 O HETATM 3745 O HOH A2045 87.773 54.015 4.178 1.00 63.17 O HETATM 3746 O HOH A2046 84.307 56.083 11.712 1.00 56.59 O HETATM 3747 O HOH A2047 76.833 64.096 6.251 1.00 46.94 O HETATM 3748 O HOH A2048 77.344 63.768 11.225 1.00 35.70 O HETATM 3749 O HOH A2049 102.257 57.648 25.506 1.00 60.60 O HETATM 3750 O HOH A2050 106.441 55.028 22.831 1.00 49.99 O HETATM 3751 O HOH A2051 102.469 49.118 28.161 1.00 61.07 O HETATM 3752 O HOH A2052 105.148 53.564 16.539 1.00 57.14 O HETATM 3753 O HOH A2053 108.169 58.524 22.309 1.00 59.46 O HETATM 3754 O HOH A2054 102.148 62.183 23.424 1.00 43.83 O HETATM 3755 O HOH A2055 107.542 56.475 12.101 1.00 51.33 O HETATM 3756 O HOH A2056 103.541 68.942 16.571 1.00 35.61 O HETATM 3757 O HOH A2057 113.526 60.494 18.009 1.00 57.64 O HETATM 3758 O HOH A2058 107.827 59.961 5.147 1.00 41.53 O HETATM 3759 O HOH A2059 120.085 61.260 15.765 1.00 58.48 O HETATM 3760 O HOH A2060 116.580 65.680 15.103 1.00 49.87 O HETATM 3761 O HOH A2061 109.080 66.035 23.792 1.00 50.73 O HETATM 3762 O HOH A2062 108.846 62.346 21.564 1.00 62.87 O HETATM 3763 O HOH A2063 104.702 74.904 16.869 1.00 53.67 O HETATM 3764 O HOH A2064 104.818 75.937 14.120 1.00 54.15 O HETATM 3765 O HOH A2065 100.600 75.847 12.778 1.00 51.84 O HETATM 3766 O HOH A2066 102.441 74.687 7.632 1.00 38.86 O HETATM 3767 O HOH A2067 100.188 76.590 10.266 1.00 50.46 O HETATM 3768 O HOH A2068 103.799 70.912 2.021 1.00 44.43 O HETATM 3769 O HOH A2069 108.100 68.637 5.138 1.00 55.01 O HETATM 3770 O HOH A2070 109.704 61.282 -0.147 1.00 65.70 O HETATM 3771 O HOH A2071 108.055 65.469 -1.586 1.00 64.50 O HETATM 3772 O HOH A2072 99.986 69.446 -3.153 1.00 60.76 O HETATM 3773 O HOH A2073 103.512 54.236 7.681 1.00 51.33 O HETATM 3774 O HOH A2074 87.811 55.795 19.996 1.00 64.11 O HETATM 3775 O HOH A2075 84.948 52.552 14.346 1.00 65.13 O HETATM 3776 O HOH A2076 79.158 58.682 23.496 1.00 62.65 O HETATM 3777 O HOH A2077 86.938 58.620 28.896 1.00 69.53 O HETATM 3778 O HOH A2078 99.691 79.154 10.032 1.00 62.42 O HETATM 3779 O HOH A2079 82.907 65.468 38.578 1.00 59.16 O HETATM 3780 O HOH A2080 73.830 62.734 24.841 1.00 66.86 O HETATM 3781 O HOH A2081 68.002 73.658 26.605 1.00 66.72 O HETATM 3782 O HOH A2082 65.474 71.884 21.190 1.00 56.63 O HETATM 3783 O HOH A2083 64.761 74.795 24.543 1.00 58.02 O HETATM 3784 O HOH A2084 67.659 75.589 20.391 1.00 46.49 O HETATM 3785 O HOH A2085 67.007 62.275 24.133 1.00 58.28 O HETATM 3786 O HOH A2086 59.812 64.642 22.341 1.00 57.87 O HETATM 3787 O HOH A2087 56.577 58.691 18.685 1.00 68.18 O HETATM 3788 O HOH A2088 66.131 57.149 12.786 1.00 49.06 O HETATM 3789 O HOH A2089 72.147 57.554 14.119 1.00 63.90 O HETATM 3790 O HOH A2090 76.621 62.094 13.167 1.00 47.59 O HETATM 3791 O HOH A2091 76.524 62.999 17.835 1.00 58.24 O HETATM 3792 O HOH A2092 91.276 63.259 18.405 1.00 32.85 O HETATM 3793 O HOH A2093 82.577 60.251 13.150 1.00 60.57 O HETATM 3794 O HOH A2094 92.117 65.500 6.034 1.00 42.63 O HETATM 3795 O HOH A2095 87.530 60.638 7.563 1.00 49.89 O HETATM 3796 O HOH A2096 85.298 64.403 1.183 1.00 31.05 O HETATM 3797 O HOH A2097 91.576 67.167 3.762 1.00 33.66 O HETATM 3798 O HOH A2098 81.790 65.064 12.308 1.00 30.87 O HETATM 3799 O HOH A2099 79.703 64.976 4.090 1.00 35.14 O HETATM 3800 O HOH A2100 76.862 70.559 8.860 1.00 32.13 O HETATM 3801 O HOH A2101 74.683 65.966 5.074 1.00 35.66 O HETATM 3802 O HOH A2102 74.241 59.584 12.457 1.00 69.23 O HETATM 3803 O HOH A2103 66.514 67.611 8.896 1.00 31.38 O HETATM 3804 O HOH A2104 72.281 78.200 11.714 1.00 58.68 O HETATM 3805 O HOH A2105 72.530 79.183 16.724 1.00 71.23 O HETATM 3806 O HOH A2106 94.357 80.322 26.270 1.00 70.41 O HETATM 3807 O HOH A2107 97.016 70.677 22.731 1.00 33.01 O HETATM 3808 O HOH A2108 60.732 70.565 1.962 1.00 57.54 O HETATM 3809 O HOH A2109 80.832 74.401 3.324 1.00 39.00 O HETATM 3810 O HOH A2110 78.727 61.016 1.737 1.00 79.64 O HETATM 3811 O HOH A2111 74.307 77.335 3.803 1.00 56.30 O HETATM 3812 O HOH A2112 76.431 76.291 -1.209 1.00 54.36 O HETATM 3813 O HOH A2113 74.798 76.629 1.092 1.00 58.03 O HETATM 3814 O HOH A2114 78.535 77.315 -3.002 1.00 54.20 O HETATM 3815 O HOH A2115 75.052 79.635 -0.996 1.00 63.31 O HETATM 3816 O HOH A2116 83.617 84.298 -0.418 1.00 60.09 O HETATM 3817 O HOH A2117 62.044 55.612 14.289 1.00 63.61 O HETATM 3818 O HOH A2118 71.813 74.873 -2.170 1.00 64.10 O HETATM 3819 O HOH A2119 83.551 75.909 -7.383 1.00 49.94 O HETATM 3820 O HOH A2120 76.979 66.050 -3.453 1.00 58.97 O HETATM 3821 O HOH A2121 63.620 79.729 11.701 1.00 72.96 O HETATM 3822 O HOH A2122 83.680 64.961 -12.899 1.00 61.27 O HETATM 3823 O HOH A2123 70.251 49.912 1.890 1.00 68.42 O HETATM 3824 O HOH A2124 74.623 57.842 3.207 1.00 85.81 O HETATM 3825 O HOH A2125 78.957 54.249 -2.051 1.00 64.54 O HETATM 3826 O HOH A2126 99.389 72.293 -3.393 1.00 60.32 O HETATM 3827 O HOH A2127 96.789 72.423 -4.332 1.00 55.31 O HETATM 3828 O HOH A2128 94.172 70.257 -9.085 1.00 56.63 O HETATM 3829 O HOH A2129 90.667 81.515 2.492 1.00 49.87 O HETATM 3830 O HOH A2130 96.914 77.229 19.148 1.00 49.18 O HETATM 3831 O HOH A2131 98.135 77.700 16.706 1.00 68.21 O HETATM 3832 O HOH A2132 96.135 74.006 25.782 1.00 49.05 O HETATM 3833 O HOH A2133 93.072 77.689 25.789 1.00 59.59 O HETATM 3834 O HOH A2134 79.457 71.051 9.458 1.00 37.63 O HETATM 3835 O HOH A2135 76.220 77.633 8.199 1.00 39.70 O HETATM 3836 O HOH A2136 62.371 68.591 3.106 1.00 37.40 O HETATM 3837 O HOH A2137 57.380 67.847 3.958 1.00 48.15 O HETATM 3838 O HOH A2138 69.423 74.806 0.711 1.00 64.80 O HETATM 3839 O HOH A2139 65.227 62.993 1.759 1.00 37.42 O HETATM 3840 O HOH A2140 62.577 72.513 1.304 1.00 60.70 O HETATM 3841 O HOH A2141 68.796 70.848 -3.015 1.00 57.77 O HETATM 3842 O HOH A2142 66.229 61.163 0.320 1.00 34.90 O HETATM 3843 O HOH A2143 64.184 63.306 -6.196 1.00 47.09 O HETATM 3844 O HOH A2144 61.280 64.163 1.865 1.00 52.27 O HETATM 3845 O HOH A2145 62.027 65.064 -5.831 1.00 54.64 O HETATM 3846 O HOH A2146 73.008 57.880 1.210 1.00 64.67 O HETATM 3847 O HOH A2147 73.056 60.801 4.583 1.00 68.37 O HETATM 3848 O HOH A2148 76.371 58.717 0.697 1.00 67.49 O HETATM 3849 O HOH A2149 77.120 64.288 3.601 1.00 50.98 O HETATM 3850 O HOH A2150 65.942 57.528 4.402 1.00 38.03 O HETATM 3851 O HOH A2151 65.475 57.950 8.605 1.00 37.52 O HETATM 3852 O HOH A2152 64.069 63.657 6.800 1.00 49.75 O HETATM 3853 O HOH A2153 68.989 56.379 10.912 1.00 51.16 O HETATM 3854 O HOH A2154 59.601 62.627 6.388 1.00 33.10 O HETATM 3855 O HOH A2155 60.837 64.929 6.455 1.00 32.48 O HETATM 3856 O HOH A2156 57.655 60.090 16.477 1.00 44.47 O HETATM 3857 O HOH A2157 59.838 56.641 14.703 1.00 37.56 O HETATM 3858 O HOH A2158 61.399 77.723 11.422 1.00 45.67 O HETATM 3859 O HOH A2159 56.398 79.723 7.801 1.00 50.02 O HETATM 3860 O HOH A2160 61.500 76.088 7.552 1.00 46.54 O HETATM 3861 O HOH A2161 49.585 74.752 -0.659 1.00 47.78 O HETATM 3862 O HOH A2162 54.972 70.767 -2.202 1.00 47.33 O HETATM 3863 O HOH A2163 54.453 63.988 1.769 1.00 51.07 O HETATM 3864 O HOH A2164 45.459 68.905 -0.396 1.00 43.56 O HETATM 3865 O HOH A2165 45.102 76.023 -2.294 1.00 77.28 O HETATM 3866 O HOH A2166 49.201 71.514 -6.029 1.00 56.03 O HETATM 3867 O HOH A2167 45.408 63.461 -2.099 1.00 42.95 O HETATM 3868 O HOH A2168 50.459 63.773 7.345 1.00 32.15 O HETATM 3869 O HOH A2169 43.385 67.963 -6.173 1.00 53.13 O HETATM 3870 O HOH A2170 48.775 66.017 -11.051 1.00 54.53 O HETATM 3871 O HOH A2171 39.356 62.676 -3.386 1.00 53.24 O HETATM 3872 O HOH A2172 43.106 64.976 -13.208 1.00 38.30 O HETATM 3873 O HOH A2173 41.889 57.245 -11.223 1.00 54.08 O HETATM 3874 O HOH A2174 43.149 55.155 -5.657 1.00 40.21 O HETATM 3875 O HOH A2175 40.130 58.732 0.026 1.00 45.89 O HETATM 3876 O HOH A2176 39.487 55.926 0.805 1.00 56.78 O HETATM 3877 O HOH A2177 40.120 55.364 4.898 1.00 68.00 O HETATM 3878 O HOH A2178 41.087 58.130 4.457 1.00 51.63 O HETATM 3879 O HOH A2179 42.078 55.766 7.537 1.00 46.09 O HETATM 3880 O HOH A2180 41.643 59.876 8.915 1.00 64.67 O HETATM 3881 O HOH A2181 60.143 53.029 14.590 1.00 56.52 O HETATM 3882 O HOH A2182 61.413 54.145 12.012 1.00 44.19 O HETATM 3883 O HOH A2183 65.365 50.260 9.608 1.00 56.67 O HETATM 3884 O HOH A2184 63.535 57.226 12.019 1.00 50.83 O HETATM 3885 O HOH A2185 64.785 50.559 1.648 1.00 64.75 O HETATM 3886 O HOH A2186 62.893 45.971 8.849 1.00 57.60 O HETATM 3887 O HOH A2187 56.456 49.299 4.253 1.00 44.23 O HETATM 3888 O HOH A2188 48.217 49.740 -1.081 1.00 38.22 O HETATM 3889 O HOH A2189 53.237 49.326 -2.533 1.00 42.41 O HETATM 3890 O HOH A2190 55.897 46.872 -12.207 1.00 59.52 O HETATM 3891 O HOH A2191 55.786 62.700 0.075 1.00 39.76 O HETATM 3892 O HOH A2192 56.043 60.729 -9.895 1.00 52.18 O HETATM 3893 O HOH A2193 57.477 69.603 -1.506 1.00 62.32 O HETATM 3894 O HOH A2194 54.000 54.271 -10.319 1.00 40.58 O HETATM 3895 O HOH A2195 59.209 50.116 -7.704 1.00 56.40 O HETATM 3896 O HOH A2196 44.379 56.198 -12.819 1.00 62.24 O HETATM 3897 O HOH A2197 40.256 65.114 9.996 1.00 53.85 O HETATM 3898 O HOH A2198 41.587 67.485 6.025 1.00 54.94 O HETATM 3899 O HOH A2199 39.544 65.596 7.169 1.00 63.55 O HETATM 3900 O HOH A2200 44.039 76.665 14.195 1.00100.16 O HETATM 3901 O HOH A2201 46.704 76.688 12.423 1.00 49.44 O HETATM 3902 O HOH A2202 44.977 74.289 19.032 1.00 64.30 O HETATM 3903 O HOH A2203 88.454 61.231 12.927 1.00 59.34 O HETATM 3904 O HOH A2204 62.154 50.158 -0.985 1.00 53.01 O CONECT 553 3651 CONECT 965 3651 CONECT 989 3651 CONECT 1564 3652 CONECT 1581 3652 CONECT 2297 3652 CONECT 3147 3639 CONECT 3169 3639 CONECT 3248 3640 CONECT 3260 3640 CONECT 3309 3639 CONECT 3334 3639 CONECT 3372 3640 CONECT 3384 3640 CONECT 3639 3147 3169 3309 3334 CONECT 3640 3248 3260 3372 3384 CONECT 3641 3642 3645 3646 CONECT 3642 3641 3647 3649 CONECT 3643 3644 3649 CONECT 3644 3643 3648 3650 CONECT 3645 3641 3652 CONECT 3646 3641 CONECT 3647 3642 3652 CONECT 3648 3644 CONECT 3649 3642 3643 CONECT 3650 3644 CONECT 3651 553 965 989 CONECT 3652 1564 1581 2297 3645 CONECT 3652 3647 3798 CONECT 3653 3654 3655 3656 3657 CONECT 3654 3653 CONECT 3655 3653 CONECT 3656 3653 CONECT 3657 3653 CONECT 3658 3659 3663 3667 CONECT 3659 3658 3660 CONECT 3660 3659 3661 CONECT 3661 3660 3662 3664 CONECT 3662 3661 3663 CONECT 3663 3658 3662 CONECT 3664 3661 3665 CONECT 3665 3664 3666 CONECT 3666 3665 CONECT 3667 3658 3668 CONECT 3668 3667 3669 CONECT 3669 3668 3670 3671 3672 CONECT 3670 3669 CONECT 3671 3669 CONECT 3672 3669 CONECT 3673 3674 3675 CONECT 3674 3673 CONECT 3675 3673 3676 CONECT 3676 3675 CONECT 3677 3678 3679 CONECT 3678 3677 CONECT 3679 3677 3680 CONECT 3680 3679 CONECT 3681 3682 3683 CONECT 3682 3681 CONECT 3683 3681 3684 CONECT 3684 3683 CONECT 3685 3686 3687 CONECT 3686 3685 CONECT 3687 3685 3688 CONECT 3688 3687 CONECT 3689 3690 3691 CONECT 3690 3689 CONECT 3691 3689 3692 CONECT 3692 3691 CONECT 3693 3694 3695 CONECT 3694 3693 CONECT 3695 3693 3696 CONECT 3696 3695 CONECT 3697 3698 3699 CONECT 3698 3697 CONECT 3699 3697 3700 CONECT 3700 3699 CONECT 3798 3652 END