USER MOD reduce.3.24.130724 H: found=0, std=0, add=3173, rem=0, adj=109 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER HYDROLASE 18-MAY-07 2PZF TITLE MINIMAL HUMAN CFTR FIRST NUCLEOTIDE BINDING DOMAIN AS A HEAD-TO-TAIL TITLE 2 DIMER WITH DELTA F508 COMPND MOL_ID: 1; COMPND 2 MOLECULE: CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: CFTR NBD1 387-646(DEL405-436,DELF508); COMPND 5 SYNONYM: CFTR, CAMP- DEPENDENT CHLORIDE CHANNEL, ATP-BINDING CASSETT COMPND 6 TRANSPORTER SUB- FAMILY C MEMBER 7; COMPND 7 ENGINEERED: YES; COMPND 8 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: CFTR, ABCC7; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3) CODON+RIL; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: MODIFIED PET26B KEYWDS NBD, ABC TRANSPORTER, CFTR, F508, HYDROLASE EXPDTA X-RAY DIFFRACTION AUTHOR S.ATWELL,K.CONNERS,S.EMTAGE,T.GHEYI,N.R.GLENN,J.HENDLE,H.A.LEWIS, AUTHOR 2 F.LU,L.A.RODGERS,R.ROMERO,J.M.SAUDER,D.SMITH,H.TIEN,S.R.WASSERMAN, AUTHOR 3 X.ZHAO REVDAT 7 13-JUL-11 2PZF 1 VERSN REVDAT 6 30-JUN-10 2PZF 1 JRNL REVDAT 5 24-FEB-09 2PZF 1 VERSN REVDAT 4 30-SEP-08 2PZF 1 REVDAT 3 26-AUG-08 2PZF 1 JRNL REVDAT 2 05-AUG-08 2PZF 1 REMARK REVDAT 1 09-OCT-07 2PZF 0 JRNL AUTH S.ATWELL,C.G.BROUILLETTE,K.CONNERS,S.EMTAGE,T.GHEYI, JRNL AUTH 2 W.B.GUGGINO,J.HENDLE,J.F.HUNT,H.A.LEWIS,F.LU, JRNL AUTH 3 I.I.PROTASEVICH,L.A.RODGERS,R.ROMERO,S.R.WASSERMAN, JRNL AUTH 4 P.C.WEBER,D.WETMORE,F.F.ZHANG,X.ZHAO JRNL TITL STRUCTURES OF A MINIMAL HUMAN CFTR FIRST NUCLEOTIDE-BINDING JRNL TITL 2 DOMAIN AS A MONOMER, HEAD-TO-TAIL HOMODIMER, AND PATHOGENIC JRNL TITL 3 MUTANT. JRNL REF PROTEIN ENG.DES.SEL. V. 23 375 2010 JRNL REFN ISSN 1741-0126 JRNL PMID 20150177 JRNL DOI 10.1093/PROTEIN/GZQ004 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH S.ATWELL,K.CONNERS,S.EMTAGE,T.GHEYI,H.LEWIS,F.LU,R.ROMERO, REMARK 1 AUTH 2 X.ZHAO REMARK 1 TITL STRUCTURE OF THE HUMAN CFTR NBD1 DOMAIN AS A HOMODIMER: REMARK 1 TITL 2 INSIGHTS AND APPLICATIONS REMARK 1 REF PEDIATR.PULMONOL.SUPPL. V. 30 100 2007 REMARK 1 REFN ISSN 1054-187X REMARK 1 PMID 17729305 REMARK 1 DOI 10.1002/PPUL.20699 REMARK 2 REMARK 2 RESOLUTION. 2.00 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC5 REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.00 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 25.12 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 98.4 REMARK 3 NUMBER OF REFLECTIONS : 29187 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : FREE R-VALUE REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.213 REMARK 3 R VALUE (WORKING SET) : 0.211 REMARK 3 FREE R VALUE : 0.251 REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 FREE R VALUE TEST SET COUNT : 1493 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3254 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 64 REMARK 3 SOLVENT ATOMS : 130 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 28.60 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 29.02 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.91300 REMARK 3 B22 (A**2) : 0.58700 REMARK 3 B33 (A**2) : -1.49900 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): NULL REMARK 3 ESU BASED ON FREE R VALUE (A): NULL REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): NULL REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 DISTANCE RESTRAINTS. RMS SIGMA REMARK 3 BOND LENGTH (A) : NULL ; NULL REMARK 3 ANGLE DISTANCE (A) : NULL ; NULL REMARK 3 INTRAPLANAR 1-4 DISTANCE (A) : NULL ; NULL REMARK 3 H-BOND OR METAL COORDINATION (A) : NULL ; NULL REMARK 3 REMARK 3 PLANE RESTRAINT (A) : NULL ; NULL REMARK 3 CHIRAL-CENTER RESTRAINT (A**3) : NULL ; NULL REMARK 3 REMARK 3 NON-BONDED CONTACT RESTRAINTS. REMARK 3 SINGLE TORSION (A) : NULL ; NULL REMARK 3 MULTIPLE TORSION (A) : NULL ; NULL REMARK 3 H-BOND (X...Y) (A) : NULL ; NULL REMARK 3 H-BOND (X-H...Y) (A) : NULL ; NULL REMARK 3 REMARK 3 CONFORMATIONAL TORSION ANGLE RESTRAINTS. REMARK 3 SPECIFIED (DEGREES) : NULL ; NULL REMARK 3 PLANAR (DEGREES) : NULL ; NULL REMARK 3 STAGGERED (DEGREES) : NULL ; NULL REMARK 3 TRANSVERSE (DEGREES) : NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2PZF COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 21-MAY-07. REMARK 100 THE RCSB ID CODE IS RCSB042956. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 18-FEB-07 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 8.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 31-ID REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.9797 REMARK 200 MONOCHROMATOR : DIAMOND REMARK 200 OPTICS : MIRRORS REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MAR CCD 165 MM REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MOSFLM REMARK 200 DATA SCALING SOFTWARE : SCALA REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 29245 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.000 REMARK 200 RESOLUTION RANGE LOW (A) : 25.583 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 98.6 REMARK 200 DATA REDUNDANCY : 6.500 REMARK 200 R MERGE (I) : 0.12700 REMARK 200 R SYM (I) : 0.12700 REMARK 200 FOR THE DATA SET : 4.1000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.00 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.11 REMARK 200 COMPLETENESS FOR SHELL (%) : 96.9 REMARK 200 DATA REDUNDANCY IN SHELL : 6.30 REMARK 200 R MERGE FOR SHELL (I) : 0.78600 REMARK 200 R SYM FOR SHELL (I) : 0.78600 REMARK 200 FOR SHELL : 0.900 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: MOLREP REMARK 200 STARTING MODEL: PDB ENTRY 2PZE REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 41.33 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.10 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PROTEIN: 9.5MG/ML NBD1, 0.15M NACL, REMARK 280 0.01M METHIONINE, 0.01M HEPES PH 7.5, 10% GLYCEROL, 0.001M TCEP, REMARK 280 0.002M ATP; WELL: 0.1M TRIS PH 8.5, 35% PEG 4K, 0.2M NAACETATE; REMARK 280 CRYO: 25% DMSO, VAPOR DIFFUSION, TEMPERATURE 281K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 21.57600 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 53.23550 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 46.33100 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 53.23550 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 21.57600 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 46.33100 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2, 3 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 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 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 3 REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA,PQS REMARK 350 TOTAL BURIED SURFACE AREA: 4200 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 18650 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -41.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 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 GLU A 402 REMARK 465 GLU A 403 REMARK 465 GLN A 637 REMARK 465 PRO A 638 REMARK 465 SER B 386 REMARK 465 LEU B 387 REMARK 465 GLN B 637 REMARK 465 PRO B 638 REMARK 465 ASP B 639 REMARK 465 PHE B 640 REMARK 465 SER B 641 REMARK 465 SER B 642 REMARK 465 LYS B 643 REMARK 465 LEU B 644 REMARK 465 MET B 645 REMARK 465 GLY B 646 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 THR A 388 OG1 CG2 REMARK 470 THR A 389 OG1 CG2 REMARK 470 LYS A 442 CG CD CE NZ REMARK 470 LYS A 447 CG CD CE NZ REMARK 470 ARG A 450 NE CZ NH1 NH2 REMARK 470 LYS A 481 CG CD CE NZ REMARK 470 LYS A 483 CG CD CE NZ REMARK 470 TYR A 512 CG CD1 CD2 CE1 CE2 CZ OH REMARK 470 GLU A 528 CG CD OE1 OE2 REMARK 470 LYS A 532 CG CD CE NZ REMARK 470 PHE A 533 CG CD1 CD2 CE1 CE2 CZ REMARK 470 GLU A 535 CG CD OE1 OE2 REMARK 470 LYS A 536 CG CD CE NZ REMARK 470 ASP A 537 CG OD1 OD2 REMARK 470 ASN A 538 CG OD1 REMARK 470 ILE A 539 CG1 CG2 CD1 REMARK 470 GLU A 543 CG CD OE1 OE2 REMARK 470 LYS A 584 CD CE NZ REMARK 470 GLU A 588 CG CD OE1 OE2 REMARK 470 SER A 605 OG REMARK 470 GLU A 608 CG CD OE1 OE2 REMARK 470 LYS A 611 CG CD CE NZ REMARK 470 LYS A 612 CD CE NZ REMARK 470 ASN A 635 CG OD1 REMARK 470 SER A 642 OG REMARK 470 LYS A 643 CG CD CE NZ REMARK 470 THR B 389 OG1 CG2 REMARK 470 GLU B 395 CG CD OE1 OE2 REMARK 470 GLU B 402 CG CD OE1 OE2 REMARK 470 GLU B 403 CG CD OE1 OE2 REMARK 470 LYS B 442 CG CD CE NZ REMARK 470 ASP B 443 CG OD1 OD2 REMARK 470 ARG B 450 NE CZ NH1 NH2 REMARK 470 GLU B 479 CG CD OE1 OE2 REMARK 470 LYS B 481 CD CE NZ REMARK 470 LYS B 483 CG CD CE NZ REMARK 470 VAL B 510 CG1 CG2 REMARK 470 SER B 511 OG REMARK 470 GLU B 514 CG CD OE1 OE2 REMARK 470 ARG B 518 CG CD NE CZ NH1 NH2 REMARK 470 GLU B 528 CG CD OE1 OE2 REMARK 470 LYS B 532 CG CD CE NZ REMARK 470 LYS B 536 CG CD CE NZ REMARK 470 ILE B 546 CG1 CG2 CD1 REMARK 470 LYS B 593 CD CE NZ REMARK 470 LYS B 606 CE NZ REMARK 470 MET B 607 SD CE REMARK 470 GLU B 608 CG CD OE1 OE2 REMARK 470 LYS B 612 CD CE NZ REMARK 470 GLN B 634 CG CD OE1 NE2 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 LYS A 536 -124.11 60.42 REMARK 500 CYS A 590 -66.66 -93.92 REMARK 500 LYS A 593 -63.25 -101.15 REMARK 500 SER B 531 2.94 -68.81 REMARK 500 LYS B 536 -131.02 47.90 REMARK 500 CYS B 590 -68.77 -90.04 REMARK 500 LYS B 593 -63.42 -103.90 REMARK 500 GLU B 621 48.14 39.42 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MG A 3 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MG B 4 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ATP A 1 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ATP B 2 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1XMI RELATED DB: PDB REMARK 900 HUMAN CFTR NBD1 389-678(F429S,F508A,H667R) REMARK 900 RELATED ID: 1XMJ RELATED DB: PDB REMARK 900 HUMAN CFTR NBD1 389-678(F409L,F429S,F433L,DEL508,G550E, REMARK 900 R553Q,R555K,H667R) REMARK 900 RELATED ID: 2BB0 RELATED DB: PDB REMARK 900 HUMAN CFTR NBD1 389-678(F409L,F429S,F433L,G550E,R553Q, REMARK 900 R555K,H667R) REMARK 900 RELATED ID: 2BBS RELATED DB: PDB REMARK 900 HUMAN CFTR NBD1 389-678(F429S,F494N,DEL508,Q637R) REMARK 900 RELATED ID: 2BBT RELATED DB: PDB REMARK 900 HUMAN CFTR NBD1 389-678(F494N,DEL508,Q637R) REMARK 900 RELATED ID: 1R0Z RELATED DB: PDB REMARK 900 MOUSE CFTR NBD1 389-673 REMARK 900 RELATED ID: 1R10 RELATED DB: PDB REMARK 900 MOUSE CFTR NBD1 389-673 REMARK 900 RELATED ID: 2IXE RELATED DB: PDB REMARK 900 HOMODIMER OF HUMAN TAP1 NBD(D645N) WITH ATP REMARK 900 RELATED ID: 1L2T RELATED DB: PDB REMARK 900 HOMODIMER OF METHANOCOCCUS JANNASCHII MJ0796(E171Q) REMARK 900 RELATED ID: 1Q12 RELATED DB: PDB REMARK 900 HOMODIMER OF E. COLI MALK REMARK 900 RELATED ID: 1XEF RELATED DB: PDB REMARK 900 HOMODIMER OF E. COLI HLYB NBD 467-707(H662A) REMARK 900 RELATED ID: 2HYD RELATED DB: PDB REMARK 900 HOMODIMER OF S. AUREUS ABC TRANSPORTER SAV1866 REMARK 900 RELATED ID: 2PZE RELATED DB: PDB REMARK 900 HUMAN NBD1 387-646(DEL 405-436) REMARK 900 RELATED ID: 2PZG RELATED DB: PDB REMARK 900 HUMAN NBD1 375-646(DEL 405-436) DBREF 2PZF A 387 404 UNP P13569 CFTR_HUMAN 387 404 DBREF 2PZF A 437 646 UNP P13569 CFTR_HUMAN 437 646 DBREF 2PZF B 387 404 UNP P13569 CFTR_HUMAN 387 404 DBREF 2PZF B 437 646 UNP P13569 CFTR_HUMAN 437 646 SEQADV 2PZF SER A 386 UNP P13569 EXPRESSION TAG SEQADV 2PZF A UNP P13569 PHE 508 DELETION SEQADV 2PZF MET A 470 UNP P13569 VAL 470 VARIANT SEQADV 2PZF SER B 386 UNP P13569 EXPRESSION TAG SEQADV 2PZF B UNP P13569 PHE 508 DELETION SEQADV 2PZF MET B 470 UNP P13569 VAL 470 VARIANT SEQRES 1 A 228 SER LEU THR THR THR GLU VAL VAL MET GLU ASN VAL THR SEQRES 2 A 228 ALA PHE TRP GLU GLU GLY GLY THR PRO VAL LEU LYS ASP SEQRES 3 A 228 ILE ASN PHE LYS ILE GLU ARG GLY GLN LEU LEU ALA VAL SEQRES 4 A 228 ALA GLY SER THR GLY ALA GLY LYS THR SER LEU LEU MET SEQRES 5 A 228 MET ILE MET GLY GLU LEU GLU PRO SER GLU GLY LYS ILE SEQRES 6 A 228 LYS HIS SER GLY ARG ILE SER PHE CYS SER GLN PHE SER SEQRES 7 A 228 TRP ILE MET PRO GLY THR ILE LYS GLU ASN ILE ILE GLY SEQRES 8 A 228 VAL SER TYR ASP GLU TYR ARG TYR ARG SER VAL ILE LYS SEQRES 9 A 228 ALA CYS GLN LEU GLU GLU ASP ILE SER LYS PHE ALA GLU SEQRES 10 A 228 LYS ASP ASN ILE VAL LEU GLY GLU GLY GLY ILE THR LEU SEQRES 11 A 228 SER GLY GLY GLN ARG ALA ARG ILE SER LEU ALA ARG ALA SEQRES 12 A 228 VAL TYR LYS ASP ALA ASP LEU TYR LEU LEU ASP SER PRO SEQRES 13 A 228 PHE GLY TYR LEU ASP VAL LEU THR GLU LYS GLU ILE PHE SEQRES 14 A 228 GLU SER CYS VAL CYS LYS LEU MET ALA ASN LYS THR ARG SEQRES 15 A 228 ILE LEU VAL THR SER LYS MET GLU HIS LEU LYS LYS ALA SEQRES 16 A 228 ASP LYS ILE LEU ILE LEU HIS GLU GLY SER SER TYR PHE SEQRES 17 A 228 TYR GLY THR PHE SER GLU LEU GLN ASN LEU GLN PRO ASP SEQRES 18 A 228 PHE SER SER LYS LEU MET GLY SEQRES 1 B 228 SER LEU THR THR THR GLU VAL VAL MET GLU ASN VAL THR SEQRES 2 B 228 ALA PHE TRP GLU GLU GLY GLY THR PRO VAL LEU LYS ASP SEQRES 3 B 228 ILE ASN PHE LYS ILE GLU ARG GLY GLN LEU LEU ALA VAL SEQRES 4 B 228 ALA GLY SER THR GLY ALA GLY LYS THR SER LEU LEU MET SEQRES 5 B 228 MET ILE MET GLY GLU LEU GLU PRO SER GLU GLY LYS ILE SEQRES 6 B 228 LYS HIS SER GLY ARG ILE SER PHE CYS SER GLN PHE SER SEQRES 7 B 228 TRP ILE MET PRO GLY THR ILE LYS GLU ASN ILE ILE GLY SEQRES 8 B 228 VAL SER TYR ASP GLU TYR ARG TYR ARG SER VAL ILE LYS SEQRES 9 B 228 ALA CYS GLN LEU GLU GLU ASP ILE SER LYS PHE ALA GLU SEQRES 10 B 228 LYS ASP ASN ILE VAL LEU GLY GLU GLY GLY ILE THR LEU SEQRES 11 B 228 SER GLY GLY GLN ARG ALA ARG ILE SER LEU ALA ARG ALA SEQRES 12 B 228 VAL TYR LYS ASP ALA ASP LEU TYR LEU LEU ASP SER PRO SEQRES 13 B 228 PHE GLY TYR LEU ASP VAL LEU THR GLU LYS GLU ILE PHE SEQRES 14 B 228 GLU SER CYS VAL CYS LYS LEU MET ALA ASN LYS THR ARG SEQRES 15 B 228 ILE LEU VAL THR SER LYS MET GLU HIS LEU LYS LYS ALA SEQRES 16 B 228 ASP LYS ILE LEU ILE LEU HIS GLU GLY SER SER TYR PHE SEQRES 17 B 228 TYR GLY THR PHE SER GLU LEU GLN ASN LEU GLN PRO ASP SEQRES 18 B 228 PHE SER SER LYS LEU MET GLY HET MG A 3 1 HET MG B 4 1 HET ATP A 1 31 HET ATP B 2 31 HETNAM MG MAGNESIUM ION HETNAM ATP ADENOSINE-5'-TRIPHOSPHATE FORMUL 3 MG 2(MG 2+) FORMUL 5 ATP 2(C10 H16 N5 O13 P3) FORMUL 7 HOH *130(H2 O) HELIX 1 1 GLY A 463 MET A 472 1 10 HELIX 2 2 ILE A 502 GLY A 509 1 7 HELIX 3 3 ASP A 513 CYS A 524 1 12 HELIX 4 4 LEU A 526 PHE A 533 1 8 HELIX 5 5 GLU A 535 ASN A 538 5 4 HELIX 6 6 SER A 549 LYS A 564 1 16 HELIX 7 7 ASP A 579 CYS A 590 1 12 HELIX 8 8 LYS A 606 LYS A 612 1 7 HELIX 9 9 THR A 629 ASN A 635 1 7 HELIX 10 10 ASP A 639 MET A 645 1 7 HELIX 11 11 GLY B 463 MET B 472 1 10 HELIX 12 12 ILE B 502 GLY B 509 1 7 HELIX 13 13 ASP B 513 CYS B 524 1 12 HELIX 14 14 LEU B 526 SER B 531 1 6 HELIX 15 15 GLU B 535 ASN B 538 5 4 HELIX 16 16 SER B 549 LYS B 564 1 16 HELIX 17 17 ASP B 579 CYS B 590 1 12 HELIX 18 18 LYS B 606 ALA B 613 1 8 HELIX 19 19 THR B 629 LEU B 636 1 8 SHEET 1 A 3 LEU A 441 GLU A 449 0 SHEET 2 A 3 THR A 390 ALA A 399 -1 N GLU A 391 O ILE A 448 SHEET 3 A 3 GLU A 479 HIS A 484 -1 O LYS A 483 N VAL A 393 SHEET 1 B 6 ILE A 488 CYS A 491 0 SHEET 2 B 6 LEU A 568 ASP A 572 1 O LEU A 570 N SER A 489 SHEET 3 B 6 THR A 599 VAL A 603 1 O ILE A 601 N LEU A 571 SHEET 4 B 6 LEU A 453 ALA A 457 1 N VAL A 456 O LEU A 602 SHEET 5 B 6 LYS A 615 HIS A 620 1 O LEU A 619 N ALA A 457 SHEET 6 B 6 SER A 623 GLY A 628 -1 O TYR A 625 N ILE A 618 SHEET 1 C 2 GLY A 500 THR A 501 0 SHEET 2 C 2 VAL A 540 LEU A 541 -1 O LEU A 541 N GLY A 500 SHEET 1 D 3 LEU B 441 GLU B 449 0 SHEET 2 D 3 THR B 390 ALA B 399 -1 N MET B 394 O PHE B 446 SHEET 3 D 3 GLU B 479 HIS B 484 -1 O LYS B 481 N GLU B 395 SHEET 1 E 6 ILE B 488 CYS B 491 0 SHEET 2 E 6 LEU B 568 ASP B 572 1 O LEU B 570 N CYS B 491 SHEET 3 E 6 ARG B 600 VAL B 603 1 O ILE B 601 N TYR B 569 SHEET 4 E 6 LEU B 453 ALA B 457 1 N LEU B 454 O ARG B 600 SHEET 5 E 6 LYS B 615 HIS B 620 1 O LEU B 619 N ALA B 457 SHEET 6 E 6 SER B 623 GLY B 628 -1 O GLY B 628 N ILE B 616 SHEET 1 F 2 GLY B 500 THR B 501 0 SHEET 2 F 2 VAL B 540 LEU B 541 -1 O LEU B 541 N GLY B 500 LINK C GLY A 404 N GLY A 437 1555 1555 1.34 LINK C GLY B 404 N GLY B 437 1555 1555 1.33 SITE *** AC1 5 ATP A 1 THR A 465 GLN A 493 HOH A 647 SITE *** AC1 5 HOH A 648 SITE *** AC2 5 ATP B 2 THR B 465 GLN B 493 HOH B 647 SITE *** AC2 5 HOH B 648 SITE *** AC3 22 MG A 3 TRP A 401 VAL A 440 THR A 460 SITE *** AC3 22 GLY A 461 ALA A 462 GLY A 463 LYS A 464 SITE *** AC3 22 THR A 465 SER A 466 GLN A 493 HOH A 647 SITE *** AC3 22 HOH A 648 HOH A 649 HOH A 686 PHE B 533 SITE *** AC3 22 THR B 547 SER B 549 GLY B 550 GLY B 551 SITE *** AC3 22 GLN B 552 HOH B 654 SITE *** AC4 21 THR A 547 SER A 549 GLY A 550 GLY A 551 SITE *** AC4 21 GLN A 552 MG B 4 TRP B 401 VAL B 440 SITE *** AC4 21 THR B 460 GLY B 461 ALA B 462 GLY B 463 SITE *** AC4 21 LYS B 464 THR B 465 SER B 466 GLN B 493 SITE *** AC4 21 HOH B 647 HOH B 648 HOH B 649 HOH B 655 SITE *** AC4 21 HOH B 696 CRYST1 43.152 92.662 106.471 90.00 90.00 90.00 P 21 21 21 8 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.023174 0.000000 0.000000 0.00000 SCALE2 0.000000 0.010792 0.000000 0.00000 SCALE3 0.000000 0.000000 0.009392 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 : A 493 GLNHE21 : A 493 GLN OE1 : A 3 MGMG :(metal ligand) USER MOD NoAdj : A 493 GLNHE22 : A 493 GLN OE1 : A 3 MGMG :(metal ligand) USER MOD NoAdj : B 493 GLNHE21 : B 493 GLN OE1 : B 4 MGMG :(metal ligand) USER MOD NoAdj : B 493 GLNHE22 : B 493 GLN OE1 : B 4 MGMG :(metal ligand) USER MOD Set 1.1: B 615 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 627 TYR OH : rot 180:sc= 0.0444 USER MOD Set 2.1: B 604 THR OG1 : rot 80:sc= 1.05 USER MOD Set 2.2: B 609 HIS : no HE2:sc= 1.8 K(o=2.9,f=-10!) USER MOD Set 3.1: B 569 TYR OH : rot -154:sc= 1.13 USER MOD Set 3.2: B 598 LYS NZ :NH3+ 150:sc= 0.943 (180deg=0.521) USER MOD Set 4.1: B 524 CYS SG : rot 85:sc= 0.149 USER MOD Set 4.2: B 590 CYS SG : rot 140:sc= -0.397 USER MOD Set 5.1: B 491 CYS SG : rot -67:sc= 0.054 USER MOD Set 5.2: B 557 SER OG A: rot -86:sc= 1.27 USER MOD Set 6.1: B 469 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 6.2: B 472 MET CE :methyl -176:sc= 0 (180deg=-0.00838) USER MOD Set 7.1: A 604 THR OG1 : rot 167:sc= 1.1 USER MOD Set 7.2: A 609 HIS : no HD1:sc= 1 K(o=2.1,f=-9.2!) USER MOD Set 8.1: A 607 MET CE :methyl -156:sc= -0.0623 (180deg=-0.519) USER MOD Set 8.2: A 641 SER OG : rot -70:sc= 0.868 USER MOD Set 9.1: A 569 TYR OH : rot -153:sc= 1.56 USER MOD Set 9.2: A 598 LYS NZ :NH3+ 148:sc= 0.0712 (180deg=0) USER MOD Set10.1: A 491 CYS SG : rot 39:sc= 0.321 USER MOD Set10.2: A 495 SER OG : rot 83:sc= 1.57 USER MOD Set10.3: A 557 SER OG A: rot 69:sc= -0.536 USER MOD Set10.4: A 557 SER OG B: rot 82:sc= 0.247 USER MOD Set11.1: A 552 GLN : amide:sc= 1.38 K(o=2.3,f=-0.88!) USER MOD Set11.2: B 2 ATP O2' : rot -78:sc= 0.894 USER MOD Set12.1: A 524 CYS SG : rot 83:sc= 0.0898 USER MOD Set12.2: A 590 CYS SG : rot 133:sc= -1.32 USER MOD Set13.1: A 1 ATP O2' : rot -93:sc= 1.87 USER MOD Set13.2: A 1 ATP O3' : rot 117:sc= 0.424 USER MOD Set13.3: B 552 GLN : amide:sc= 1.77 K(o=4.1,f=0.72!) USER MOD Single : A 386 SER OG : rot -26:sc= 0.0378 USER MOD Single : A 390 THR OG1 : rot 180:sc= 0.0135 USER MOD Single : A 394 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 396 ASN : amide:sc= -0.535 X(o=-0.53,f=-0.13) USER MOD Single : A 398 THR OG1 : rot 180:sc= 0.0287 USER MOD Single : A 438 THR OG1 : rot 180:sc= -0.167 USER MOD Single : A 445 ASN : amide:sc= 0.888 K(o=0.89,f=-3.4!) USER MOD Single : A 452 GLN : amide:sc= 0.46 K(o=0.46,f=-2.7!) USER MOD Single : A 459 SER OG : rot -77:sc= 0.18 USER MOD Single : A 460 THR OG1 : rot 40:sc= 0.679 USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 1.69 (180deg=1.69) USER MOD Single : A 466 SER OG : rot 98:sc= 1.91 USER MOD Single : A 469 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 470 MET CE :methyl -155:sc= -3.55! (180deg=-4.77!) USER MOD Single : A 472 MET CE :methyl -114:sc= -0.114 (180deg=-0.171) USER MOD Single : A 478 SER OG : rot 53:sc= 1.29 USER MOD Single : A 484 HIS : no HE2:sc= 0.409 K(o=0.41,f=-2.4!) USER MOD Single : A 485 SER OG : rot 180:sc= 0 USER MOD Single : A 489 SER OG : rot -150:sc= 1.27 USER MOD Single : A 492 SER OG : rot -80:sc= 0.767 USER MOD Single : A 498 MET CE A:methyl -98:sc= -0.0206 (180deg=-0.166) USER MOD Single : A 498 MET CE B:methyl -122:sc= 0 (180deg=-0.584) USER MOD Single : A 501 THR OG1 : rot 180:sc= -0.0607 USER MOD Single : A 503 LYS NZ :NH3+ 174:sc= 0.919 (180deg=0.828) USER MOD Single : A 505 ASN : amide:sc= 1.81 K(o=1.8,f=-6.6!) USER MOD Single : A 511 SER OG : rot 180:sc= 0 USER MOD Single : A 515 TYR OH : rot 180:sc= 0 USER MOD Single : A 517 TYR OH : rot 180:sc= 0 USER MOD Single : A 519 SER OG : rot -36:sc= 1.21 USER MOD Single : A 522 LYS NZ :NH3+ 169:sc= 0.349 (180deg=0.0666) USER MOD Single : A 525 GLN : amide:sc= 0.163 K(o=0.16,f=-1.8!) USER MOD Single : A 531 SER OG : rot -49:sc= 0.166 USER MOD Single : A 547 THR OG1 : rot -71:sc= 0.963 USER MOD Single : A 549 SER OG : rot 180:sc= 0.0887 USER MOD Single : A 563 TYR OH : rot -178:sc= 1.12 USER MOD Single : A 564 LYS NZ :NH3+ -161:sc= 0.825 (180deg=0.626) USER MOD Single : A 573 SER OG : rot -161:sc= 0.73 USER MOD Single : A 577 TYR OH : rot 0:sc= 1.22 USER MOD Single : A 582 THR OG1 : rot 123:sc= 1.18 USER MOD Single : A 589 SER OG : rot 98:sc= 1.71 USER MOD Single : A 592 CYS SG : rot 127:sc= -0.0548 USER MOD Single : A 593 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 595 MET CE :methyl 179:sc=-0.00916 (180deg=-0.0101) USER MOD Single : A 597 ASN :FLIP amide:sc= -0.112 F(o=-1.9!,f=-0.11) USER MOD Single : A 599 THR OG1 : rot 160:sc= 0.469 USER MOD Single : A 606 LYS NZ :NH3+ -172:sc= -0.0453 (180deg=-0.0904) USER MOD Single : A 615 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 620 HIS : no HD1:sc= 0.558 K(o=0.56,f=-0.11) USER MOD Single : A 623 SER OG : rot 180:sc= 0 USER MOD Single : A 624 SER OG : rot 180:sc= 0 USER MOD Single : A 625 TYR OH : rot -1:sc= 0.568 USER MOD Single : A 627 TYR OH : rot 180:sc= 0.081 USER MOD Single : A 629 THR OG1 : rot 180:sc= 0 USER MOD Single : A 631 SER OG : rot 180:sc= 0 USER MOD Single : A 634 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 645 MET CE :methyl -149:sc= -1.64 (180deg=-1.9) USER MOD Single : B 2 ATP O3' : rot 144:sc= 0.227 USER MOD Single : B 388 THR OG1 : rot 180:sc= 0 USER MOD Single : B 390 THR OG1 : rot -28:sc= 0.00104 USER MOD Single : B 394 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 396 ASN : amide:sc= -0.748 X(o=-0.75,f=-0.66) USER MOD Single : B 398 THR OG1 : rot 180:sc= 0.136 USER MOD Single : B 438 THR OG1 : rot 180:sc= -0.831 USER MOD Single : B 445 ASN : amide:sc= 0.685 K(o=0.68,f=-4.1!) USER MOD Single : B 447 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 452 GLN : amide:sc= 0.594 K(o=0.59,f=-3.6!) USER MOD Single : B 459 SER OG : rot -40:sc= 0.0172 USER MOD Single : B 460 THR OG1 : rot 53:sc= 0.252 USER MOD Single : B 464 LYS NZ :NH3+ 171:sc= 1.55 (180deg=1.47) USER MOD Single : B 466 SER OG : rot 89:sc= 1.91 USER MOD Single : B 470 MET CE :methyl -151:sc= -3.6 (180deg=-4.42!) USER MOD Single : B 478 SER OG : rot -178:sc= 0.414! USER MOD Single : B 484 HIS :FLIP no HD1:sc= -0.103 F(o=-0.66,f=-0.1) USER MOD Single : B 485 SER OG : rot 180:sc= 0 USER MOD Single : B 489 SER OG : rot -167:sc= 1.22 USER MOD Single : B 492 SER OG : rot 116:sc= 0.961 USER MOD Single : B 495 SER OG : rot 180:sc= 0 USER MOD Single : B 498 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 501 THR OG1 : rot 180:sc= 0.24 USER MOD Single : B 503 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 505 ASN : amide:sc= 1.87 K(o=1.9,f=-8.1!) USER MOD Single : B 512 TYR OH : rot 180:sc= 0 USER MOD Single : B 515 TYR OH : rot 180:sc= 0 USER MOD Single : B 517 TYR OH : rot 175:sc= 1.32 USER MOD Single : B 519 SER OG : rot -53:sc= 0.00533 USER MOD Single : B 522 LYS NZ :NH3+ 153:sc= 1.11 (180deg=-0.423) USER MOD Single : B 525 GLN : amide:sc= 0.0265 X(o=0.026,f=0) USER MOD Single : B 531 SER OG : rot 81:sc= 0.401 USER MOD Single : B 538 ASN : amide:sc=-0.00465 X(o=-0.0047,f=-0.18) USER MOD Single : B 547 THR OG1 : rot 180:sc= 0 USER MOD Single : B 549 SER OG : rot 180:sc= 0.0332 USER MOD Single : B 557 SER OG B: rot 79:sc= 0.56 USER MOD Single : B 563 TYR OH : rot 146:sc= 1.58 USER MOD Single : B 564 LYS NZ :NH3+ -116:sc= 0.0373 (180deg=0.0243) USER MOD Single : B 573 SER OG : rot 115:sc= 1.05 USER MOD Single : B 577 TYR OH : rot 180:sc= 0.732 USER MOD Single : B 582 THR OG1 : rot 127:sc= 1.21 USER MOD Single : B 584 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 589 SER OG : rot 180:sc= 0 USER MOD Single : B 592 CYS SG : rot 122:sc= 0.119 USER MOD Single : B 595 MET CE :methyl -170:sc= -0.655 (180deg=-0.721) USER MOD Single : B 597 ASN : amide:sc= -0.0128 X(o=-0.013,f=0) USER MOD Single : B 599 THR OG1 : rot 130:sc= 0.343 USER MOD Single : B 605 SER OG : rot -175:sc= 1.07 USER MOD Single : B 611 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 620 HIS : no HD1:sc= 0.0904 X(o=0.09,f=0) USER MOD Single : B 623 SER OG : rot 180:sc= 0 USER MOD Single : B 624 SER OG : rot 154:sc= 0.952 USER MOD Single : B 625 TYR OH : rot 180:sc= 0 USER MOD Single : B 629 THR OG1 : rot 111:sc= -2.07! USER MOD Single : B 631 SER OG : rot 180:sc= 0 USER MOD Single : B 635 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 386 -3.779 12.992 104.530 1.00 56.36 N ATOM 2 CA SER A 386 -3.770 12.186 103.276 1.00 55.97 C ATOM 3 C SER A 386 -2.420 11.515 103.011 1.00 55.53 C ATOM 4 O SER A 386 -1.370 11.992 103.460 1.00 55.93 O ATOM 5 CB SER A 386 -4.171 13.048 102.079 1.00 56.27 C ATOM 6 OG SER A 386 -3.277 14.135 101.917 1.00 58.02 O ATOM 0 HA SER A 386 -4.422 11.478 103.398 1.00 55.97 H new ATOM 0 HB2 SER A 386 -4.178 12.507 101.274 1.00 56.27 H new ATOM 0 HB3 SER A 386 -5.073 13.382 102.204 1.00 56.27 H new ATOM 0 HG SER A 386 -2.929 14.325 102.658 1.00 58.02 H new ATOM 7 N LEU A 387 -2.463 10.402 102.282 1.00 54.29 N ATOM 8 CA LEU A 387 -1.259 9.697 101.864 1.00 53.04 C ATOM 9 C LEU A 387 -1.130 9.782 100.348 1.00 52.63 C ATOM 10 O LEU A 387 -2.058 9.415 99.612 1.00 52.92 O ATOM 11 CB LEU A 387 -1.305 8.236 102.308 1.00 52.52 C ATOM 12 CG LEU A 387 -1.322 7.923 103.803 1.00 52.27 C ATOM 13 CD1 LEU A 387 -1.837 6.516 104.006 1.00 52.00 C ATOM 14 CD2 LEU A 387 0.063 8.094 104.430 1.00 51.89 C ATOM 0 H LEU A 387 -3.194 10.035 102.016 1.00 54.29 H new ATOM 0 HA LEU A 387 -0.488 10.113 102.281 1.00 53.04 H new ATOM 0 HB2 LEU A 387 -2.095 7.834 101.914 1.00 52.52 H new ATOM 0 HB3 LEU A 387 -0.536 7.787 101.922 1.00 52.52 H new ATOM 0 HG LEU A 387 -1.912 8.552 104.248 1.00 52.27 H new ATOM 0 HD11 LEU A 387 -1.851 6.310 104.954 1.00 52.00 H new ATOM 0 HD12 LEU A 387 -2.735 6.445 103.647 1.00 52.00 H new ATOM 0 HD13 LEU A 387 -1.256 5.889 103.548 1.00 52.00 H new ATOM 0 HD21 LEU A 387 0.017 7.888 105.377 1.00 51.89 H new ATOM 0 HD22 LEU A 387 0.690 7.493 103.999 1.00 51.89 H new ATOM 0 HD23 LEU A 387 0.361 9.010 104.313 1.00 51.89 H new ATOM 15 N THR A 388 0.021 10.272 99.897 1.00 51.07 N ATOM 16 CA THR A 388 0.286 10.495 98.477 1.00 49.74 C ATOM 17 C THR A 388 0.804 9.237 97.771 1.00 48.44 C ATOM 18 O THR A 388 1.574 8.464 98.347 1.00 47.54 O ATOM 19 CB THR A 388 1.295 11.650 98.286 1.00 50.08 C ATOM 0 H THR A 388 0.677 10.487 100.411 1.00 51.07 H new ATOM 0 HA THR A 388 -0.563 10.732 98.071 1.00 49.74 H new ATOM 20 N THR A 389 0.378 9.044 96.521 1.00 46.85 N ATOM 21 CA THR A 389 0.865 7.931 95.696 1.00 44.96 C ATOM 22 C THR A 389 1.209 8.369 94.271 1.00 43.58 C ATOM 23 O THR A 389 0.982 7.633 93.310 1.00 42.39 O ATOM 24 CB THR A 389 -0.149 6.786 95.637 1.00 45.22 C ATOM 0 H THR A 389 -0.197 9.549 96.129 1.00 46.85 H new ATOM 0 HA THR A 389 1.676 7.619 96.126 1.00 44.96 H new ATOM 25 N THR A 390 1.765 9.575 94.155 1.00 42.03 N ATOM 26 CA THR A 390 2.201 10.135 92.884 1.00 40.47 C ATOM 27 C THR A 390 3.387 9.339 92.378 1.00 38.87 C ATOM 28 O THR A 390 4.334 9.077 93.124 1.00 39.32 O ATOM 29 CB THR A 390 2.636 11.595 93.057 1.00 41.22 C ATOM 30 OG1 THR A 390 1.787 12.226 94.016 1.00 39.98 O ATOM 31 CG2 THR A 390 2.557 12.350 91.742 1.00 41.26 C ATOM 0 H THR A 390 1.900 10.096 94.826 1.00 42.03 H new ATOM 0 HA THR A 390 1.463 10.094 92.256 1.00 40.47 H new ATOM 0 HB THR A 390 3.557 11.608 93.361 1.00 41.22 H new ATOM 0 HG1 THR A 390 2.022 13.026 94.115 1.00 39.98 H new ATOM 0 HG21 THR A 390 2.837 13.269 91.879 1.00 41.26 H new ATOM 0 HG22 THR A 390 3.140 11.928 91.091 1.00 41.26 H new ATOM 0 HG23 THR A 390 1.644 12.336 91.415 1.00 41.26 H new ATOM 32 N GLU A 391 3.322 8.941 91.117 1.00 36.60 N ATOM 33 CA GLU A 391 4.387 8.159 90.508 1.00 35.32 C ATOM 34 C GLU A 391 5.309 8.975 89.617 1.00 32.87 C ATOM 35 O GLU A 391 6.522 8.788 89.644 1.00 33.30 O ATOM 36 CB GLU A 391 3.811 6.972 89.738 1.00 35.86 C ATOM 37 CG GLU A 391 3.388 5.828 90.622 1.00 39.66 C ATOM 38 CD GLU A 391 4.528 5.220 91.444 1.00 43.76 C ATOM 39 OE1 GLU A 391 5.631 4.978 90.887 1.00 44.87 O ATOM 40 OE2 GLU A 391 4.305 4.964 92.653 1.00 46.49 O ATOM 0 H GLU A 391 2.664 9.115 90.592 1.00 36.60 H new ATOM 0 HA GLU A 391 4.935 7.835 91.240 1.00 35.32 H new ATOM 0 HB2 GLU A 391 3.047 7.271 89.221 1.00 35.86 H new ATOM 0 HB3 GLU A 391 4.474 6.654 89.105 1.00 35.86 H new ATOM 0 HG2 GLU A 391 2.695 6.138 91.226 1.00 39.66 H new ATOM 0 HG3 GLU A 391 2.994 5.134 90.071 1.00 39.66 H new ATOM 41 N VAL A 392 4.734 9.869 88.827 1.00 31.42 N ATOM 42 CA VAL A 392 5.511 10.705 87.910 1.00 29.54 C ATOM 43 C VAL A 392 5.077 12.147 88.063 1.00 28.52 C ATOM 44 O VAL A 392 3.886 12.436 88.079 1.00 27.48 O ATOM 45 CB VAL A 392 5.309 10.289 86.423 1.00 30.16 C ATOM 46 CG1 VAL A 392 6.244 11.076 85.487 1.00 29.18 C ATOM 47 CG2 VAL A 392 5.483 8.791 86.249 1.00 30.26 C ATOM 0 H VAL A 392 3.886 10.012 88.803 1.00 31.42 H new ATOM 0 HA VAL A 392 6.448 10.592 88.135 1.00 29.54 H new ATOM 0 HB VAL A 392 4.398 10.512 86.175 1.00 30.16 H new ATOM 0 HG11 VAL A 392 6.095 10.796 84.570 1.00 29.18 H new ATOM 0 HG12 VAL A 392 6.060 12.025 85.568 1.00 29.18 H new ATOM 0 HG13 VAL A 392 7.167 10.904 85.732 1.00 29.18 H new ATOM 0 HG21 VAL A 392 5.353 8.556 85.317 1.00 30.26 H new ATOM 0 HG22 VAL A 392 6.377 8.535 86.525 1.00 30.26 H new ATOM 0 HG23 VAL A 392 4.831 8.324 86.794 1.00 30.26 H new ATOM 48 N VAL A 393 6.050 13.048 88.157 1.00 28.18 N ATOM 49 CA VAL A 393 5.776 14.473 88.224 1.00 28.11 C ATOM 50 C VAL A 393 6.678 15.202 87.242 1.00 27.40 C ATOM 51 O VAL A 393 7.887 14.995 87.231 1.00 28.06 O ATOM 52 CB VAL A 393 6.016 15.049 89.650 1.00 27.20 C ATOM 53 CG1 VAL A 393 5.641 16.518 89.707 1.00 28.25 C ATOM 54 CG2 VAL A 393 5.208 14.290 90.664 1.00 28.24 C ATOM 0 H VAL A 393 6.886 12.848 88.184 1.00 28.18 H new ATOM 0 HA VAL A 393 4.841 14.604 88.001 1.00 28.11 H new ATOM 0 HB VAL A 393 6.960 14.956 89.855 1.00 27.20 H new ATOM 0 HG11 VAL A 393 5.797 16.858 90.602 1.00 28.25 H new ATOM 0 HG12 VAL A 393 6.182 17.015 89.074 1.00 28.25 H new ATOM 0 HG13 VAL A 393 4.703 16.622 89.482 1.00 28.25 H new ATOM 0 HG21 VAL A 393 5.367 14.659 91.547 1.00 28.24 H new ATOM 0 HG22 VAL A 393 4.265 14.364 90.448 1.00 28.24 H new ATOM 0 HG23 VAL A 393 5.469 13.356 90.653 1.00 28.24 H new ATOM 55 N MET A 394 6.077 16.033 86.404 1.00 27.18 N ATOM 56 CA MET A 394 6.830 17.032 85.676 1.00 27.95 C ATOM 57 C MET A 394 6.423 18.397 86.198 1.00 27.61 C ATOM 58 O MET A 394 5.235 18.692 86.317 1.00 27.86 O ATOM 59 CB MET A 394 6.623 16.919 84.171 1.00 27.09 C ATOM 60 CG MET A 394 7.302 15.698 83.566 1.00 26.41 C ATOM 61 SD MET A 394 7.740 15.974 81.837 1.00 29.90 S ATOM 62 CE MET A 394 8.184 14.294 81.365 1.00 31.71 C ATOM 0 H MET A 394 5.232 16.033 86.244 1.00 27.18 H new ATOM 0 HA MET A 394 7.779 16.893 85.821 1.00 27.95 H new ATOM 0 HB2 MET A 394 5.672 16.880 83.983 1.00 27.09 H new ATOM 0 HB3 MET A 394 6.965 17.719 83.742 1.00 27.09 H new ATOM 0 HG2 MET A 394 8.101 15.486 84.074 1.00 26.41 H new ATOM 0 HG3 MET A 394 6.711 14.931 83.633 1.00 26.41 H new ATOM 0 HE1 MET A 394 8.450 14.279 80.432 1.00 31.71 H new ATOM 0 HE2 MET A 394 8.921 13.987 81.916 1.00 31.71 H new ATOM 0 HE3 MET A 394 7.420 13.710 81.492 1.00 31.71 H new ATOM 63 N GLU A 395 7.425 19.206 86.519 1.00 28.50 N ATOM 64 CA GLU A 395 7.238 20.542 87.095 1.00 31.02 C ATOM 65 C GLU A 395 7.995 21.545 86.246 1.00 29.14 C ATOM 66 O GLU A 395 9.222 21.514 86.223 1.00 29.25 O ATOM 67 CB GLU A 395 7.782 20.584 88.538 1.00 30.63 C ATOM 68 CG GLU A 395 6.788 20.156 89.636 1.00 34.49 C ATOM 69 CD GLU A 395 7.447 19.989 91.029 1.00 35.94 C ATOM 70 OE1 GLU A 395 6.873 19.281 91.905 1.00 41.75 O ATOM 71 OE2 GLU A 395 8.545 20.559 91.249 1.00 44.64 O ATOM 0 H GLU A 395 8.251 18.994 86.408 1.00 28.50 H new ATOM 0 HA GLU A 395 6.292 20.757 87.112 1.00 31.02 H new ATOM 0 HB2 GLU A 395 8.563 20.011 88.589 1.00 30.63 H new ATOM 0 HB3 GLU A 395 8.080 21.487 88.728 1.00 30.63 H new ATOM 0 HG2 GLU A 395 6.080 20.816 89.697 1.00 34.49 H new ATOM 0 HG3 GLU A 395 6.373 19.318 89.379 1.00 34.49 H new ATOM 72 N ASN A 396 7.273 22.413 85.537 1.00 29.53 N ATOM 73 CA ASN A 396 7.886 23.474 84.692 1.00 29.91 C ATOM 74 C ASN A 396 8.990 22.990 83.745 1.00 27.89 C ATOM 75 O ASN A 396 10.049 23.606 83.625 1.00 27.68 O ATOM 76 CB ASN A 396 8.389 24.650 85.556 1.00 31.76 C ATOM 77 CG ASN A 396 8.600 25.948 84.742 1.00 37.81 C ATOM 78 OD1 ASN A 396 9.602 26.649 84.918 1.00 43.78 O ATOM 79 ND2 ASN A 396 7.651 26.263 83.858 1.00 43.18 N ATOM 0 H ASN A 396 6.413 22.413 85.525 1.00 29.53 H new ATOM 0 HA ASN A 396 7.168 23.776 84.115 1.00 29.91 H new ATOM 0 HB2 ASN A 396 7.751 24.819 86.266 1.00 31.76 H new ATOM 0 HB3 ASN A 396 9.225 24.400 85.979 1.00 31.76 H new ATOM 0 HD21 ASN A 396 7.724 26.977 83.385 1.00 43.18 H new ATOM 0 HD22 ASN A 396 6.966 25.752 83.762 1.00 43.18 H new ATOM 80 N VAL A 397 8.742 21.878 83.065 1.00 26.17 N ATOM 81 CA VAL A 397 9.790 21.256 82.268 1.00 24.30 C ATOM 82 C VAL A 397 9.918 21.831 80.857 1.00 24.21 C ATOM 83 O VAL A 397 8.953 21.890 80.085 1.00 24.00 O ATOM 84 CB VAL A 397 9.651 19.694 82.247 1.00 24.72 C ATOM 85 CG1 VAL A 397 10.538 19.100 81.192 1.00 22.21 C ATOM 86 CG2 VAL A 397 9.998 19.123 83.609 1.00 22.22 C ATOM 0 H VAL A 397 7.984 21.472 83.051 1.00 26.17 H new ATOM 0 HA VAL A 397 10.622 21.477 82.715 1.00 24.30 H new ATOM 0 HB VAL A 397 8.732 19.467 82.036 1.00 24.72 H new ATOM 0 HG11 VAL A 397 10.440 18.135 81.192 1.00 22.21 H new ATOM 0 HG12 VAL A 397 10.286 19.450 80.323 1.00 22.21 H new ATOM 0 HG13 VAL A 397 11.462 19.331 81.378 1.00 22.21 H new ATOM 0 HG21 VAL A 397 9.910 18.157 83.587 1.00 22.22 H new ATOM 0 HG22 VAL A 397 10.911 19.359 83.836 1.00 22.22 H new ATOM 0 HG23 VAL A 397 9.395 19.488 84.276 1.00 22.22 H new ATOM 87 N THR A 398 11.134 22.261 80.539 1.00 24.01 N ATOM 88 CA THR A 398 11.509 22.656 79.197 1.00 24.75 C ATOM 89 C THR A 398 12.734 21.847 78.853 1.00 25.69 C ATOM 90 O THR A 398 13.530 21.536 79.741 1.00 26.53 O ATOM 91 CB THR A 398 11.822 24.171 79.091 1.00 23.40 C ATOM 92 OG1 THR A 398 10.635 24.909 79.344 1.00 27.26 O ATOM 93 CG2 THR A 398 12.325 24.550 77.694 1.00 24.16 C ATOM 0 H THR A 398 11.773 22.331 81.111 1.00 24.01 H new ATOM 0 HA THR A 398 10.775 22.493 78.585 1.00 24.75 H new ATOM 0 HB THR A 398 12.514 24.376 79.740 1.00 23.40 H new ATOM 0 HG1 THR A 398 10.799 25.731 79.289 1.00 27.26 H new ATOM 0 HG21 THR A 398 12.510 25.502 77.664 1.00 24.16 H new ATOM 0 HG22 THR A 398 13.137 24.057 77.497 1.00 24.16 H new ATOM 0 HG23 THR A 398 11.647 24.332 77.036 1.00 24.16 H new ATOM 94 N ALA A 399 12.850 21.464 77.579 1.00 25.45 N ATOM 95 CA ALA A 399 13.963 20.651 77.094 1.00 26.03 C ATOM 96 C ALA A 399 14.223 20.923 75.619 1.00 26.38 C ATOM 97 O ALA A 399 13.303 21.249 74.877 1.00 26.07 O ATOM 98 CB ALA A 399 13.676 19.156 77.304 1.00 26.07 C ATOM 0 H ALA A 399 12.280 21.671 76.970 1.00 25.45 H new ATOM 0 HA ALA A 399 14.753 20.893 77.602 1.00 26.03 H new ATOM 0 HB1 ALA A 399 14.425 18.633 76.977 1.00 26.07 H new ATOM 0 HB2 ALA A 399 13.549 18.980 78.249 1.00 26.07 H new ATOM 0 HB3 ALA A 399 12.873 18.909 76.819 1.00 26.07 H new ATOM 99 N PHE A 400 15.483 20.780 75.217 1.00 28.07 N ATOM 100 CA PHE A 400 15.919 20.951 73.830 1.00 30.25 C ATOM 101 C PHE A 400 16.633 19.691 73.376 1.00 30.30 C ATOM 102 O PHE A 400 17.457 19.150 74.097 1.00 31.02 O ATOM 103 CB PHE A 400 16.914 22.118 73.701 1.00 31.33 C ATOM 104 CG PHE A 400 16.350 23.478 74.066 1.00 33.90 C ATOM 105 CD1 PHE A 400 16.151 23.842 75.403 1.00 35.76 C ATOM 106 CD2 PHE A 400 16.070 24.411 73.077 1.00 33.41 C ATOM 107 CE1 PHE A 400 15.649 25.109 75.750 1.00 35.71 C ATOM 108 CE2 PHE A 400 15.571 25.691 73.411 1.00 35.07 C ATOM 109 CZ PHE A 400 15.359 26.035 74.745 1.00 35.84 C ATOM 0 H PHE A 400 16.123 20.576 75.754 1.00 28.07 H new ATOM 0 HA PHE A 400 15.134 21.132 73.289 1.00 30.25 H new ATOM 0 HB2 PHE A 400 17.680 21.937 74.267 1.00 31.33 H new ATOM 0 HB3 PHE A 400 17.238 22.151 72.787 1.00 31.33 H new ATOM 0 HD1 PHE A 400 16.355 23.233 76.076 1.00 35.76 H new ATOM 0 HD2 PHE A 400 16.212 24.192 72.185 1.00 33.41 H new ATOM 0 HE1 PHE A 400 15.511 25.329 76.643 1.00 35.71 H new ATOM 0 HE2 PHE A 400 15.384 26.305 72.738 1.00 35.07 H new ATOM 0 HZ PHE A 400 15.027 26.875 74.965 1.00 35.84 H new ATOM 110 N TRP A 401 16.335 19.226 72.171 1.00 30.95 N ATOM 111 CA TRP A 401 17.154 18.195 71.566 1.00 30.67 C ATOM 112 C TRP A 401 18.484 18.784 71.051 1.00 32.57 C ATOM 113 O TRP A 401 19.548 18.183 71.229 1.00 33.87 O ATOM 114 CB TRP A 401 16.407 17.527 70.428 1.00 30.06 C ATOM 115 CG TRP A 401 15.431 16.454 70.858 1.00 27.65 C ATOM 116 CD1 TRP A 401 14.085 16.473 70.689 1.00 27.57 C ATOM 117 CD2 TRP A 401 15.740 15.204 71.495 1.00 26.03 C ATOM 118 NE1 TRP A 401 13.526 15.321 71.182 1.00 27.18 N ATOM 119 CE2 TRP A 401 14.521 14.524 71.685 1.00 27.11 C ATOM 120 CE3 TRP A 401 16.929 14.591 71.915 1.00 26.94 C ATOM 121 CZ2 TRP A 401 14.451 13.253 72.282 1.00 28.12 C ATOM 122 CZ3 TRP A 401 16.864 13.332 72.510 1.00 27.38 C ATOM 123 CH2 TRP A 401 15.633 12.677 72.695 1.00 29.70 C ATOM 0 H TRP A 401 15.671 19.492 71.694 1.00 30.95 H new ATOM 0 HA TRP A 401 17.353 17.531 72.244 1.00 30.67 H new ATOM 0 HB2 TRP A 401 15.924 18.206 69.931 1.00 30.06 H new ATOM 0 HB3 TRP A 401 17.053 17.135 69.819 1.00 30.06 H new ATOM 0 HD1 TRP A 401 13.609 17.168 70.295 1.00 27.57 H new ATOM 0 HE1 TRP A 401 12.687 15.130 71.176 1.00 27.18 H new ATOM 0 HE3 TRP A 401 17.747 15.017 71.799 1.00 26.94 H new ATOM 0 HZ2 TRP A 401 13.637 12.817 72.394 1.00 28.12 H new ATOM 0 HZ3 TRP A 401 17.648 12.918 72.790 1.00 27.38 H new ATOM 0 HH2 TRP A 401 15.616 11.841 73.103 1.00 29.70 H new ATOM 124 N GLY A 404 19.603 22.457 70.922 1.00 53.49 N ATOM 125 CA GLY A 404 20.269 23.705 71.288 1.00 54.18 C ATOM 126 C GLY A 404 19.869 24.825 70.343 1.00 54.05 C ATOM 127 O GLY A 404 20.714 25.390 69.640 1.00 54.20 O ATOM 0 HA2 GLY A 404 20.037 23.946 72.199 1.00 54.18 H new ATOM 0 HA3 GLY A 404 21.231 23.583 71.263 1.00 54.18 H new ATOM 128 N GLY A 437 18.568 25.126 70.340 1.00 53.36 N ATOM 129 CA GLY A 437 17.940 26.088 69.432 1.00 51.56 C ATOM 130 C GLY A 437 16.533 26.374 69.929 1.00 50.10 C ATOM 131 O GLY A 437 16.357 27.153 70.866 1.00 50.80 O ATOM 0 H GLY A 437 18.010 24.764 70.884 1.00 53.36 H new ATOM 0 HA2 GLY A 437 18.458 26.907 69.398 1.00 51.56 H new ATOM 0 HA3 GLY A 437 17.913 25.732 68.530 1.00 51.56 H new ATOM 132 N THR A 438 15.533 25.735 69.319 1.00 48.49 N ATOM 133 CA THR A 438 14.127 25.854 69.761 1.00 46.03 C ATOM 134 C THR A 438 13.685 24.632 70.605 1.00 43.64 C ATOM 135 O THR A 438 14.110 23.496 70.313 1.00 43.94 O ATOM 136 CB THR A 438 13.164 26.123 68.570 1.00 46.26 C ATOM 137 OG1 THR A 438 11.799 25.942 68.983 1.00 47.82 O ATOM 138 CG2 THR A 438 13.459 25.196 67.395 1.00 49.33 C ATOM 0 H THR A 438 15.643 25.220 68.639 1.00 48.49 H new ATOM 0 HA THR A 438 14.075 26.630 70.341 1.00 46.03 H new ATOM 0 HB THR A 438 13.302 27.039 68.284 1.00 46.26 H new ATOM 0 HG1 THR A 438 11.287 26.091 68.334 1.00 47.82 H new ATOM 0 HG21 THR A 438 12.844 25.387 66.670 1.00 49.33 H new ATOM 0 HG22 THR A 438 14.370 25.337 67.092 1.00 49.33 H new ATOM 0 HG23 THR A 438 13.351 24.274 67.675 1.00 49.33 H new ATOM 139 N PRO A 439 12.866 24.858 71.667 1.00 39.73 N ATOM 140 CA PRO A 439 12.508 23.747 72.573 1.00 36.63 C ATOM 141 C PRO A 439 11.573 22.706 71.955 1.00 32.86 C ATOM 142 O PRO A 439 10.614 23.053 71.266 1.00 31.78 O ATOM 143 CB PRO A 439 11.820 24.454 73.751 1.00 36.39 C ATOM 144 CG PRO A 439 11.266 25.695 73.169 1.00 38.55 C ATOM 145 CD PRO A 439 12.262 26.130 72.113 1.00 39.96 C ATOM 0 HA PRO A 439 13.295 23.235 72.815 1.00 36.63 H new ATOM 0 HB2 PRO A 439 11.121 23.902 74.134 1.00 36.39 H new ATOM 0 HB3 PRO A 439 12.450 24.649 74.462 1.00 36.39 H new ATOM 0 HG2 PRO A 439 10.392 25.538 72.780 1.00 38.55 H new ATOM 0 HG3 PRO A 439 11.156 26.379 73.847 1.00 38.55 H new ATOM 0 HD2 PRO A 439 11.827 26.595 71.381 1.00 39.96 H new ATOM 0 HD3 PRO A 439 12.928 26.734 72.477 1.00 39.96 H new ATOM 146 N VAL A 440 11.860 21.433 72.211 1.00 30.31 N ATOM 147 CA VAL A 440 10.951 20.358 71.808 1.00 26.96 C ATOM 148 C VAL A 440 9.768 20.255 72.780 1.00 25.30 C ATOM 149 O VAL A 440 8.666 19.887 72.388 1.00 24.79 O ATOM 150 CB VAL A 440 11.683 19.002 71.631 1.00 27.71 C ATOM 151 CG1 VAL A 440 12.238 18.479 72.964 1.00 26.29 C ATOM 152 CG2 VAL A 440 10.728 17.962 70.987 1.00 24.91 C ATOM 0 H VAL A 440 12.572 21.169 72.615 1.00 30.31 H new ATOM 0 HA VAL A 440 10.597 20.586 70.934 1.00 26.96 H new ATOM 0 HB VAL A 440 12.439 19.144 71.040 1.00 27.71 H new ATOM 0 HG11 VAL A 440 12.688 17.632 72.817 1.00 26.29 H new ATOM 0 HG12 VAL A 440 12.868 19.121 73.327 1.00 26.29 H new ATOM 0 HG13 VAL A 440 11.509 18.353 73.591 1.00 26.29 H new ATOM 0 HG21 VAL A 440 11.193 17.118 70.880 1.00 24.91 H new ATOM 0 HG22 VAL A 440 9.955 17.834 71.559 1.00 24.91 H new ATOM 0 HG23 VAL A 440 10.438 18.283 70.119 1.00 24.91 H new ATOM 153 N LEU A 441 10.021 20.586 74.049 1.00 24.38 N ATOM 154 CA LEU A 441 9.013 20.641 75.104 1.00 22.76 C ATOM 155 C LEU A 441 9.203 21.928 75.902 1.00 22.85 C ATOM 156 O LEU A 441 10.331 22.297 76.214 1.00 21.90 O ATOM 157 CB LEU A 441 9.147 19.434 76.037 1.00 22.22 C ATOM 158 CG LEU A 441 8.754 18.095 75.417 1.00 21.13 C ATOM 159 CD1 LEU A 441 9.213 16.965 76.325 1.00 22.48 C ATOM 160 CD2 LEU A 441 7.238 18.028 75.141 1.00 20.60 C ATOM 0 H LEU A 441 10.809 20.791 74.325 1.00 24.38 H new ATOM 0 HA LEU A 441 8.130 20.624 74.703 1.00 22.76 H new ATOM 0 HB2 LEU A 441 10.066 19.377 76.341 1.00 22.22 H new ATOM 0 HB3 LEU A 441 8.598 19.586 76.822 1.00 22.22 H new ATOM 0 HG LEU A 441 9.195 18.001 74.558 1.00 21.13 H new ATOM 0 HD11 LEU A 441 8.964 16.113 75.933 1.00 22.48 H new ATOM 0 HD12 LEU A 441 10.177 17.004 76.428 1.00 22.48 H new ATOM 0 HD13 LEU A 441 8.791 17.056 77.194 1.00 22.48 H new ATOM 0 HD21 LEU A 441 7.018 17.169 74.748 1.00 20.60 H new ATOM 0 HD22 LEU A 441 6.752 18.136 75.974 1.00 20.60 H new ATOM 0 HD23 LEU A 441 6.989 18.737 74.527 1.00 20.60 H new ATOM 161 N LYS A 442 8.115 22.617 76.217 1.00 22.99 N ATOM 162 CA LYS A 442 8.228 23.870 76.984 1.00 23.40 C ATOM 163 C LYS A 442 7.118 23.990 78.018 1.00 23.29 C ATOM 164 O LYS A 442 5.943 23.788 77.705 1.00 22.53 O ATOM 165 CB LYS A 442 8.253 25.100 76.056 1.00 23.80 C ATOM 0 H LYS A 442 7.313 22.390 76.005 1.00 22.99 H new ATOM 0 HA LYS A 442 9.074 23.841 77.458 1.00 23.40 H new ATOM 166 N ASP A 443 7.512 24.293 79.254 1.00 24.11 N ATOM 167 CA ASP A 443 6.583 24.487 80.370 1.00 25.98 C ATOM 168 C ASP A 443 5.609 23.342 80.558 1.00 25.88 C ATOM 169 O ASP A 443 4.396 23.552 80.721 1.00 27.22 O ATOM 170 CB ASP A 443 5.821 25.813 80.240 1.00 27.85 C ATOM 171 CG ASP A 443 6.738 26.983 80.062 1.00 32.49 C ATOM 172 OD1 ASP A 443 6.331 27.948 79.379 1.00 39.67 O ATOM 173 OD2 ASP A 443 7.878 26.939 80.599 1.00 38.49 O ATOM 0 H ASP A 443 8.338 24.393 79.472 1.00 24.11 H new ATOM 0 HA ASP A 443 7.139 24.514 81.165 1.00 25.98 H new ATOM 0 HB2 ASP A 443 5.215 25.762 79.484 1.00 27.85 H new ATOM 0 HB3 ASP A 443 5.277 25.949 81.031 1.00 27.85 H new ATOM 174 N ILE A 444 6.136 22.123 80.553 1.00 24.91 N ATOM 175 CA ILE A 444 5.278 20.960 80.756 1.00 25.39 C ATOM 176 C ILE A 444 5.072 20.739 82.243 1.00 25.42 C ATOM 177 O ILE A 444 6.047 20.628 82.987 1.00 26.23 O ATOM 178 CB ILE A 444 5.877 19.670 80.125 1.00 24.57 C ATOM 179 CG1 ILE A 444 6.218 19.871 78.635 1.00 25.00 C ATOM 180 CG2 ILE A 444 4.968 18.452 80.407 1.00 22.29 C ATOM 181 CD1 ILE A 444 5.081 20.323 77.724 1.00 19.31 C ATOM 0 H ILE A 444 6.970 21.948 80.436 1.00 24.91 H new ATOM 0 HA ILE A 444 4.432 21.140 80.316 1.00 25.39 H new ATOM 0 HB ILE A 444 6.726 19.476 80.552 1.00 24.57 H new ATOM 0 HG12 ILE A 444 6.932 20.524 78.574 1.00 25.00 H new ATOM 0 HG13 ILE A 444 6.568 19.035 78.290 1.00 25.00 H new ATOM 0 HG21 ILE A 444 5.357 17.658 80.007 1.00 22.29 H new ATOM 0 HG22 ILE A 444 4.886 18.324 81.365 1.00 22.29 H new ATOM 0 HG23 ILE A 444 4.090 18.608 80.026 1.00 22.29 H new ATOM 0 HD11 ILE A 444 5.411 20.416 76.816 1.00 19.31 H new ATOM 0 HD12 ILE A 444 4.369 19.664 77.743 1.00 19.31 H new ATOM 0 HD13 ILE A 444 4.739 21.177 78.032 1.00 19.31 H new ATOM 182 N ASN A 445 3.807 20.679 82.659 1.00 27.01 N ATOM 183 CA ASN A 445 3.407 20.285 84.020 1.00 28.77 C ATOM 184 C ASN A 445 2.353 19.199 84.030 1.00 29.49 C ATOM 185 O ASN A 445 1.313 19.327 83.387 1.00 31.87 O ATOM 186 CB ASN A 445 2.836 21.472 84.789 1.00 28.86 C ATOM 187 CG ASN A 445 3.829 22.568 84.969 1.00 26.61 C ATOM 188 OD1 ASN A 445 4.562 22.581 85.946 1.00 30.38 O ATOM 189 ND2 ASN A 445 3.877 23.497 84.022 1.00 27.16 N ATOM 0 H ASN A 445 3.140 20.869 82.150 1.00 27.01 H new ATOM 0 HA ASN A 445 4.216 19.953 84.439 1.00 28.77 H new ATOM 0 HB2 ASN A 445 2.061 21.816 84.318 1.00 28.86 H new ATOM 0 HB3 ASN A 445 2.529 21.172 85.659 1.00 28.86 H new ATOM 0 HD21 ASN A 445 4.442 24.143 84.082 1.00 27.16 H new ATOM 0 HD22 ASN A 445 3.344 23.453 83.349 1.00 27.16 H new ATOM 190 N PHE A 446 2.610 18.130 84.771 1.00 30.14 N ATOM 191 CA PHE A 446 1.606 17.086 85.014 1.00 29.49 C ATOM 192 C PHE A 446 2.058 16.180 86.156 1.00 28.99 C ATOM 193 O PHE A 446 3.222 16.166 86.538 1.00 28.00 O ATOM 194 CB PHE A 446 1.264 16.266 83.735 1.00 30.23 C ATOM 195 CG PHE A 446 2.326 15.267 83.322 1.00 29.41 C ATOM 196 CD1 PHE A 446 2.371 13.997 83.889 1.00 29.31 C ATOM 197 CD2 PHE A 446 3.260 15.596 82.343 1.00 27.87 C ATOM 198 CE1 PHE A 446 3.345 13.085 83.515 1.00 28.09 C ATOM 199 CE2 PHE A 446 4.228 14.699 81.965 1.00 28.09 C ATOM 200 CZ PHE A 446 4.274 13.437 82.552 1.00 29.75 C ATOM 0 H PHE A 446 3.368 17.984 85.149 1.00 30.14 H new ATOM 0 HA PHE A 446 0.783 17.529 85.272 1.00 29.49 H new ATOM 0 HB2 PHE A 446 0.431 15.792 83.883 1.00 30.23 H new ATOM 0 HB3 PHE A 446 1.114 16.882 83.001 1.00 30.23 H new ATOM 0 HD1 PHE A 446 1.739 13.757 84.528 1.00 29.31 H new ATOM 0 HD2 PHE A 446 3.228 16.434 81.940 1.00 27.87 H new ATOM 0 HE1 PHE A 446 3.374 12.243 83.908 1.00 28.09 H new ATOM 0 HE2 PHE A 446 4.853 14.934 81.317 1.00 28.09 H new ATOM 0 HZ PHE A 446 4.930 12.830 82.296 1.00 29.75 H new ATOM 201 N LYS A 447 1.119 15.417 86.680 1.00 29.45 N ATOM 202 CA LYS A 447 1.418 14.410 87.681 1.00 30.26 C ATOM 203 C LYS A 447 0.622 13.164 87.320 1.00 30.90 C ATOM 204 O LYS A 447 -0.433 13.269 86.696 1.00 33.12 O ATOM 205 CB LYS A 447 1.035 14.917 89.072 1.00 30.70 C ATOM 0 H LYS A 447 0.288 15.467 86.466 1.00 29.45 H new ATOM 0 HA LYS A 447 2.367 14.210 87.698 1.00 30.26 H new ATOM 206 N ILE A 448 1.138 11.995 87.679 1.00 29.48 N ATOM 207 CA ILE A 448 0.411 10.743 87.470 1.00 30.11 C ATOM 208 C ILE A 448 0.495 9.921 88.746 1.00 28.54 C ATOM 209 O ILE A 448 1.562 9.783 89.326 1.00 28.12 O ATOM 210 CB ILE A 448 0.908 9.957 86.201 1.00 29.99 C ATOM 211 CG1 ILE A 448 0.045 8.733 85.902 1.00 31.43 C ATOM 212 CG2 ILE A 448 2.335 9.527 86.344 1.00 32.71 C ATOM 213 CD1 ILE A 448 0.479 8.005 84.633 1.00 31.62 C ATOM 0 H ILE A 448 1.910 11.902 88.047 1.00 29.48 H new ATOM 0 HA ILE A 448 -0.520 10.941 87.282 1.00 30.11 H new ATOM 0 HB ILE A 448 0.832 10.576 85.458 1.00 29.99 H new ATOM 0 HG12 ILE A 448 0.087 8.120 86.653 1.00 31.43 H new ATOM 0 HG13 ILE A 448 -0.881 9.008 85.812 1.00 31.43 H new ATOM 0 HG21 ILE A 448 2.610 9.047 85.547 1.00 32.71 H new ATOM 0 HG22 ILE A 448 2.898 10.308 86.461 1.00 32.71 H new ATOM 0 HG23 ILE A 448 2.423 8.947 87.117 1.00 32.71 H new ATOM 0 HD11 ILE A 448 -0.097 7.238 84.486 1.00 31.62 H new ATOM 0 HD12 ILE A 448 0.414 8.607 83.876 1.00 31.62 H new ATOM 0 HD13 ILE A 448 1.397 7.706 84.729 1.00 31.62 H new ATOM 214 N GLU A 449 -0.650 9.425 89.200 1.00 28.36 N ATOM 215 CA GLU A 449 -0.715 8.645 90.434 1.00 29.62 C ATOM 216 C GLU A 449 -0.577 7.175 90.070 1.00 27.91 C ATOM 217 O GLU A 449 -0.824 6.812 88.921 1.00 26.73 O ATOM 218 CB GLU A 449 -2.046 8.900 91.156 1.00 30.89 C ATOM 219 CG GLU A 449 -2.483 10.381 91.208 1.00 37.05 C ATOM 220 CD GLU A 449 -1.643 11.234 92.142 1.00 42.28 C ATOM 221 OE1 GLU A 449 -1.301 12.372 91.754 1.00 47.08 O ATOM 222 OE2 GLU A 449 -1.339 10.785 93.266 1.00 46.82 O ATOM 0 H GLU A 449 -1.407 9.529 88.806 1.00 28.36 H new ATOM 0 HA GLU A 449 0.001 8.906 91.034 1.00 29.62 H new ATOM 0 HB2 GLU A 449 -2.741 8.386 90.716 1.00 30.89 H new ATOM 0 HB3 GLU A 449 -1.976 8.565 92.064 1.00 30.89 H new ATOM 0 HG2 GLU A 449 -2.438 10.755 90.314 1.00 37.05 H new ATOM 0 HG3 GLU A 449 -3.411 10.426 91.488 1.00 37.05 H new ATOM 223 N ARG A 450 -0.178 6.340 91.033 1.00 27.87 N ATOM 224 CA ARG A 450 0.010 4.902 90.795 1.00 27.94 C ATOM 225 C ARG A 450 -1.270 4.271 90.269 1.00 27.23 C ATOM 226 O ARG A 450 -2.350 4.577 90.747 1.00 27.11 O ATOM 227 CB ARG A 450 0.464 4.176 92.065 1.00 29.08 C ATOM 228 CG ARG A 450 1.024 2.782 91.788 1.00 31.62 C ATOM 229 CD ARG A 450 1.208 1.962 93.059 1.00 35.79 C ATOM 0 H ARG A 450 -0.009 6.588 91.839 1.00 27.87 H new ATOM 0 HA ARG A 450 0.707 4.809 90.127 1.00 27.94 H new ATOM 0 HB2 ARG A 450 1.141 4.708 92.511 1.00 29.08 H new ATOM 0 HB3 ARG A 450 -0.286 4.102 92.675 1.00 29.08 H new ATOM 0 HG2 ARG A 450 0.426 2.311 91.187 1.00 31.62 H new ATOM 0 HG3 ARG A 450 1.877 2.864 91.334 1.00 31.62 H new ATOM 230 N GLY A 451 -1.142 3.413 89.264 1.00 26.62 N ATOM 231 CA GLY A 451 -2.292 2.720 88.695 1.00 25.37 C ATOM 232 C GLY A 451 -3.084 3.537 87.696 1.00 24.98 C ATOM 233 O GLY A 451 -4.065 3.050 87.152 1.00 25.88 O ATOM 0 H GLY A 451 -0.391 3.217 88.894 1.00 26.62 H new ATOM 0 HA2 GLY A 451 -1.985 1.909 88.261 1.00 25.37 H new ATOM 0 HA3 GLY A 451 -2.882 2.450 89.416 1.00 25.37 H new ATOM 234 N GLN A 452 -2.677 4.778 87.460 1.00 24.57 N ATOM 235 CA GLN A 452 -3.415 5.665 86.575 1.00 26.62 C ATOM 236 C GLN A 452 -3.037 5.480 85.085 1.00 25.27 C ATOM 237 O GLN A 452 -1.921 5.050 84.752 1.00 23.80 O ATOM 238 CB GLN A 452 -3.236 7.137 86.993 1.00 26.81 C ATOM 239 CG GLN A 452 -4.173 7.595 88.120 1.00 29.72 C ATOM 240 CD GLN A 452 -4.226 9.116 88.289 1.00 30.48 C ATOM 241 OE1 GLN A 452 -3.278 9.838 87.970 1.00 31.67 O ATOM 242 NE2 GLN A 452 -5.342 9.600 88.803 1.00 36.08 N ATOM 0 H GLN A 452 -1.971 5.127 87.806 1.00 24.57 H new ATOM 0 HA GLN A 452 -4.350 5.422 86.664 1.00 26.62 H new ATOM 0 HB2 GLN A 452 -2.318 7.272 87.276 1.00 26.81 H new ATOM 0 HB3 GLN A 452 -3.380 7.702 86.218 1.00 26.81 H new ATOM 0 HG2 GLN A 452 -5.068 7.265 87.941 1.00 29.72 H new ATOM 0 HG3 GLN A 452 -3.884 7.194 88.954 1.00 29.72 H new ATOM 0 HE21 GLN A 452 -5.984 9.068 89.015 1.00 36.08 H new ATOM 0 HE22 GLN A 452 -5.427 10.447 88.926 1.00 36.08 H new ATOM 243 N LEU A 453 -3.995 5.789 84.213 1.00 23.95 N ATOM 244 CA LEU A 453 -3.752 5.887 82.782 1.00 24.02 C ATOM 245 C LEU A 453 -3.781 7.344 82.315 1.00 22.45 C ATOM 246 O LEU A 453 -4.800 8.023 82.453 1.00 22.81 O ATOM 247 CB LEU A 453 -4.783 5.067 82.000 1.00 24.32 C ATOM 248 CG LEU A 453 -4.802 5.307 80.486 1.00 23.71 C ATOM 249 CD1 LEU A 453 -3.571 4.673 79.815 1.00 19.18 C ATOM 250 CD2 LEU A 453 -6.092 4.777 79.890 1.00 23.35 C ATOM 0 H LEU A 453 -4.809 5.948 84.440 1.00 23.95 H new ATOM 0 HA LEU A 453 -2.868 5.527 82.609 1.00 24.02 H new ATOM 0 HB2 LEU A 453 -4.614 4.125 82.161 1.00 24.32 H new ATOM 0 HB3 LEU A 453 -5.665 5.262 82.354 1.00 24.32 H new ATOM 0 HG LEU A 453 -4.762 6.262 80.321 1.00 23.71 H new ATOM 0 HD11 LEU A 453 -3.603 4.836 78.859 1.00 19.18 H new ATOM 0 HD12 LEU A 453 -2.764 5.065 80.183 1.00 19.18 H new ATOM 0 HD13 LEU A 453 -3.569 3.717 79.979 1.00 19.18 H new ATOM 0 HD21 LEU A 453 -6.095 4.933 78.933 1.00 23.35 H new ATOM 0 HD22 LEU A 453 -6.161 3.825 80.062 1.00 23.35 H new ATOM 0 HD23 LEU A 453 -6.847 5.233 80.294 1.00 23.35 H new ATOM 251 N LEU A 454 -2.658 7.807 81.771 1.00 20.38 N ATOM 252 CA LEU A 454 -2.554 9.136 81.165 1.00 19.34 C ATOM 253 C LEU A 454 -2.553 8.930 79.653 1.00 19.83 C ATOM 254 O LEU A 454 -1.755 8.149 79.136 1.00 18.94 O ATOM 255 CB LEU A 454 -1.259 9.846 81.611 1.00 19.35 C ATOM 256 CG LEU A 454 -0.815 11.135 80.898 1.00 18.28 C ATOM 257 CD1 LEU A 454 -1.727 12.277 81.248 1.00 14.01 C ATOM 258 CD2 LEU A 454 0.626 11.504 81.285 1.00 18.75 C ATOM 0 H LEU A 454 -1.927 7.355 81.742 1.00 20.38 H new ATOM 0 HA LEU A 454 -3.295 9.697 81.442 1.00 19.34 H new ATOM 0 HB2 LEU A 454 -1.352 10.053 82.554 1.00 19.35 H new ATOM 0 HB3 LEU A 454 -0.535 9.206 81.531 1.00 19.35 H new ATOM 0 HG LEU A 454 -0.857 10.972 79.943 1.00 18.28 H new ATOM 0 HD11 LEU A 454 -1.432 13.079 80.790 1.00 14.01 H new ATOM 0 HD12 LEU A 454 -2.633 12.064 80.974 1.00 14.01 H new ATOM 0 HD13 LEU A 454 -1.706 12.426 82.206 1.00 14.01 H new ATOM 0 HD21 LEU A 454 0.886 12.318 80.826 1.00 18.75 H new ATOM 0 HD22 LEU A 454 0.678 11.643 82.244 1.00 18.75 H new ATOM 0 HD23 LEU A 454 1.224 10.784 81.030 1.00 18.75 H new ATOM 259 N ALA A 455 -3.463 9.597 78.957 1.00 18.76 N ATOM 260 CA ALA A 455 -3.474 9.565 77.500 1.00 18.79 C ATOM 261 C ALA A 455 -2.696 10.776 77.035 1.00 19.16 C ATOM 262 O ALA A 455 -2.951 11.890 77.493 1.00 20.20 O ATOM 263 CB ALA A 455 -4.905 9.603 76.968 1.00 19.25 C ATOM 0 H ALA A 455 -4.085 10.076 79.309 1.00 18.76 H new ATOM 0 HA ALA A 455 -3.073 8.747 77.168 1.00 18.79 H new ATOM 0 HB1 ALA A 455 -4.891 9.581 75.998 1.00 19.25 H new ATOM 0 HB2 ALA A 455 -5.395 8.835 77.301 1.00 19.25 H new ATOM 0 HB3 ALA A 455 -5.340 10.417 77.266 1.00 19.25 H new ATOM 264 N VAL A 456 -1.711 10.565 76.160 1.00 18.93 N ATOM 265 CA VAL A 456 -0.960 11.674 75.616 1.00 18.09 C ATOM 266 C VAL A 456 -1.370 11.807 74.153 1.00 19.93 C ATOM 267 O VAL A 456 -1.239 10.866 73.364 1.00 19.64 O ATOM 268 CB VAL A 456 0.561 11.511 75.785 1.00 19.38 C ATOM 269 CG1 VAL A 456 1.301 12.631 75.053 1.00 18.87 C ATOM 270 CG2 VAL A 456 0.947 11.502 77.293 1.00 14.55 C ATOM 0 H VAL A 456 -1.470 9.790 75.876 1.00 18.93 H new ATOM 0 HA VAL A 456 -1.167 12.486 76.105 1.00 18.09 H new ATOM 0 HB VAL A 456 0.823 10.661 75.397 1.00 19.38 H new ATOM 0 HG11 VAL A 456 2.257 12.516 75.168 1.00 18.87 H new ATOM 0 HG12 VAL A 456 1.083 12.600 74.108 1.00 18.87 H new ATOM 0 HG13 VAL A 456 1.033 13.489 75.418 1.00 18.87 H new ATOM 0 HG21 VAL A 456 1.907 11.399 77.381 1.00 14.55 H new ATOM 0 HG22 VAL A 456 0.673 12.338 77.702 1.00 14.55 H new ATOM 0 HG23 VAL A 456 0.501 10.764 77.737 1.00 14.55 H new ATOM 271 N ALA A 457 -1.913 12.963 73.810 1.00 19.57 N ATOM 272 CA ALA A 457 -2.404 13.177 72.466 1.00 20.80 C ATOM 273 C ALA A 457 -1.757 14.407 71.824 1.00 20.27 C ATOM 274 O ALA A 457 -1.090 15.207 72.501 1.00 19.47 O ATOM 275 CB ALA A 457 -3.920 13.296 72.494 1.00 21.36 C ATOM 0 H ALA A 457 -2.006 13.634 74.340 1.00 19.57 H new ATOM 0 HA ALA A 457 -2.160 12.415 71.918 1.00 20.80 H new ATOM 0 HB1 ALA A 457 -4.250 13.440 71.593 1.00 21.36 H new ATOM 0 HB2 ALA A 457 -4.302 12.479 72.852 1.00 21.36 H new ATOM 0 HB3 ALA A 457 -4.176 14.045 73.055 1.00 21.36 H new ATOM 276 N GLY A 458 -1.901 14.517 70.501 1.00 21.18 N ATOM 277 CA GLY A 458 -1.357 15.660 69.760 1.00 21.79 C ATOM 278 C GLY A 458 -0.897 15.270 68.379 1.00 23.52 C ATOM 279 O GLY A 458 -0.650 14.095 68.093 1.00 23.45 O ATOM 0 H GLY A 458 -2.311 13.940 70.013 1.00 21.18 H new ATOM 0 HA2 GLY A 458 -2.034 16.352 69.691 1.00 21.79 H new ATOM 0 HA3 GLY A 458 -0.613 16.039 70.253 1.00 21.79 H new ATOM 280 N SER A 459 -0.744 16.261 67.511 1.00 24.39 N ATOM 281 CA SER A 459 -0.452 15.957 66.124 1.00 24.36 C ATOM 282 C SER A 459 0.998 15.512 65.988 1.00 23.53 C ATOM 283 O SER A 459 1.778 15.595 66.952 1.00 23.24 O ATOM 284 CB SER A 459 -0.805 17.139 65.228 1.00 25.58 C ATOM 285 OG SER A 459 -0.079 18.270 65.606 1.00 29.26 O ATOM 0 H SER A 459 -0.804 17.098 67.701 1.00 24.39 H new ATOM 0 HA SER A 459 -1.006 15.218 65.826 1.00 24.36 H new ATOM 0 HB2 SER A 459 -0.614 16.919 64.303 1.00 25.58 H new ATOM 0 HB3 SER A 459 -1.756 17.323 65.286 1.00 25.58 H new ATOM 0 HG SER A 459 -0.418 18.602 66.300 1.00 29.26 H new ATOM 286 N THR A 460 1.336 14.985 64.814 1.00 21.80 N ATOM 287 CA THR A 460 2.682 14.546 64.508 1.00 22.29 C ATOM 288 C THR A 460 3.699 15.662 64.801 1.00 22.22 C ATOM 289 O THR A 460 3.482 16.807 64.411 1.00 22.39 O ATOM 290 CB THR A 460 2.783 13.988 63.034 1.00 22.89 C ATOM 291 OG1 THR A 460 4.096 13.471 62.787 1.00 24.21 O ATOM 292 CG2 THR A 460 2.447 15.065 61.984 1.00 23.86 C ATOM 0 H THR A 460 0.779 14.873 64.168 1.00 21.80 H new ATOM 0 HA THR A 460 2.906 13.804 65.092 1.00 22.29 H new ATOM 0 HB THR A 460 2.129 13.276 62.952 1.00 22.89 H new ATOM 0 HG1 THR A 460 4.369 13.062 63.468 1.00 24.21 H new ATOM 0 HG21 THR A 460 2.520 14.684 61.095 1.00 23.86 H new ATOM 0 HG22 THR A 460 1.542 15.384 62.125 1.00 23.86 H new ATOM 0 HG23 THR A 460 3.067 15.806 62.070 1.00 23.86 H new ATOM 293 N GLY A 461 4.773 15.333 65.529 1.00 21.54 N ATOM 294 CA GLY A 461 5.833 16.301 65.834 1.00 22.01 C ATOM 295 C GLY A 461 5.586 17.191 67.047 1.00 21.25 C ATOM 296 O GLY A 461 6.423 18.033 67.359 1.00 21.79 O ATOM 0 H GLY A 461 4.906 14.549 65.857 1.00 21.54 H new ATOM 0 HA2 GLY A 461 6.661 15.816 65.973 1.00 22.01 H new ATOM 0 HA3 GLY A 461 5.963 16.868 65.058 1.00 22.01 H new ATOM 297 N ALA A 462 4.472 16.977 67.756 1.00 20.26 N ATOM 298 CA ALA A 462 4.126 17.790 68.928 1.00 20.51 C ATOM 299 C ALA A 462 5.059 17.607 70.127 1.00 20.75 C ATOM 300 O ALA A 462 5.195 18.518 70.939 1.00 21.93 O ATOM 301 CB ALA A 462 2.661 17.556 69.362 1.00 18.96 C ATOM 0 H ALA A 462 3.900 16.361 67.573 1.00 20.26 H new ATOM 0 HA ALA A 462 4.240 18.707 68.633 1.00 20.51 H new ATOM 0 HB1 ALA A 462 2.461 18.105 70.136 1.00 18.96 H new ATOM 0 HB2 ALA A 462 2.066 17.795 68.634 1.00 18.96 H new ATOM 0 HB3 ALA A 462 2.536 16.621 69.588 1.00 18.96 H new ATOM 302 N GLY A 463 5.710 16.452 70.239 1.00 19.10 N ATOM 303 CA GLY A 463 6.642 16.218 71.341 1.00 17.52 C ATOM 304 C GLY A 463 6.289 15.024 72.221 1.00 17.67 C ATOM 305 O GLY A 463 6.845 14.876 73.309 1.00 17.47 O ATOM 0 H GLY A 463 5.628 15.794 69.691 1.00 19.10 H new ATOM 0 HA2 GLY A 463 7.531 16.085 70.976 1.00 17.52 H new ATOM 0 HA3 GLY A 463 6.678 17.014 71.894 1.00 17.52 H new ATOM 306 N LYS A 464 5.380 14.169 71.747 1.00 16.19 N ATOM 307 CA LYS A 464 4.833 13.083 72.574 1.00 15.89 C ATOM 308 C LYS A 464 5.893 12.035 72.929 1.00 15.83 C ATOM 309 O LYS A 464 6.058 11.700 74.096 1.00 15.04 O ATOM 310 CB LYS A 464 3.606 12.433 71.914 1.00 15.17 C ATOM 311 CG LYS A 464 2.509 13.423 71.492 1.00 16.91 C ATOM 312 CD LYS A 464 1.278 12.696 70.852 1.00 15.12 C ATOM 313 CE LYS A 464 1.575 12.045 69.458 1.00 18.45 C ATOM 314 NZ LYS A 464 2.173 13.037 68.490 1.00 17.74 N ATOM 0 H LYS A 464 5.065 14.199 70.947 1.00 16.19 H new ATOM 0 HA LYS A 464 4.542 13.486 73.407 1.00 15.89 H new ATOM 0 HB2 LYS A 464 3.898 11.939 71.132 1.00 15.17 H new ATOM 0 HB3 LYS A 464 3.224 11.789 72.531 1.00 15.17 H new ATOM 0 HG2 LYS A 464 2.218 13.931 72.265 1.00 16.91 H new ATOM 0 HG3 LYS A 464 2.875 14.058 70.857 1.00 16.91 H new ATOM 0 HD2 LYS A 464 0.969 12.007 71.461 1.00 15.12 H new ATOM 0 HD3 LYS A 464 0.553 13.333 70.753 1.00 15.12 H new ATOM 0 HE2 LYS A 464 2.184 11.299 69.573 1.00 18.45 H new ATOM 0 HE3 LYS A 464 0.754 11.687 69.087 1.00 18.45 H new ATOM 0 HZ1 LYS A 464 2.329 12.635 67.711 1.00 17.74 H new ATOM 0 HZ2 LYS A 464 1.605 13.711 68.367 1.00 17.74 H new ATOM 0 HZ3 LYS A 464 2.938 13.350 68.820 1.00 17.74 H new ATOM 315 N THR A 465 6.621 11.536 71.931 1.00 17.26 N ATOM 316 CA THR A 465 7.740 10.608 72.173 1.00 16.44 C ATOM 317 C THR A 465 8.869 11.294 72.944 1.00 16.86 C ATOM 318 O THR A 465 9.452 10.685 73.837 1.00 16.56 O ATOM 319 CB THR A 465 8.257 9.978 70.851 1.00 16.85 C ATOM 320 OG1 THR A 465 7.171 9.286 70.212 1.00 14.90 O ATOM 321 CG2 THR A 465 9.381 8.986 71.081 1.00 19.86 C ATOM 0 H THR A 465 6.487 11.720 71.102 1.00 17.26 H new ATOM 0 HA THR A 465 7.404 9.884 72.724 1.00 16.44 H new ATOM 0 HB THR A 465 8.600 10.699 70.300 1.00 16.85 H new ATOM 0 HG21 THR A 465 9.670 8.621 70.230 1.00 19.86 H new ATOM 0 HG22 THR A 465 10.127 9.435 71.509 1.00 19.86 H new ATOM 0 HG23 THR A 465 9.067 8.267 71.651 1.00 19.86 H new ATOM 322 N SER A 466 9.155 12.564 72.635 1.00 16.29 N ATOM 323 CA SER A 466 10.155 13.301 73.383 1.00 17.81 C ATOM 324 C SER A 466 9.805 13.357 74.875 1.00 17.32 C ATOM 325 O SER A 466 10.699 13.196 75.702 1.00 16.41 O ATOM 326 CB SER A 466 10.413 14.686 72.781 1.00 18.46 C ATOM 327 OG SER A 466 10.795 14.519 71.421 1.00 19.67 O ATOM 0 H SER A 466 8.780 13.006 72.000 1.00 16.29 H new ATOM 0 HA SER A 466 10.993 12.818 73.311 1.00 17.81 H new ATOM 0 HB2 SER A 466 9.616 15.235 72.843 1.00 18.46 H new ATOM 0 HB3 SER A 466 11.112 15.144 73.274 1.00 18.46 H new ATOM 0 HG SER A 466 10.127 14.639 70.925 1.00 19.67 H new ATOM 328 N LEU A 467 8.519 13.505 75.204 1.00 17.44 N ATOM 329 CA LEU A 467 8.068 13.476 76.605 1.00 18.04 C ATOM 330 C LEU A 467 8.397 12.131 77.263 1.00 17.71 C ATOM 331 O LEU A 467 8.923 12.089 78.378 1.00 18.88 O ATOM 332 CB LEU A 467 6.557 13.723 76.686 1.00 18.74 C ATOM 333 CG LEU A 467 5.850 13.852 78.045 1.00 19.08 C ATOM 334 CD1 LEU A 467 5.989 15.279 78.515 1.00 25.24 C ATOM 335 CD2 LEU A 467 4.378 13.548 77.899 1.00 23.12 C ATOM 0 H LEU A 467 7.889 13.624 74.631 1.00 17.44 H new ATOM 0 HA LEU A 467 8.537 14.180 77.080 1.00 18.04 H new ATOM 0 HB2 LEU A 467 6.375 14.538 76.192 1.00 18.74 H new ATOM 0 HB3 LEU A 467 6.124 12.999 76.208 1.00 18.74 H new ATOM 0 HG LEU A 467 6.248 13.230 78.675 1.00 19.08 H new ATOM 0 HD11 LEU A 467 5.548 15.382 79.373 1.00 25.24 H new ATOM 0 HD12 LEU A 467 6.929 15.500 78.606 1.00 25.24 H new ATOM 0 HD13 LEU A 467 5.579 15.874 77.868 1.00 25.24 H new ATOM 0 HD21 LEU A 467 3.943 13.632 78.762 1.00 23.12 H new ATOM 0 HD22 LEU A 467 3.979 14.173 77.273 1.00 23.12 H new ATOM 0 HD23 LEU A 467 4.266 12.643 77.568 1.00 23.12 H new ATOM 336 N LEU A 468 8.076 11.037 76.576 1.00 16.70 N ATOM 337 CA LEU A 468 8.433 9.690 77.051 1.00 16.29 C ATOM 338 C LEU A 468 9.945 9.559 77.221 1.00 17.84 C ATOM 339 O LEU A 468 10.418 9.017 78.237 1.00 18.25 O ATOM 340 CB LEU A 468 7.911 8.619 76.087 1.00 14.00 C ATOM 341 CG LEU A 468 6.402 8.634 75.770 1.00 17.84 C ATOM 342 CD1 LEU A 468 6.035 7.424 74.903 1.00 14.69 C ATOM 343 CD2 LEU A 468 5.623 8.646 77.053 1.00 16.29 C ATOM 0 H LEU A 468 7.650 11.048 75.829 1.00 16.70 H new ATOM 0 HA LEU A 468 8.014 9.556 77.916 1.00 16.29 H new ATOM 0 HB2 LEU A 468 8.395 8.705 75.251 1.00 14.00 H new ATOM 0 HB3 LEU A 468 8.133 7.749 76.455 1.00 14.00 H new ATOM 0 HG LEU A 468 6.179 9.434 75.269 1.00 17.84 H new ATOM 0 HD11 LEU A 468 5.085 7.441 74.709 1.00 14.69 H new ATOM 0 HD12 LEU A 468 6.535 7.457 74.073 1.00 14.69 H new ATOM 0 HD13 LEU A 468 6.252 6.607 75.379 1.00 14.69 H new ATOM 0 HD21 LEU A 468 4.673 8.655 76.855 1.00 16.29 H new ATOM 0 HD22 LEU A 468 5.837 7.853 77.569 1.00 16.29 H new ATOM 0 HD23 LEU A 468 5.854 9.437 77.565 1.00 16.29 H new ATOM 344 N MET A 469 10.707 10.061 76.246 1.00 17.70 N ATOM 345 CA MET A 469 12.176 10.109 76.349 1.00 19.36 C ATOM 346 C MET A 469 12.705 10.836 77.609 1.00 20.81 C ATOM 347 O MET A 469 13.736 10.437 78.185 1.00 20.30 O ATOM 348 CB MET A 469 12.805 10.699 75.070 1.00 20.69 C ATOM 349 CG MET A 469 12.630 9.821 73.820 1.00 21.06 C ATOM 350 SD MET A 469 13.526 8.257 73.931 1.00 28.80 S ATOM 351 CE MET A 469 12.685 7.277 72.667 1.00 25.35 C ATOM 0 H MET A 469 10.394 10.381 75.512 1.00 17.70 H new ATOM 0 HA MET A 469 12.455 9.185 76.445 1.00 19.36 H new ATOM 0 HB2 MET A 469 12.411 11.569 74.900 1.00 20.69 H new ATOM 0 HB3 MET A 469 13.752 10.841 75.223 1.00 20.69 H new ATOM 0 HG2 MET A 469 11.686 9.639 73.687 1.00 21.06 H new ATOM 0 HG3 MET A 469 12.937 10.310 73.041 1.00 21.06 H new ATOM 0 HE1 MET A 469 13.082 6.393 72.626 1.00 25.35 H new ATOM 0 HE2 MET A 469 11.744 7.199 72.891 1.00 25.35 H new ATOM 0 HE3 MET A 469 12.777 7.713 71.805 1.00 25.35 H new ATOM 352 N MET A 470 12.014 11.893 78.031 1.00 22.21 N ATOM 353 CA MET A 470 12.393 12.625 79.250 1.00 24.83 C ATOM 354 C MET A 470 12.226 11.768 80.497 1.00 23.94 C ATOM 355 O MET A 470 13.061 11.790 81.390 1.00 24.40 O ATOM 356 CB MET A 470 11.555 13.888 79.423 1.00 24.57 C ATOM 357 CG MET A 470 11.708 14.904 78.307 1.00 28.28 C ATOM 358 SD MET A 470 11.531 16.588 78.940 1.00 29.88 S ATOM 359 CE MET A 470 13.031 16.627 79.916 1.00 28.48 C ATOM 0 H MET A 470 11.321 12.206 77.629 1.00 22.21 H new ATOM 0 HA MET A 470 13.328 12.862 79.144 1.00 24.83 H new ATOM 0 HB2 MET A 470 10.621 13.636 79.489 1.00 24.57 H new ATOM 0 HB3 MET A 470 11.795 14.309 80.263 1.00 24.57 H new ATOM 0 HG2 MET A 470 12.577 14.802 77.888 1.00 28.28 H new ATOM 0 HG3 MET A 470 11.041 14.740 77.622 1.00 28.28 H new ATOM 0 HE1 MET A 470 12.935 17.275 80.631 1.00 28.48 H new ATOM 0 HE2 MET A 470 13.194 15.749 80.295 1.00 28.48 H new ATOM 0 HE3 MET A 470 13.778 16.878 79.351 1.00 28.48 H new ATOM 360 N ILE A 471 11.115 11.047 80.568 1.00 24.46 N ATOM 361 CA ILE A 471 10.846 10.151 81.686 1.00 24.35 C ATOM 362 C ILE A 471 11.916 9.074 81.736 1.00 24.01 C ATOM 363 O ILE A 471 12.351 8.670 82.813 1.00 24.64 O ATOM 364 CB ILE A 471 9.442 9.498 81.561 1.00 24.50 C ATOM 365 CG1 ILE A 471 8.365 10.587 81.514 1.00 22.10 C ATOM 366 CG2 ILE A 471 9.221 8.505 82.698 1.00 23.11 C ATOM 367 CD1 ILE A 471 6.968 10.062 81.190 1.00 23.60 C ATOM 0 H ILE A 471 10.496 11.063 79.971 1.00 24.46 H new ATOM 0 HA ILE A 471 10.861 10.669 82.506 1.00 24.35 H new ATOM 0 HB ILE A 471 9.384 8.997 80.732 1.00 24.50 H new ATOM 0 HG12 ILE A 471 8.340 11.041 82.371 1.00 22.10 H new ATOM 0 HG13 ILE A 471 8.615 11.248 80.849 1.00 22.10 H new ATOM 0 HG21 ILE A 471 8.342 8.103 82.611 1.00 23.11 H new ATOM 0 HG22 ILE A 471 9.898 7.812 82.659 1.00 23.11 H new ATOM 0 HG23 ILE A 471 9.282 8.968 83.548 1.00 23.11 H new ATOM 0 HD11 ILE A 471 6.340 10.801 81.177 1.00 23.60 H new ATOM 0 HD12 ILE A 471 6.978 9.630 80.321 1.00 23.60 H new ATOM 0 HD13 ILE A 471 6.698 9.421 81.866 1.00 23.60 H new ATOM 368 N MET A 472 12.343 8.618 80.565 1.00 23.84 N ATOM 369 CA MET A 472 13.336 7.546 80.466 1.00 24.37 C ATOM 370 C MET A 472 14.794 7.985 80.647 1.00 25.58 C ATOM 371 O MET A 472 15.676 7.141 80.641 1.00 26.07 O ATOM 372 CB MET A 472 13.172 6.781 79.151 1.00 24.80 C ATOM 373 CG MET A 472 11.919 5.898 79.120 1.00 23.79 C ATOM 374 SD MET A 472 11.799 4.917 77.605 1.00 24.38 S ATOM 375 CE MET A 472 11.335 6.214 76.438 1.00 21.12 C ATOM 0 H MET A 472 12.069 8.917 79.807 1.00 23.84 H new ATOM 0 HA MET A 472 13.150 6.965 81.221 1.00 24.37 H new ATOM 0 HB2 MET A 472 13.133 7.415 78.418 1.00 24.80 H new ATOM 0 HB3 MET A 472 13.955 6.227 79.006 1.00 24.80 H new ATOM 0 HG2 MET A 472 11.927 5.304 79.887 1.00 23.79 H new ATOM 0 HG3 MET A 472 11.131 6.457 79.203 1.00 23.79 H new ATOM 0 HE1 MET A 472 10.436 6.050 76.112 1.00 21.12 H new ATOM 0 HE2 MET A 472 11.365 7.076 76.883 1.00 21.12 H new ATOM 0 HE3 MET A 472 11.954 6.214 75.691 1.00 21.12 H new ATOM 376 N GLY A 473 15.048 9.284 80.811 1.00 26.24 N ATOM 377 CA GLY A 473 16.423 9.781 81.021 1.00 27.40 C ATOM 378 C GLY A 473 17.217 10.092 79.756 1.00 27.94 C ATOM 379 O GLY A 473 18.376 10.541 79.833 1.00 28.92 O ATOM 0 H GLY A 473 14.445 9.897 80.805 1.00 26.24 H new ATOM 0 HA2 GLY A 473 16.379 10.586 81.561 1.00 27.40 H new ATOM 0 HA3 GLY A 473 16.913 9.120 81.536 1.00 27.40 H new ATOM 380 N GLU A 474 16.602 9.863 78.596 1.00 27.44 N ATOM 381 CA GLU A 474 17.232 10.090 77.295 1.00 28.81 C ATOM 382 C GLU A 474 17.260 11.570 76.865 1.00 29.06 C ATOM 383 O GLU A 474 18.080 11.971 76.035 1.00 28.80 O ATOM 384 CB GLU A 474 16.539 9.245 76.214 1.00 29.31 C ATOM 385 CG GLU A 474 16.549 7.726 76.458 1.00 32.86 C ATOM 386 CD GLU A 474 17.954 7.113 76.401 1.00 38.68 C ATOM 387 OE1 GLU A 474 18.869 7.723 75.798 1.00 39.59 O ATOM 388 OE2 GLU A 474 18.141 6.010 76.959 1.00 41.64 O ATOM 0 H GLU A 474 15.796 9.567 78.542 1.00 27.44 H new ATOM 0 HA GLU A 474 18.157 9.816 77.395 1.00 28.81 H new ATOM 0 HB2 GLU A 474 15.618 9.539 76.136 1.00 29.31 H new ATOM 0 HB3 GLU A 474 16.967 9.423 75.362 1.00 29.31 H new ATOM 0 HG2 GLU A 474 16.157 7.541 77.326 1.00 32.86 H new ATOM 0 HG3 GLU A 474 15.987 7.294 75.795 1.00 32.86 H new ATOM 389 N LEU A 475 16.369 12.367 77.442 1.00 29.02 N ATOM 390 CA LEU A 475 16.276 13.781 77.147 1.00 29.73 C ATOM 391 C LEU A 475 16.239 14.447 78.502 1.00 30.27 C ATOM 392 O LEU A 475 15.352 14.156 79.308 1.00 28.12 O ATOM 393 CB LEU A 475 14.975 14.098 76.385 1.00 29.84 C ATOM 394 CG LEU A 475 14.865 15.257 75.372 1.00 32.92 C ATOM 395 CD1 LEU A 475 13.535 15.946 75.498 1.00 32.24 C ATOM 396 CD2 LEU A 475 16.012 16.271 75.418 1.00 31.96 C ATOM 0 H LEU A 475 15.796 12.094 78.023 1.00 29.02 H new ATOM 0 HA LEU A 475 17.012 14.083 76.592 1.00 29.73 H new ATOM 0 HB2 LEU A 475 14.729 13.290 75.909 1.00 29.84 H new ATOM 0 HB3 LEU A 475 14.291 14.251 77.056 1.00 29.84 H new ATOM 0 HG LEU A 475 14.938 14.839 74.500 1.00 32.92 H new ATOM 0 HD11 LEU A 475 13.483 16.670 74.855 1.00 32.24 H new ATOM 0 HD12 LEU A 475 12.823 15.310 75.326 1.00 32.24 H new ATOM 0 HD13 LEU A 475 13.439 16.303 76.395 1.00 32.24 H new ATOM 0 HD21 LEU A 475 15.862 16.960 74.752 1.00 31.96 H new ATOM 0 HD22 LEU A 475 16.051 16.676 76.299 1.00 31.96 H new ATOM 0 HD23 LEU A 475 16.851 15.820 75.232 1.00 31.96 H new ATOM 397 N GLU A 476 17.214 15.321 78.766 1.00 30.96 N ATOM 398 CA GLU A 476 17.271 16.019 80.053 1.00 32.58 C ATOM 399 C GLU A 476 16.650 17.426 79.990 1.00 31.20 C ATOM 400 O GLU A 476 16.758 18.106 78.966 1.00 31.20 O ATOM 401 CB GLU A 476 18.710 16.029 80.585 1.00 32.93 C ATOM 402 CG GLU A 476 19.197 14.610 80.902 1.00 34.57 C ATOM 403 CD GLU A 476 20.677 14.510 81.205 1.00 36.34 C ATOM 404 OE1 GLU A 476 21.451 15.405 80.793 1.00 41.96 O ATOM 405 OE2 GLU A 476 21.071 13.515 81.855 1.00 41.92 O ATOM 0 H GLU A 476 17.846 15.522 78.219 1.00 30.96 H new ATOM 0 HA GLU A 476 16.723 15.528 80.686 1.00 32.58 H new ATOM 0 HB2 GLU A 476 19.297 16.435 79.928 1.00 32.93 H new ATOM 0 HB3 GLU A 476 18.758 16.576 81.385 1.00 32.93 H new ATOM 0 HG2 GLU A 476 18.699 14.271 81.662 1.00 34.57 H new ATOM 0 HG3 GLU A 476 18.992 14.034 80.149 1.00 34.57 H new ATOM 406 N PRO A 477 15.975 17.849 81.077 1.00 31.20 N ATOM 407 CA PRO A 477 15.367 19.183 81.119 1.00 31.77 C ATOM 408 C PRO A 477 16.385 20.316 81.196 1.00 32.22 C ATOM 409 O PRO A 477 17.434 20.173 81.822 1.00 33.06 O ATOM 410 CB PRO A 477 14.510 19.163 82.393 1.00 30.77 C ATOM 411 CG PRO A 477 14.534 17.760 82.895 1.00 32.29 C ATOM 412 CD PRO A 477 15.734 17.095 82.321 1.00 31.08 C ATOM 0 HA PRO A 477 14.867 19.355 80.306 1.00 31.77 H new ATOM 0 HB2 PRO A 477 14.865 19.774 83.058 1.00 30.77 H new ATOM 0 HB3 PRO A 477 13.602 19.447 82.203 1.00 30.77 H new ATOM 0 HG2 PRO A 477 14.568 17.746 83.864 1.00 32.29 H new ATOM 0 HG3 PRO A 477 13.727 17.291 82.633 1.00 32.29 H new ATOM 0 HD2 PRO A 477 16.493 17.144 82.923 1.00 31.08 H new ATOM 0 HD3 PRO A 477 15.573 16.155 82.145 1.00 31.08 H new ATOM 413 N SER A 478 16.066 21.418 80.528 1.00 33.59 N ATOM 414 CA SER A 478 16.850 22.657 80.583 1.00 34.19 C ATOM 415 C SER A 478 16.336 23.516 81.722 1.00 33.69 C ATOM 416 O SER A 478 17.105 24.226 82.364 1.00 34.32 O ATOM 417 CB SER A 478 16.715 23.426 79.268 1.00 33.71 C ATOM 418 OG SER A 478 17.307 22.698 78.210 1.00 38.83 O ATOM 0 H SER A 478 15.375 21.472 80.019 1.00 33.59 H new ATOM 0 HA SER A 478 17.784 22.438 80.725 1.00 34.19 H new ATOM 0 HB2 SER A 478 15.778 23.586 79.074 1.00 33.71 H new ATOM 0 HB3 SER A 478 17.140 24.294 79.349 1.00 33.71 H new ATOM 0 HG SER A 478 16.993 21.919 78.196 1.00 38.83 H new ATOM 419 N GLU A 479 15.022 23.454 81.939 1.00 33.01 N ATOM 420 CA GLU A 479 14.330 24.078 83.067 1.00 32.57 C ATOM 421 C GLU A 479 13.460 22.982 83.681 1.00 30.89 C ATOM 422 O GLU A 479 12.992 22.080 82.963 1.00 28.08 O ATOM 423 CB GLU A 479 13.383 25.187 82.595 1.00 31.37 C ATOM 424 CG GLU A 479 13.980 26.481 82.116 1.00 36.67 C ATOM 425 CD GLU A 479 12.887 27.482 81.693 1.00 37.04 C ATOM 426 OE1 GLU A 479 12.798 27.806 80.481 1.00 43.04 O ATOM 427 OE2 GLU A 479 12.091 27.910 82.566 1.00 41.14 O ATOM 0 H GLU A 479 14.489 23.031 81.413 1.00 33.01 H new ATOM 0 HA GLU A 479 14.977 24.459 83.681 1.00 32.57 H new ATOM 0 HB2 GLU A 479 12.842 24.827 81.875 1.00 31.37 H new ATOM 0 HB3 GLU A 479 12.781 25.393 83.327 1.00 31.37 H new ATOM 0 HG2 GLU A 479 14.522 26.870 82.821 1.00 36.67 H new ATOM 0 HG3 GLU A 479 14.571 26.309 81.366 1.00 36.67 H new ATOM 428 N GLY A 480 13.223 23.087 84.989 1.00 30.21 N ATOM 429 CA GLY A 480 12.237 22.275 85.693 1.00 30.09 C ATOM 430 C GLY A 480 12.711 20.918 86.179 1.00 30.15 C ATOM 431 O GLY A 480 13.885 20.564 86.041 1.00 30.84 O ATOM 0 H GLY A 480 13.639 23.642 85.498 1.00 30.21 H new ATOM 0 HA2 GLY A 480 11.918 22.778 86.458 1.00 30.09 H new ATOM 0 HA3 GLY A 480 11.477 22.140 85.105 1.00 30.09 H new ATOM 432 N LYS A 481 11.777 20.153 86.728 1.00 30.69 N ATOM 433 CA LYS A 481 12.084 18.886 87.378 1.00 30.73 C ATOM 434 C LYS A 481 11.184 17.746 86.918 1.00 31.16 C ATOM 435 O LYS A 481 9.982 17.932 86.700 1.00 31.02 O ATOM 436 CB LYS A 481 11.989 19.040 88.901 1.00 31.04 C ATOM 0 H LYS A 481 10.941 20.355 86.734 1.00 30.69 H new ATOM 0 HA LYS A 481 12.990 18.653 87.121 1.00 30.73 H new ATOM 437 N ILE A 482 11.787 16.567 86.779 1.00 31.33 N ATOM 438 CA ILE A 482 11.060 15.324 86.557 1.00 32.10 C ATOM 439 C ILE A 482 11.283 14.398 87.746 1.00 32.06 C ATOM 440 O ILE A 482 12.416 14.056 88.059 1.00 33.12 O ATOM 441 CB ILE A 482 11.497 14.614 85.260 1.00 32.53 C ATOM 442 CG1 ILE A 482 11.575 15.612 84.115 1.00 31.80 C ATOM 443 CG2 ILE A 482 10.539 13.450 84.932 1.00 29.63 C ATOM 444 CD1 ILE A 482 12.290 15.080 82.921 1.00 39.51 C ATOM 0 H ILE A 482 12.641 16.468 86.812 1.00 31.33 H new ATOM 0 HA ILE A 482 10.119 15.542 86.464 1.00 32.10 H new ATOM 0 HB ILE A 482 12.382 14.238 85.389 1.00 32.53 H new ATOM 0 HG12 ILE A 482 10.676 15.871 83.858 1.00 31.80 H new ATOM 0 HG13 ILE A 482 12.025 16.414 84.423 1.00 31.80 H new ATOM 0 HG21 ILE A 482 10.827 13.014 84.115 1.00 29.63 H new ATOM 0 HG22 ILE A 482 10.547 12.809 85.660 1.00 29.63 H new ATOM 0 HG23 ILE A 482 9.640 13.794 84.815 1.00 29.63 H new ATOM 0 HD11 ILE A 482 12.308 15.757 82.226 1.00 39.51 H new ATOM 0 HD12 ILE A 482 13.198 14.844 83.166 1.00 39.51 H new ATOM 0 HD13 ILE A 482 11.829 14.292 82.592 1.00 39.51 H new ATOM 445 N LYS A 483 10.197 14.034 88.425 1.00 31.01 N ATOM 446 CA LYS A 483 10.262 13.091 89.529 1.00 29.83 C ATOM 447 C LYS A 483 9.614 11.775 89.132 1.00 28.55 C ATOM 448 O LYS A 483 8.412 11.718 88.877 1.00 28.46 O ATOM 449 CB LYS A 483 9.544 13.632 90.770 1.00 29.86 C ATOM 0 H LYS A 483 9.406 14.328 88.257 1.00 31.01 H new ATOM 0 HA LYS A 483 11.199 12.955 89.739 1.00 29.83 H new ATOM 450 N HIS A 484 10.423 10.723 89.112 1.00 27.12 N ATOM 451 CA HIS A 484 9.936 9.368 88.926 1.00 25.43 C ATOM 452 C HIS A 484 10.950 8.379 89.467 1.00 25.26 C ATOM 453 O HIS A 484 12.153 8.552 89.282 1.00 25.45 O ATOM 454 CB HIS A 484 9.679 9.055 87.440 1.00 25.43 C ATOM 455 CG HIS A 484 9.309 7.622 87.203 1.00 19.47 C ATOM 456 ND1 HIS A 484 10.166 6.723 86.620 1.00 21.35 N ATOM 457 CD2 HIS A 484 8.213 6.916 87.562 1.00 20.56 C ATOM 458 CE1 HIS A 484 9.594 5.531 86.582 1.00 19.38 C ATOM 459 NE2 HIS A 484 8.403 5.625 87.141 1.00 21.07 N ATOM 0 H HIS A 484 11.276 10.778 89.207 1.00 27.12 H new ATOM 0 HA HIS A 484 9.097 9.290 89.407 1.00 25.43 H new ATOM 0 HB2 HIS A 484 8.967 9.627 87.112 1.00 25.43 H new ATOM 0 HB3 HIS A 484 10.474 9.268 86.927 1.00 25.43 H new ATOM 0 HD1 HIS A 484 10.953 6.906 86.325 1.00 21.35 H new ATOM 0 HD2 HIS A 484 7.468 7.245 88.011 1.00 20.56 H new ATOM 0 HE1 HIS A 484 9.968 4.759 86.223 1.00 19.38 H new ATOM 460 N SER A 485 10.462 7.329 90.110 1.00 24.58 N ATOM 461 CA SER A 485 11.334 6.215 90.468 1.00 25.11 C ATOM 462 C SER A 485 10.625 4.918 90.182 1.00 22.55 C ATOM 463 O SER A 485 9.568 4.658 90.717 1.00 23.92 O ATOM 464 CB SER A 485 11.728 6.276 91.953 1.00 26.10 C ATOM 465 OG SER A 485 12.798 5.361 92.217 1.00 31.40 O ATOM 0 H SER A 485 9.640 7.239 90.347 1.00 24.58 H new ATOM 0 HA SER A 485 12.145 6.273 89.939 1.00 25.11 H new ATOM 0 HB2 SER A 485 11.999 7.178 92.186 1.00 26.10 H new ATOM 0 HB3 SER A 485 10.962 6.058 92.507 1.00 26.10 H new ATOM 0 HG SER A 485 13.008 5.402 93.029 1.00 31.40 H new ATOM 466 N GLY A 486 11.194 4.099 89.319 1.00 23.12 N ATOM 467 CA GLY A 486 10.627 2.781 89.107 1.00 20.27 C ATOM 468 C GLY A 486 11.097 2.219 87.795 1.00 19.73 C ATOM 469 O GLY A 486 11.737 2.912 86.991 1.00 18.67 O ATOM 0 H GLY A 486 11.894 4.280 88.854 1.00 23.12 H new ATOM 0 HA2 GLY A 486 10.886 2.190 89.831 1.00 20.27 H new ATOM 0 HA3 GLY A 486 9.658 2.833 89.116 1.00 20.27 H new ATOM 470 N ARG A 487 10.784 0.948 87.584 1.00 18.77 N ATOM 471 CA ARG A 487 11.179 0.283 86.353 1.00 19.53 C ATOM 472 C ARG A 487 10.245 0.686 85.214 1.00 18.79 C ATOM 473 O ARG A 487 9.014 0.665 85.353 1.00 19.44 O ATOM 474 CB ARG A 487 11.184 -1.237 86.531 1.00 19.48 C ATOM 475 CG ARG A 487 11.705 -1.989 85.311 1.00 19.61 C ATOM 476 CD ARG A 487 11.480 -3.452 85.514 1.00 26.25 C ATOM 477 NE ARG A 487 12.491 -4.019 86.390 1.00 29.08 N ATOM 478 CZ ARG A 487 12.344 -5.130 87.108 1.00 26.39 C ATOM 479 NH1 ARG A 487 13.358 -5.548 87.841 1.00 22.87 N ATOM 480 NH2 ARG A 487 11.190 -5.800 87.121 1.00 23.92 N ATOM 0 H ARG A 487 10.346 0.456 88.137 1.00 18.77 H new ATOM 0 HA ARG A 487 12.081 0.562 86.130 1.00 19.53 H new ATOM 0 HB2 ARG A 487 11.730 -1.464 87.300 1.00 19.48 H new ATOM 0 HB3 ARG A 487 10.282 -1.536 86.726 1.00 19.48 H new ATOM 0 HG2 ARG A 487 11.248 -1.687 84.510 1.00 19.61 H new ATOM 0 HG3 ARG A 487 12.650 -1.809 85.184 1.00 19.61 H new ATOM 0 HD2 ARG A 487 10.600 -3.597 85.894 1.00 26.25 H new ATOM 0 HD3 ARG A 487 11.498 -3.907 84.658 1.00 26.25 H new ATOM 0 HE ARG A 487 13.242 -3.605 86.449 1.00 29.08 H new ATOM 0 HH11 ARG A 487 14.095 -5.105 87.848 1.00 22.87 H new ATOM 0 HH12 ARG A 487 13.282 -6.264 88.312 1.00 22.87 H new ATOM 0 HH21 ARG A 487 10.522 -5.516 86.659 1.00 23.92 H new ATOM 0 HH22 ARG A 487 11.114 -6.516 87.591 1.00 23.92 H new ATOM 481 N ILE A 488 10.843 1.025 84.082 1.00 18.45 N ATOM 482 CA ILE A 488 10.078 1.452 82.925 1.00 18.47 C ATOM 483 C ILE A 488 10.023 0.366 81.863 1.00 18.19 C ATOM 484 O ILE A 488 11.032 -0.230 81.534 1.00 17.99 O ATOM 485 CB ILE A 488 10.641 2.762 82.324 1.00 18.25 C ATOM 486 CG1 ILE A 488 10.482 3.896 83.338 1.00 16.94 C ATOM 487 CG2 ILE A 488 9.903 3.104 81.034 1.00 19.60 C ATOM 488 CD1 ILE A 488 11.204 5.117 83.002 1.00 14.87 C ATOM 0 H ILE A 488 11.695 1.014 83.964 1.00 18.45 H new ATOM 0 HA ILE A 488 9.174 1.623 83.232 1.00 18.47 H new ATOM 0 HB ILE A 488 11.582 2.644 82.121 1.00 18.25 H new ATOM 0 HG12 ILE A 488 9.539 4.106 83.426 1.00 16.94 H new ATOM 0 HG13 ILE A 488 10.785 3.584 84.205 1.00 16.94 H new ATOM 0 HG21 ILE A 488 10.262 3.926 80.664 1.00 19.60 H new ATOM 0 HG22 ILE A 488 10.019 2.384 80.394 1.00 19.60 H new ATOM 0 HG23 ILE A 488 8.959 3.220 81.222 1.00 19.60 H new ATOM 0 HD11 ILE A 488 11.052 5.783 83.691 1.00 14.87 H new ATOM 0 HD12 ILE A 488 12.153 4.926 82.941 1.00 14.87 H new ATOM 0 HD13 ILE A 488 10.888 5.456 82.150 1.00 14.87 H new ATOM 489 N SER A 489 8.826 0.116 81.349 1.00 18.86 N ATOM 490 CA SER A 489 8.665 -0.701 80.170 1.00 18.69 C ATOM 491 C SER A 489 8.156 0.179 79.022 1.00 19.87 C ATOM 492 O SER A 489 7.125 0.832 79.148 1.00 20.25 O ATOM 493 CB SER A 489 7.708 -1.864 80.417 1.00 18.37 C ATOM 494 OG SER A 489 7.586 -2.619 79.209 1.00 18.39 O ATOM 0 H SER A 489 8.090 0.417 81.677 1.00 18.86 H new ATOM 0 HA SER A 489 9.525 -1.084 79.937 1.00 18.69 H new ATOM 0 HB2 SER A 489 8.040 -2.427 81.134 1.00 18.37 H new ATOM 0 HB3 SER A 489 6.840 -1.532 80.696 1.00 18.37 H new ATOM 0 HG SER A 489 6.823 -2.968 79.172 1.00 18.39 H new ATOM 495 N PHE A 490 8.885 0.182 77.912 1.00 19.51 N ATOM 496 CA PHE A 490 8.623 1.092 76.776 1.00 20.49 C ATOM 497 C PHE A 490 8.271 0.300 75.522 1.00 20.25 C ATOM 498 O PHE A 490 9.032 -0.571 75.097 1.00 19.86 O ATOM 499 CB PHE A 490 9.885 1.950 76.542 1.00 19.92 C ATOM 500 CG PHE A 490 9.859 2.846 75.305 1.00 19.79 C ATOM 501 CD1 PHE A 490 8.795 3.693 75.035 1.00 17.74 C ATOM 502 CD2 PHE A 490 10.987 2.908 74.474 1.00 19.29 C ATOM 503 CE1 PHE A 490 8.812 4.531 73.912 1.00 15.11 C ATOM 504 CE2 PHE A 490 11.020 3.756 73.358 1.00 17.25 C ATOM 505 CZ PHE A 490 9.919 4.569 73.082 1.00 16.88 C ATOM 0 H PHE A 490 9.553 -0.345 77.786 1.00 19.51 H new ATOM 0 HA PHE A 490 7.867 1.665 76.980 1.00 20.49 H new ATOM 0 HB2 PHE A 490 10.025 2.509 77.322 1.00 19.92 H new ATOM 0 HB3 PHE A 490 10.650 1.358 76.476 1.00 19.92 H new ATOM 0 HD1 PHE A 490 8.061 3.705 75.606 1.00 17.74 H new ATOM 0 HD2 PHE A 490 11.726 2.377 74.667 1.00 19.29 H new ATOM 0 HE1 PHE A 490 8.075 5.065 73.723 1.00 15.11 H new ATOM 0 HE2 PHE A 490 11.769 3.777 72.807 1.00 17.25 H new ATOM 0 HZ PHE A 490 9.929 5.134 72.343 1.00 16.88 H new ATOM 506 N CYS A 491 7.115 0.615 74.953 1.00 20.38 N ATOM 507 CA CYS A 491 6.700 0.125 73.645 1.00 19.85 C ATOM 508 C CYS A 491 6.872 1.268 72.630 1.00 19.09 C ATOM 509 O CYS A 491 6.103 2.231 72.613 1.00 16.18 O ATOM 510 CB CYS A 491 5.249 -0.354 73.676 1.00 18.84 C ATOM 511 SG CYS A 491 4.677 -1.126 72.134 1.00 23.38 S ATOM 0 H CYS A 491 6.536 1.131 75.325 1.00 20.38 H new ATOM 0 HA CYS A 491 7.248 -0.634 73.389 1.00 19.85 H new ATOM 0 HB2 CYS A 491 5.146 -0.991 74.401 1.00 18.84 H new ATOM 0 HB3 CYS A 491 4.675 0.401 73.878 1.00 18.84 H new ATOM 0 HG CYS A 491 5.556 -1.801 71.674 1.00 23.38 H new ATOM 512 N SER A 492 7.918 1.145 71.826 1.00 17.41 N ATOM 513 CA SER A 492 8.350 2.164 70.889 1.00 21.08 C ATOM 514 C SER A 492 7.471 2.177 69.651 1.00 19.73 C ATOM 515 O SER A 492 6.871 1.173 69.325 1.00 17.84 O ATOM 516 CB SER A 492 9.771 1.806 70.433 1.00 21.68 C ATOM 517 OG SER A 492 10.299 2.850 69.648 1.00 31.26 O ATOM 0 H SER A 492 8.412 0.441 71.812 1.00 17.41 H new ATOM 0 HA SER A 492 8.304 3.030 71.324 1.00 21.08 H new ATOM 0 HB2 SER A 492 10.338 1.652 71.205 1.00 21.68 H new ATOM 0 HB3 SER A 492 9.757 0.981 69.922 1.00 21.68 H new ATOM 0 HG SER A 492 9.994 2.795 68.867 1.00 31.26 H new ATOM 518 N GLN A 493 7.413 3.314 68.957 1.00 20.43 N ATOM 519 CA GLN A 493 6.974 3.321 67.558 1.00 22.60 C ATOM 520 C GLN A 493 8.035 2.615 66.713 1.00 24.06 C ATOM 521 O GLN A 493 9.230 2.697 67.016 1.00 24.91 O ATOM 522 CB GLN A 493 6.832 4.764 67.037 1.00 22.71 C ATOM 523 CG GLN A 493 5.573 5.471 67.501 1.00 18.85 C ATOM 524 CD GLN A 493 5.635 6.956 67.224 1.00 16.33 C ATOM 525 OE1 GLN A 493 6.506 7.663 67.735 1.00 19.55 O ATOM 526 NE2 GLN A 493 4.713 7.440 66.404 1.00 17.53 N ATOM 0 H GLN A 493 7.621 4.086 69.273 1.00 20.43 H new ATOM 0 HA GLN A 493 6.116 2.873 67.498 1.00 22.60 H new ATOM 0 HB2 GLN A 493 7.603 5.278 67.323 1.00 22.71 H new ATOM 0 HB3 GLN A 493 6.844 4.750 66.067 1.00 22.71 H new ATOM 0 HG2 GLN A 493 4.802 5.089 67.052 1.00 18.85 H new ATOM 0 HG3 GLN A 493 5.450 5.323 68.452 1.00 18.85 H new ATOM 0 HE21 GLN A 493 4.120 6.916 66.066 1.00 17.53 H new ATOM 0 HE22 GLN A 493 4.707 8.278 66.210 1.00 17.53 H new ATOM 527 N PHE A 494 7.604 1.949 65.650 1.00 26.17 N ATOM 528 CA PHE A 494 8.492 1.153 64.799 1.00 29.43 C ATOM 529 C PHE A 494 9.331 0.154 65.596 1.00 31.23 C ATOM 530 O PHE A 494 10.537 0.023 65.372 1.00 30.78 O ATOM 531 CB PHE A 494 9.411 2.044 63.939 1.00 30.26 C ATOM 532 CG PHE A 494 8.674 2.844 62.893 1.00 31.53 C ATOM 533 CD1 PHE A 494 8.117 2.208 61.776 1.00 29.92 C ATOM 534 CD2 PHE A 494 8.528 4.228 63.035 1.00 31.08 C ATOM 535 CE1 PHE A 494 7.433 2.945 60.805 1.00 31.37 C ATOM 536 CE2 PHE A 494 7.863 4.975 62.064 1.00 30.97 C ATOM 537 CZ PHE A 494 7.307 4.330 60.954 1.00 29.52 C ATOM 0 H PHE A 494 6.782 1.944 65.397 1.00 26.17 H new ATOM 0 HA PHE A 494 7.910 0.648 64.210 1.00 29.43 H new ATOM 0 HB2 PHE A 494 9.894 2.653 64.520 1.00 30.26 H new ATOM 0 HB3 PHE A 494 10.072 1.485 63.501 1.00 30.26 H new ATOM 0 HD1 PHE A 494 8.203 1.287 61.680 1.00 29.92 H new ATOM 0 HD2 PHE A 494 8.878 4.654 63.784 1.00 31.08 H new ATOM 0 HE1 PHE A 494 7.065 2.518 60.066 1.00 31.37 H new ATOM 0 HE2 PHE A 494 7.789 5.898 62.154 1.00 30.97 H new ATOM 0 HZ PHE A 494 6.851 4.825 60.312 1.00 29.52 H new ATOM 538 N SER A 495 8.686 -0.554 66.511 1.00 32.64 N ATOM 539 CA SER A 495 9.402 -1.445 67.397 1.00 36.20 C ATOM 540 C SER A 495 9.974 -2.671 66.675 1.00 37.19 C ATOM 541 O SER A 495 9.303 -3.310 65.874 1.00 37.50 O ATOM 542 CB SER A 495 8.520 -1.856 68.565 1.00 36.95 C ATOM 543 OG SER A 495 9.287 -2.571 69.529 1.00 41.04 O ATOM 0 H SER A 495 7.835 -0.531 66.633 1.00 32.64 H new ATOM 0 HA SER A 495 10.164 -0.952 67.739 1.00 36.20 H new ATOM 0 HB2 SER A 495 8.125 -1.070 68.974 1.00 36.95 H new ATOM 0 HB3 SER A 495 7.789 -2.409 68.248 1.00 36.95 H new ATOM 0 HG SER A 495 9.689 -2.027 70.027 1.00 41.04 H new ATOM 544 N TRP A 496 11.224 -2.980 66.995 1.00 38.43 N ATOM 545 CA TRP A 496 11.987 -4.007 66.314 1.00 39.73 C ATOM 546 C TRP A 496 11.705 -5.402 66.868 1.00 38.19 C ATOM 547 O TRP A 496 11.500 -5.591 68.069 1.00 39.03 O ATOM 548 CB TRP A 496 13.489 -3.673 66.388 1.00 42.22 C ATOM 549 CG TRP A 496 14.322 -4.218 65.241 1.00 45.89 C ATOM 550 CD1 TRP A 496 15.382 -5.084 65.338 1.00 46.56 C ATOM 551 CD2 TRP A 496 14.165 -3.931 63.835 1.00 47.24 C ATOM 552 NE1 TRP A 496 15.890 -5.352 64.086 1.00 48.22 N ATOM 553 CE2 TRP A 496 15.166 -4.661 63.146 1.00 47.76 C ATOM 554 CE3 TRP A 496 13.277 -3.133 63.095 1.00 45.98 C ATOM 555 CZ2 TRP A 496 15.308 -4.617 61.746 1.00 47.11 C ATOM 556 CZ3 TRP A 496 13.412 -3.093 61.698 1.00 47.08 C ATOM 557 CH2 TRP A 496 14.423 -3.835 61.039 1.00 46.64 C ATOM 0 H TRP A 496 11.658 -2.589 67.626 1.00 38.43 H new ATOM 0 HA TRP A 496 11.709 -4.020 65.385 1.00 39.73 H new ATOM 0 HB2 TRP A 496 13.592 -2.709 66.416 1.00 42.22 H new ATOM 0 HB3 TRP A 496 13.844 -4.020 67.222 1.00 42.22 H new ATOM 0 HD1 TRP A 496 15.710 -5.438 66.133 1.00 46.56 H new ATOM 0 HE1 TRP A 496 16.556 -5.870 63.919 1.00 48.22 H new ATOM 0 HE3 TRP A 496 12.613 -2.641 63.522 1.00 45.98 H new ATOM 0 HZ2 TRP A 496 15.976 -5.099 61.314 1.00 47.11 H new ATOM 0 HZ3 TRP A 496 12.828 -2.571 61.197 1.00 47.08 H new ATOM 0 HH2 TRP A 496 14.490 -3.793 60.112 1.00 46.64 H new ATOM 558 N ILE A 497 11.655 -6.361 65.954 1.00 36.50 N ATOM 559 CA ILE A 497 11.580 -7.775 66.259 1.00 34.77 C ATOM 560 C ILE A 497 13.014 -8.271 66.244 1.00 34.24 C ATOM 561 O ILE A 497 13.776 -7.963 65.323 1.00 33.13 O ATOM 562 CB ILE A 497 10.751 -8.533 65.179 1.00 34.65 C ATOM 563 CG1 ILE A 497 9.283 -8.053 65.147 1.00 35.10 C ATOM 564 CG2 ILE A 497 10.860 -10.063 65.340 1.00 35.24 C ATOM 565 CD1 ILE A 497 8.443 -8.383 66.395 1.00 35.92 C ATOM 0 H ILE A 497 11.664 -6.197 65.110 1.00 36.50 H new ATOM 0 HA ILE A 497 11.146 -7.927 67.113 1.00 34.77 H new ATOM 0 HB ILE A 497 11.137 -8.316 64.316 1.00 34.65 H new ATOM 0 HG12 ILE A 497 9.277 -7.091 65.019 1.00 35.10 H new ATOM 0 HG13 ILE A 497 8.849 -8.445 64.373 1.00 35.10 H new ATOM 0 HG21 ILE A 497 10.333 -10.499 64.653 1.00 35.24 H new ATOM 0 HG22 ILE A 497 11.788 -10.332 65.255 1.00 35.24 H new ATOM 0 HG23 ILE A 497 10.528 -10.321 66.214 1.00 35.24 H new ATOM 0 HD11 ILE A 497 7.542 -8.042 66.278 1.00 35.92 H new ATOM 0 HD12 ILE A 497 8.411 -9.345 66.519 1.00 35.92 H new ATOM 0 HD13 ILE A 497 8.846 -7.970 67.175 1.00 35.92 H new ATOM 566 N MET A 498 13.400 -9.013 67.273 1.00 34.44 N ATOM 567 CA MET A 498 14.745 -9.583 67.307 1.00 35.69 C ATOM 568 C MET A 498 14.733 -11.063 66.869 1.00 34.66 C ATOM 569 O MET A 498 13.695 -11.727 66.948 1.00 33.60 O ATOM 570 CB AMET A 498 15.358 -9.436 68.707 0.65 35.73 C ATOM 571 CB BMET A 498 15.401 -9.379 68.679 0.35 35.42 C ATOM 572 CG AMET A 498 14.546 -10.085 69.816 0.65 37.22 C ATOM 573 CG BMET A 498 15.815 -7.925 68.966 0.35 35.70 C ATOM 574 SD AMET A 498 15.503 -10.471 71.296 0.65 38.91 S ATOM 575 SD BMET A 498 17.015 -7.216 67.802 0.35 37.18 S ATOM 576 CE AMET A 498 14.469 -11.742 72.030 0.65 35.74 C ATOM 577 CE BMET A 498 18.511 -8.100 68.249 0.35 36.19 C ATOM 0 H MET A 498 12.909 -9.198 67.954 1.00 34.44 H new ATOM 0 HA MET A 498 15.295 -9.091 66.678 1.00 35.69 H new ATOM 0 HB2AMET A 498 16.247 -9.824 68.702 0.65 35.42 H new ATOM 0 HB2BMET A 498 14.785 -9.672 69.368 0.35 35.42 H new ATOM 0 HB3AMET A 498 15.461 -8.492 68.906 0.65 35.42 H new ATOM 0 HB3BMET A 498 16.185 -9.947 68.740 0.35 35.42 H new ATOM 0 HG2AMET A 498 13.817 -9.494 70.059 0.65 35.70 H new ATOM 0 HG2BMET A 498 15.019 -7.371 68.964 0.35 35.70 H new ATOM 0 HG3AMET A 498 14.148 -10.902 69.477 0.65 35.70 H new ATOM 0 HG3BMET A 498 16.189 -7.881 69.860 0.35 35.70 H new ATOM 0 HE1AMET A 498 13.910 -11.348 72.718 0.65 36.19 H new ATOM 0 HE1BMET A 498 19.199 -7.465 68.504 0.35 36.19 H new ATOM 0 HE2AMET A 498 13.907 -12.138 71.345 0.65 36.19 H new ATOM 0 HE2BMET A 498 18.327 -8.692 68.995 0.35 36.19 H new ATOM 0 HE3AMET A 498 15.030 -12.428 72.424 0.65 36.19 H new ATOM 0 HE3BMET A 498 18.818 -8.621 67.491 0.35 36.19 H new ATOM 578 N PRO A 499 15.873 -11.564 66.348 1.00 35.09 N ATOM 579 CA PRO A 499 15.958 -12.984 65.991 1.00 34.82 C ATOM 580 C PRO A 499 15.589 -13.901 67.156 1.00 34.03 C ATOM 581 O PRO A 499 15.966 -13.645 68.302 1.00 34.88 O ATOM 582 CB PRO A 499 17.432 -13.165 65.615 1.00 34.92 C ATOM 583 CG PRO A 499 17.853 -11.816 65.151 1.00 36.98 C ATOM 584 CD PRO A 499 17.123 -10.847 66.035 1.00 34.62 C ATOM 0 HA PRO A 499 15.339 -13.217 65.281 1.00 34.82 H new ATOM 0 HB2 PRO A 499 17.959 -13.460 66.374 1.00 34.92 H new ATOM 0 HB3 PRO A 499 17.542 -13.831 64.918 1.00 34.92 H new ATOM 0 HG2 PRO A 499 18.813 -11.704 65.227 1.00 36.98 H new ATOM 0 HG3 PRO A 499 17.624 -11.680 64.218 1.00 36.98 H new ATOM 0 HD2 PRO A 499 17.629 -10.640 66.836 1.00 34.62 H new ATOM 0 HD3 PRO A 499 16.952 -10.006 65.582 1.00 34.62 H new ATOM 585 N GLY A 500 14.858 -14.962 66.852 1.00 33.03 N ATOM 586 CA GLY A 500 14.362 -15.870 67.879 1.00 32.11 C ATOM 587 C GLY A 500 12.892 -16.125 67.648 1.00 31.31 C ATOM 588 O GLY A 500 12.314 -15.642 66.670 1.00 31.12 O ATOM 0 H GLY A 500 14.635 -15.177 66.050 1.00 33.03 H new ATOM 0 HA2 GLY A 500 14.854 -16.705 67.853 1.00 32.11 H new ATOM 0 HA3 GLY A 500 14.500 -15.487 68.759 1.00 32.11 H new ATOM 589 N THR A 501 12.277 -16.872 68.549 1.00 30.59 N ATOM 590 CA THR A 501 10.869 -17.198 68.418 1.00 30.85 C ATOM 591 C THR A 501 9.999 -16.011 68.839 1.00 30.97 C ATOM 592 O THR A 501 10.500 -15.024 69.381 1.00 31.13 O ATOM 593 CB THR A 501 10.512 -18.446 69.249 1.00 31.29 C ATOM 594 OG1 THR A 501 10.772 -18.179 70.627 1.00 34.12 O ATOM 595 CG2 THR A 501 11.360 -19.635 68.818 1.00 31.00 C ATOM 0 H THR A 501 12.658 -17.201 69.246 1.00 30.59 H new ATOM 0 HA THR A 501 10.693 -17.394 67.485 1.00 30.85 H new ATOM 0 HB THR A 501 9.575 -18.654 69.111 1.00 31.29 H new ATOM 0 HG1 THR A 501 10.578 -18.856 71.085 1.00 34.12 H new ATOM 0 HG21 THR A 501 11.124 -20.411 69.350 1.00 31.00 H new ATOM 0 HG22 THR A 501 11.199 -19.825 67.880 1.00 31.00 H new ATOM 0 HG23 THR A 501 12.299 -19.428 68.949 1.00 31.00 H new ATOM 596 N ILE A 502 8.702 -16.103 68.552 1.00 31.40 N ATOM 597 CA ILE A 502 7.730 -15.111 69.001 1.00 30.91 C ATOM 598 C ILE A 502 7.694 -15.095 70.545 1.00 30.20 C ATOM 599 O ILE A 502 7.670 -14.022 71.155 1.00 27.95 O ATOM 600 CB ILE A 502 6.344 -15.379 68.369 1.00 31.35 C ATOM 601 CG1 ILE A 502 6.400 -15.102 66.860 1.00 32.02 C ATOM 602 CG2 ILE A 502 5.237 -14.534 69.008 1.00 31.37 C ATOM 603 CD1 ILE A 502 5.433 -15.933 66.038 1.00 37.78 C ATOM 0 H ILE A 502 8.361 -16.744 68.091 1.00 31.40 H new ATOM 0 HA ILE A 502 7.996 -14.227 68.704 1.00 30.91 H new ATOM 0 HB ILE A 502 6.128 -16.311 68.531 1.00 31.35 H new ATOM 0 HG12 ILE A 502 6.214 -14.162 66.707 1.00 32.02 H new ATOM 0 HG13 ILE A 502 7.302 -15.268 66.544 1.00 32.02 H new ATOM 0 HG21 ILE A 502 4.389 -14.735 68.581 1.00 31.37 H new ATOM 0 HG22 ILE A 502 5.179 -14.739 69.954 1.00 31.37 H new ATOM 0 HG23 ILE A 502 5.441 -13.593 68.893 1.00 31.37 H new ATOM 0 HD11 ILE A 502 5.526 -15.704 65.100 1.00 37.78 H new ATOM 0 HD12 ILE A 502 5.630 -16.875 66.161 1.00 37.78 H new ATOM 0 HD13 ILE A 502 4.525 -15.752 66.326 1.00 37.78 H new ATOM 604 N LYS A 503 7.737 -16.281 71.159 1.00 28.92 N ATOM 605 CA LYS A 503 7.729 -16.390 72.622 1.00 29.46 C ATOM 606 C LYS A 503 8.921 -15.663 73.234 1.00 28.13 C ATOM 607 O LYS A 503 8.757 -14.875 74.167 1.00 27.34 O ATOM 608 CB LYS A 503 7.694 -17.861 73.093 1.00 29.66 C ATOM 609 CG LYS A 503 7.479 -18.018 74.614 1.00 31.00 C ATOM 610 CD LYS A 503 7.085 -19.442 75.015 1.00 31.66 C ATOM 611 CE LYS A 503 6.462 -19.483 76.418 1.00 34.15 C ATOM 612 NZ LYS A 503 5.648 -20.746 76.642 1.00 36.93 N ATOM 0 H LYS A 503 7.771 -17.035 70.746 1.00 28.92 H new ATOM 0 HA LYS A 503 6.915 -15.963 72.932 1.00 29.46 H new ATOM 0 HB2 LYS A 503 6.984 -18.326 72.624 1.00 29.66 H new ATOM 0 HB3 LYS A 503 8.527 -18.292 72.846 1.00 29.66 H new ATOM 0 HG2 LYS A 503 8.293 -17.769 75.079 1.00 31.00 H new ATOM 0 HG3 LYS A 503 6.788 -17.402 74.904 1.00 31.00 H new ATOM 0 HD2 LYS A 503 6.454 -19.798 74.370 1.00 31.66 H new ATOM 0 HD3 LYS A 503 7.868 -20.014 74.991 1.00 31.66 H new ATOM 0 HE2 LYS A 503 7.165 -19.429 77.085 1.00 34.15 H new ATOM 0 HE3 LYS A 503 5.894 -18.707 76.542 1.00 34.15 H new ATOM 0 HZ1 LYS A 503 5.376 -20.778 77.489 1.00 36.93 H new ATOM 0 HZ2 LYS A 503 4.940 -20.743 76.103 1.00 36.93 H new ATOM 0 HZ3 LYS A 503 6.151 -21.459 76.466 1.00 36.93 H new ATOM 613 N GLU A 504 10.105 -15.934 72.696 1.00 27.76 N ATOM 614 CA GLU A 504 11.348 -15.318 73.131 1.00 29.49 C ATOM 615 C GLU A 504 11.327 -13.808 72.927 1.00 28.81 C ATOM 616 O GLU A 504 11.833 -13.060 73.765 1.00 28.48 O ATOM 617 CB GLU A 504 12.523 -15.919 72.373 1.00 30.92 C ATOM 618 CG GLU A 504 12.840 -17.344 72.780 1.00 35.48 C ATOM 619 CD GLU A 504 13.877 -17.985 71.880 1.00 40.85 C ATOM 620 OE1 GLU A 504 14.289 -17.345 70.879 1.00 39.47 O ATOM 621 OE2 GLU A 504 14.268 -19.139 72.178 1.00 43.78 O ATOM 0 H GLU A 504 10.208 -16.495 72.052 1.00 27.76 H new ATOM 0 HA GLU A 504 11.447 -15.494 74.080 1.00 29.49 H new ATOM 0 HB2 GLU A 504 12.331 -15.897 71.422 1.00 30.92 H new ATOM 0 HB3 GLU A 504 13.308 -15.367 72.517 1.00 30.92 H new ATOM 0 HG2 GLU A 504 13.160 -17.352 73.696 1.00 35.48 H new ATOM 0 HG3 GLU A 504 12.027 -17.872 72.759 1.00 35.48 H new ATOM 622 N ASN A 505 10.723 -13.369 71.821 1.00 27.94 N ATOM 623 CA ASN A 505 10.490 -11.941 71.600 1.00 27.69 C ATOM 624 C ASN A 505 9.593 -11.301 72.658 1.00 27.29 C ATOM 625 O ASN A 505 9.715 -10.106 72.943 1.00 28.42 O ATOM 626 CB ASN A 505 9.920 -11.688 70.204 1.00 26.98 C ATOM 627 CG ASN A 505 10.995 -11.385 69.200 1.00 28.68 C ATOM 628 OD1 ASN A 505 11.352 -10.227 69.004 1.00 30.38 O ATOM 629 ND2 ASN A 505 11.547 -12.424 68.576 1.00 24.86 N ATOM 0 H ASN A 505 10.442 -13.880 71.189 1.00 27.94 H new ATOM 0 HA ASN A 505 11.359 -11.517 71.675 1.00 27.69 H new ATOM 0 HB2 ASN A 505 9.419 -12.467 69.915 1.00 26.98 H new ATOM 0 HB3 ASN A 505 9.295 -10.947 70.241 1.00 26.98 H new ATOM 0 HD21 ASN A 505 12.181 -12.298 68.009 1.00 24.86 H new ATOM 0 HD22 ASN A 505 11.269 -13.221 68.740 1.00 24.86 H new ATOM 630 N ILE A 506 8.691 -12.091 73.230 1.00 25.63 N ATOM 631 CA ILE A 506 7.790 -11.574 74.247 1.00 24.27 C ATOM 632 C ILE A 506 8.379 -11.673 75.665 1.00 25.53 C ATOM 633 O ILE A 506 8.406 -10.672 76.408 1.00 24.77 O ATOM 634 CB ILE A 506 6.373 -12.198 74.131 1.00 24.04 C ATOM 635 CG1 ILE A 506 5.755 -11.790 72.786 1.00 20.96 C ATOM 636 CG2 ILE A 506 5.480 -11.781 75.321 1.00 20.67 C ATOM 637 CD1 ILE A 506 4.462 -12.485 72.444 1.00 16.90 C ATOM 0 H ILE A 506 8.586 -12.924 73.044 1.00 25.63 H new ATOM 0 HA ILE A 506 7.686 -10.625 74.077 1.00 24.27 H new ATOM 0 HB ILE A 506 6.443 -13.165 74.163 1.00 24.04 H new ATOM 0 HG12 ILE A 506 5.600 -10.832 72.793 1.00 20.96 H new ATOM 0 HG13 ILE A 506 6.398 -11.968 72.082 1.00 20.96 H new ATOM 0 HG21 ILE A 506 4.603 -12.183 75.224 1.00 20.67 H new ATOM 0 HG22 ILE A 506 5.884 -12.082 76.150 1.00 20.67 H new ATOM 0 HG23 ILE A 506 5.392 -10.815 75.337 1.00 20.67 H new ATOM 0 HD11 ILE A 506 4.143 -12.170 71.584 1.00 16.90 H new ATOM 0 HD12 ILE A 506 4.610 -13.443 72.403 1.00 16.90 H new ATOM 0 HD13 ILE A 506 3.799 -12.290 73.125 1.00 16.90 H new ATOM 638 N ILE A 507 8.888 -12.852 76.017 1.00 27.44 N ATOM 639 CA ILE A 507 9.250 -13.143 77.408 1.00 31.13 C ATOM 640 C ILE A 507 10.698 -12.816 77.736 1.00 34.64 C ATOM 641 O ILE A 507 11.056 -12.724 78.913 1.00 35.96 O ATOM 642 CB ILE A 507 8.928 -14.616 77.824 1.00 29.91 C ATOM 643 CG1 ILE A 507 9.835 -15.622 77.102 1.00 30.74 C ATOM 644 CG2 ILE A 507 7.454 -14.920 77.599 1.00 29.90 C ATOM 645 CD1 ILE A 507 9.722 -17.090 77.622 1.00 31.37 C ATOM 0 H ILE A 507 9.032 -13.498 75.468 1.00 27.44 H new ATOM 0 HA ILE A 507 8.689 -12.550 77.932 1.00 31.13 H new ATOM 0 HB ILE A 507 9.112 -14.709 78.772 1.00 29.91 H new ATOM 0 HG12 ILE A 507 9.623 -15.610 76.156 1.00 30.74 H new ATOM 0 HG13 ILE A 507 10.756 -15.330 77.190 1.00 30.74 H new ATOM 0 HG21 ILE A 507 7.269 -15.835 77.861 1.00 29.90 H new ATOM 0 HG22 ILE A 507 6.914 -14.316 78.132 1.00 29.90 H new ATOM 0 HG23 ILE A 507 7.239 -14.803 76.660 1.00 29.90 H new ATOM 0 HD11 ILE A 507 10.323 -17.660 77.117 1.00 31.37 H new ATOM 0 HD12 ILE A 507 9.962 -17.120 78.561 1.00 31.37 H new ATOM 0 HD13 ILE A 507 8.811 -17.404 77.511 1.00 31.37 H new ATOM 646 N GLY A 509 11.523 -12.633 76.704 1.00 37.49 N ATOM 647 CA GLY A 509 12.952 -12.387 76.890 1.00 40.90 C ATOM 648 C GLY A 509 13.585 -13.353 77.873 1.00 43.67 C ATOM 649 O GLY A 509 13.747 -14.547 77.576 1.00 43.49 O ATOM 0 H GLY A 509 11.271 -12.648 75.882 1.00 37.49 H new ATOM 0 HA2 GLY A 509 13.403 -12.459 76.034 1.00 40.90 H new ATOM 0 HA3 GLY A 509 13.082 -11.479 77.204 1.00 40.90 H new ATOM 650 N VAL A 510 13.913 -12.830 79.056 1.00 46.07 N ATOM 651 CA VAL A 510 14.610 -13.589 80.099 1.00 48.11 C ATOM 652 C VAL A 510 13.676 -14.445 80.967 1.00 48.27 C ATOM 653 O VAL A 510 13.893 -15.654 81.085 1.00 49.66 O ATOM 654 CB VAL A 510 15.481 -12.674 81.017 1.00 48.58 C ATOM 655 CG1 VAL A 510 16.445 -13.509 81.847 1.00 49.75 C ATOM 656 CG2 VAL A 510 16.253 -11.648 80.199 1.00 50.38 C ATOM 0 H VAL A 510 13.736 -12.018 79.278 1.00 46.07 H new ATOM 0 HA VAL A 510 15.191 -14.193 79.611 1.00 48.11 H new ATOM 0 HB VAL A 510 14.881 -12.200 81.614 1.00 48.58 H new ATOM 0 HG11 VAL A 510 16.977 -12.925 82.410 1.00 49.75 H new ATOM 0 HG12 VAL A 510 15.943 -14.125 82.403 1.00 49.75 H new ATOM 0 HG13 VAL A 510 17.030 -14.010 81.257 1.00 49.75 H new ATOM 0 HG21 VAL A 510 16.784 -11.094 80.792 1.00 50.38 H new ATOM 0 HG22 VAL A 510 16.838 -12.105 79.574 1.00 50.38 H new ATOM 0 HG23 VAL A 510 15.630 -11.090 79.708 1.00 50.38 H new ATOM 657 N SER A 511 12.647 -13.829 81.557 1.00 47.86 N ATOM 658 CA SER A 511 11.854 -14.483 82.610 1.00 47.11 C ATOM 659 C SER A 511 10.663 -15.303 82.115 1.00 45.58 C ATOM 660 O SER A 511 9.748 -14.765 81.488 1.00 46.01 O ATOM 661 CB SER A 511 11.378 -13.458 83.653 1.00 47.81 C ATOM 662 OG SER A 511 10.942 -14.105 84.850 1.00 49.93 O ATOM 0 H SER A 511 12.390 -13.032 81.363 1.00 47.86 H new ATOM 0 HA SER A 511 12.465 -15.121 83.011 1.00 47.11 H new ATOM 0 HB2 SER A 511 12.099 -12.843 83.859 1.00 47.81 H new ATOM 0 HB3 SER A 511 10.652 -12.931 83.284 1.00 47.81 H new ATOM 0 HG SER A 511 10.689 -13.527 85.405 1.00 49.93 H new ATOM 663 N TYR A 512 10.674 -16.600 82.432 1.00 42.97 N ATOM 664 CA TYR A 512 9.563 -17.509 82.120 1.00 40.28 C ATOM 665 C TYR A 512 8.485 -17.478 83.197 1.00 38.26 C ATOM 666 O TYR A 512 8.755 -17.743 84.371 1.00 37.43 O ATOM 667 CB TYR A 512 10.066 -18.947 81.914 1.00 40.80 C ATOM 0 H TYR A 512 11.330 -16.981 82.837 1.00 42.97 H new ATOM 0 HA TYR A 512 9.166 -17.196 81.292 1.00 40.28 H new ATOM 668 N ASP A 513 7.264 -17.149 82.779 1.00 35.64 N ATOM 669 CA ASP A 513 6.082 -17.124 83.652 1.00 34.36 C ATOM 670 C ASP A 513 4.883 -17.475 82.767 1.00 33.91 C ATOM 671 O ASP A 513 4.337 -16.607 82.089 1.00 32.08 O ATOM 672 CB ASP A 513 5.907 -15.739 84.288 1.00 33.32 C ATOM 673 CG ASP A 513 4.761 -15.674 85.291 1.00 34.07 C ATOM 674 OD1 ASP A 513 3.831 -16.510 85.243 1.00 31.23 O ATOM 675 OD2 ASP A 513 4.777 -14.757 86.139 1.00 33.97 O ATOM 0 H ASP A 513 7.093 -16.929 81.965 1.00 35.64 H new ATOM 0 HA ASP A 513 6.172 -17.757 84.382 1.00 34.36 H new ATOM 0 HB2 ASP A 513 6.732 -15.488 84.733 1.00 33.32 H new ATOM 0 HB3 ASP A 513 5.752 -15.086 83.588 1.00 33.32 H new ATOM 676 N GLU A 514 4.491 -18.750 82.763 1.00 32.83 N ATOM 677 CA GLU A 514 3.514 -19.233 81.796 1.00 32.74 C ATOM 678 C GLU A 514 2.131 -18.617 81.963 1.00 32.84 C ATOM 679 O GLU A 514 1.439 -18.366 80.970 1.00 32.46 O ATOM 680 CB GLU A 514 3.449 -20.771 81.786 1.00 33.66 C ATOM 681 CG GLU A 514 2.738 -21.342 80.571 1.00 35.30 C ATOM 682 CD GLU A 514 3.475 -21.083 79.254 1.00 39.79 C ATOM 683 OE1 GLU A 514 4.652 -20.636 79.282 1.00 38.59 O ATOM 684 OE2 GLU A 514 2.868 -21.330 78.183 1.00 40.48 O ATOM 0 H GLU A 514 4.779 -19.347 83.311 1.00 32.83 H new ATOM 0 HA GLU A 514 3.830 -18.935 80.929 1.00 32.74 H new ATOM 0 HB2 GLU A 514 4.351 -21.126 81.820 1.00 33.66 H new ATOM 0 HB3 GLU A 514 2.995 -21.073 82.588 1.00 33.66 H new ATOM 0 HG2 GLU A 514 2.628 -22.299 80.689 1.00 35.30 H new ATOM 0 HG3 GLU A 514 1.848 -20.959 80.516 1.00 35.30 H new ATOM 685 N TYR A 515 1.735 -18.366 83.207 1.00 32.44 N ATOM 686 CA TYR A 515 0.439 -17.748 83.487 1.00 33.51 C ATOM 687 C TYR A 515 0.405 -16.323 82.945 1.00 32.82 C ATOM 688 O TYR A 515 -0.567 -15.922 82.309 1.00 33.06 O ATOM 689 CB TYR A 515 0.147 -17.728 84.994 1.00 35.12 C ATOM 690 CG TYR A 515 -1.184 -17.078 85.340 1.00 37.08 C ATOM 691 CD1 TYR A 515 -2.337 -17.848 85.447 1.00 38.68 C ATOM 692 CD2 TYR A 515 -1.291 -15.694 85.544 1.00 38.90 C ATOM 693 CE1 TYR A 515 -3.565 -17.277 85.741 1.00 39.48 C ATOM 694 CE2 TYR A 515 -2.529 -15.105 85.846 1.00 40.69 C ATOM 695 CZ TYR A 515 -3.655 -15.913 85.942 1.00 39.43 C ATOM 696 OH TYR A 515 -4.887 -15.383 86.236 1.00 43.47 O ATOM 0 H TYR A 515 2.202 -18.546 83.906 1.00 32.44 H new ATOM 0 HA TYR A 515 -0.243 -18.279 83.047 1.00 33.51 H new ATOM 0 HB2 TYR A 515 0.153 -18.638 85.330 1.00 35.12 H new ATOM 0 HB3 TYR A 515 0.860 -17.253 85.449 1.00 35.12 H new ATOM 0 HD1 TYR A 515 -2.283 -18.767 85.318 1.00 38.68 H new ATOM 0 HD2 TYR A 515 -0.532 -15.160 85.478 1.00 38.90 H new ATOM 0 HE1 TYR A 515 -4.325 -17.809 85.803 1.00 39.48 H new ATOM 0 HE2 TYR A 515 -2.594 -14.187 85.980 1.00 40.69 H new ATOM 0 HH TYR A 515 -4.818 -14.552 86.337 1.00 43.47 H new ATOM 697 N ARG A 516 1.468 -15.565 83.216 1.00 32.43 N ATOM 698 CA ARG A 516 1.560 -14.170 82.781 1.00 31.62 C ATOM 699 C ARG A 516 1.619 -14.115 81.256 1.00 30.03 C ATOM 700 O ARG A 516 0.928 -13.319 80.638 1.00 31.27 O ATOM 701 CB ARG A 516 2.797 -13.492 83.384 1.00 32.04 C ATOM 702 CG ARG A 516 2.749 -11.972 83.345 1.00 34.37 C ATOM 703 CD ARG A 516 4.073 -11.357 83.761 1.00 38.84 C ATOM 704 NE ARG A 516 3.905 -10.133 84.551 1.00 43.07 N ATOM 705 CZ ARG A 516 3.529 -8.947 84.073 1.00 47.05 C ATOM 706 NH1 ARG A 516 3.230 -8.788 82.787 1.00 51.92 N ATOM 707 NH2 ARG A 516 3.422 -7.911 84.889 1.00 47.40 N ATOM 0 H ARG A 516 2.153 -15.843 83.655 1.00 32.43 H new ATOM 0 HA ARG A 516 0.774 -13.693 83.091 1.00 31.62 H new ATOM 0 HB2 ARG A 516 2.896 -13.780 84.305 1.00 32.04 H new ATOM 0 HB3 ARG A 516 3.585 -13.794 82.906 1.00 32.04 H new ATOM 0 HG2 ARG A 516 2.523 -11.678 82.449 1.00 34.37 H new ATOM 0 HG3 ARG A 516 2.046 -11.655 83.933 1.00 34.37 H new ATOM 0 HD2 ARG A 516 4.578 -12.004 84.278 1.00 38.84 H new ATOM 0 HD3 ARG A 516 4.596 -11.157 82.969 1.00 38.84 H new ATOM 0 HE ARG A 516 4.063 -10.185 85.395 1.00 43.07 H new ATOM 0 HH11 ARG A 516 3.278 -9.457 82.249 1.00 51.92 H new ATOM 0 HH12 ARG A 516 2.989 -8.016 82.494 1.00 51.92 H new ATOM 0 HH21 ARG A 516 3.595 -8.003 85.726 1.00 47.40 H new ATOM 0 HH22 ARG A 516 3.180 -7.145 84.582 1.00 47.40 H new ATOM 708 N TYR A 517 2.436 -14.983 80.667 1.00 28.81 N ATOM 709 CA TYR A 517 2.572 -15.097 79.219 1.00 27.43 C ATOM 710 C TYR A 517 1.229 -15.334 78.518 1.00 27.46 C ATOM 711 O TYR A 517 0.901 -14.657 77.531 1.00 26.68 O ATOM 712 CB TYR A 517 3.581 -16.198 78.864 1.00 27.61 C ATOM 713 CG TYR A 517 3.697 -16.451 77.373 1.00 28.84 C ATOM 714 CD1 TYR A 517 4.300 -15.509 76.536 1.00 30.05 C ATOM 715 CD2 TYR A 517 3.166 -17.613 76.796 1.00 26.86 C ATOM 716 CE1 TYR A 517 4.397 -15.722 75.177 1.00 31.05 C ATOM 717 CE2 TYR A 517 3.257 -17.834 75.441 1.00 25.86 C ATOM 718 CZ TYR A 517 3.874 -16.883 74.636 1.00 28.45 C ATOM 719 OH TYR A 517 3.979 -17.076 73.288 1.00 29.96 O ATOM 0 H TYR A 517 2.934 -15.531 81.104 1.00 28.81 H new ATOM 0 HA TYR A 517 2.906 -14.247 78.893 1.00 27.43 H new ATOM 0 HB2 TYR A 517 4.453 -15.953 79.212 1.00 27.61 H new ATOM 0 HB3 TYR A 517 3.320 -17.021 79.306 1.00 27.61 H new ATOM 0 HD1 TYR A 517 4.642 -14.725 76.901 1.00 30.05 H new ATOM 0 HD2 TYR A 517 2.747 -18.243 77.336 1.00 26.86 H new ATOM 0 HE1 TYR A 517 4.809 -15.092 74.630 1.00 31.05 H new ATOM 0 HE2 TYR A 517 2.909 -18.611 75.067 1.00 25.86 H new ATOM 0 HH TYR A 517 3.628 -17.811 73.082 1.00 29.96 H new ATOM 720 N ARG A 518 0.457 -16.291 79.026 1.00 26.84 N ATOM 721 CA ARG A 518 -0.839 -16.650 78.419 1.00 27.81 C ATOM 722 C ARG A 518 -1.828 -15.489 78.479 1.00 26.12 C ATOM 723 O ARG A 518 -2.544 -15.222 77.511 1.00 25.67 O ATOM 724 CB ARG A 518 -1.467 -17.871 79.106 1.00 27.64 C ATOM 725 CG ARG A 518 -0.698 -19.180 78.925 1.00 34.53 C ATOM 726 CD ARG A 518 -0.665 -19.736 77.483 1.00 38.51 C ATOM 727 NE ARG A 518 -1.933 -19.669 76.751 1.00 37.54 N ATOM 728 CZ ARG A 518 -2.048 -20.000 75.463 1.00 41.58 C ATOM 729 NH1 ARG A 518 -3.212 -19.909 74.841 1.00 41.93 N ATOM 730 NH2 ARG A 518 -0.986 -20.430 74.792 1.00 44.43 N ATOM 0 H ARG A 518 0.660 -16.750 79.724 1.00 26.84 H new ATOM 0 HA ARG A 518 -0.655 -16.866 77.491 1.00 27.81 H new ATOM 0 HB2 ARG A 518 -1.546 -17.686 80.055 1.00 27.64 H new ATOM 0 HB3 ARG A 518 -2.367 -17.990 78.764 1.00 27.64 H new ATOM 0 HG2 ARG A 518 0.215 -19.045 79.224 1.00 34.53 H new ATOM 0 HG3 ARG A 518 -1.091 -19.851 79.505 1.00 34.53 H new ATOM 0 HD2 ARG A 518 0.007 -19.249 76.981 1.00 38.51 H new ATOM 0 HD3 ARG A 518 -0.378 -20.662 77.517 1.00 38.51 H new ATOM 0 HE ARG A 518 -2.635 -19.404 77.171 1.00 37.54 H new ATOM 0 HH11 ARG A 518 -3.907 -19.634 75.267 1.00 41.93 H new ATOM 0 HH12 ARG A 518 -3.274 -20.125 74.011 1.00 41.93 H new ATOM 0 HH21 ARG A 518 -0.225 -20.495 75.187 1.00 44.43 H new ATOM 0 HH22 ARG A 518 -1.059 -20.643 73.962 1.00 44.43 H new ATOM 731 N SER A 519 -1.865 -14.814 79.624 1.00 25.72 N ATOM 732 CA SER A 519 -2.743 -13.658 79.819 1.00 26.14 C ATOM 733 C SER A 519 -2.398 -12.511 78.851 1.00 24.79 C ATOM 734 O SER A 519 -3.292 -11.817 78.360 1.00 23.17 O ATOM 735 CB SER A 519 -2.676 -13.178 81.277 1.00 26.99 C ATOM 736 OG SER A 519 -1.370 -12.710 81.594 1.00 31.69 O ATOM 0 H SER A 519 -1.384 -15.011 80.309 1.00 25.72 H new ATOM 0 HA SER A 519 -3.651 -13.938 79.623 1.00 26.14 H new ATOM 0 HB2 SER A 519 -3.322 -12.468 81.419 1.00 26.99 H new ATOM 0 HB3 SER A 519 -2.918 -13.904 81.873 1.00 26.99 H new ATOM 0 HG SER A 519 -0.799 -13.183 81.199 1.00 31.69 H new ATOM 737 N VAL A 520 -1.104 -12.337 78.584 1.00 25.56 N ATOM 738 CA VAL A 520 -0.609 -11.282 77.688 1.00 25.73 C ATOM 739 C VAL A 520 -0.906 -11.614 76.224 1.00 26.12 C ATOM 740 O VAL A 520 -1.428 -10.767 75.486 1.00 25.88 O ATOM 741 CB VAL A 520 0.902 -10.966 77.886 1.00 26.50 C ATOM 742 CG1 VAL A 520 1.375 -9.975 76.828 1.00 26.62 C ATOM 743 CG2 VAL A 520 1.189 -10.399 79.305 1.00 22.90 C ATOM 0 H VAL A 520 -0.483 -12.829 78.918 1.00 25.56 H new ATOM 0 HA VAL A 520 -1.093 -10.477 77.930 1.00 25.73 H new ATOM 0 HB VAL A 520 1.391 -11.799 77.792 1.00 26.50 H new ATOM 0 HG11 VAL A 520 2.317 -9.785 76.960 1.00 26.62 H new ATOM 0 HG12 VAL A 520 1.243 -10.356 75.946 1.00 26.62 H new ATOM 0 HG13 VAL A 520 0.866 -9.153 76.904 1.00 26.62 H new ATOM 0 HG21 VAL A 520 2.137 -10.214 79.394 1.00 22.90 H new ATOM 0 HG22 VAL A 520 0.686 -9.580 79.434 1.00 22.90 H new ATOM 0 HG23 VAL A 520 0.923 -11.050 79.974 1.00 22.90 H new ATOM 744 N ILE A 521 -0.616 -12.845 75.805 1.00 26.03 N ATOM 745 CA ILE A 521 -0.903 -13.221 74.422 1.00 26.87 C ATOM 746 C ILE A 521 -2.405 -13.259 74.134 1.00 27.03 C ATOM 747 O ILE A 521 -2.837 -12.914 73.035 1.00 27.78 O ATOM 748 CB ILE A 521 -0.076 -14.452 73.909 1.00 27.38 C ATOM 749 CG1 ILE A 521 -0.474 -15.756 74.600 1.00 26.02 C ATOM 750 CG2 ILE A 521 1.396 -14.166 74.112 1.00 28.11 C ATOM 751 CD1 ILE A 521 -0.082 -17.022 73.818 1.00 28.68 C ATOM 0 H ILE A 521 -0.263 -13.461 76.290 1.00 26.03 H new ATOM 0 HA ILE A 521 -0.567 -12.504 73.862 1.00 26.87 H new ATOM 0 HB ILE A 521 -0.267 -14.576 72.966 1.00 27.38 H new ATOM 0 HG12 ILE A 521 -0.059 -15.787 75.476 1.00 26.02 H new ATOM 0 HG13 ILE A 521 -1.434 -15.757 74.740 1.00 26.02 H new ATOM 0 HG21 ILE A 521 1.919 -14.921 73.798 1.00 28.11 H new ATOM 0 HG22 ILE A 521 1.643 -13.372 73.613 1.00 28.11 H new ATOM 0 HG23 ILE A 521 1.571 -14.022 75.055 1.00 28.11 H new ATOM 0 HD11 ILE A 521 -0.363 -17.808 74.312 1.00 28.68 H new ATOM 0 HD12 ILE A 521 -0.515 -17.014 72.950 1.00 28.68 H new ATOM 0 HD13 ILE A 521 0.880 -17.044 73.698 1.00 28.68 H new ATOM 752 N LYS A 522 -3.206 -13.630 75.130 1.00 27.21 N ATOM 753 CA LYS A 522 -4.658 -13.511 75.003 1.00 28.45 C ATOM 754 C LYS A 522 -5.093 -12.051 74.839 1.00 27.84 C ATOM 755 O LYS A 522 -5.842 -11.736 73.926 1.00 27.30 O ATOM 756 CB LYS A 522 -5.396 -14.148 76.186 1.00 28.48 C ATOM 757 CG LYS A 522 -6.926 -14.232 75.995 1.00 30.23 C ATOM 758 CD LYS A 522 -7.664 -14.876 77.172 1.00 31.28 C ATOM 759 CE LYS A 522 -7.127 -16.280 77.526 1.00 35.64 C ATOM 760 NZ LYS A 522 -7.352 -17.257 76.428 1.00 36.83 N ATOM 0 H LYS A 522 -2.933 -13.950 75.880 1.00 27.21 H new ATOM 0 HA LYS A 522 -4.901 -13.998 74.200 1.00 28.45 H new ATOM 0 HB2 LYS A 522 -5.047 -15.041 76.331 1.00 28.48 H new ATOM 0 HB3 LYS A 522 -5.206 -13.636 76.988 1.00 28.48 H new ATOM 0 HG2 LYS A 522 -7.275 -13.338 75.856 1.00 30.23 H new ATOM 0 HG3 LYS A 522 -7.115 -14.739 75.190 1.00 30.23 H new ATOM 0 HD2 LYS A 522 -7.587 -14.301 77.949 1.00 31.28 H new ATOM 0 HD3 LYS A 522 -8.608 -14.941 76.959 1.00 31.28 H new ATOM 0 HE2 LYS A 522 -6.178 -16.223 77.718 1.00 35.64 H new ATOM 0 HE3 LYS A 522 -7.561 -16.597 78.334 1.00 35.64 H new ATOM 0 HZ1 LYS A 522 -6.896 -18.002 76.595 1.00 36.83 H new ATOM 0 HZ2 LYS A 522 -8.220 -17.447 76.373 1.00 36.83 H new ATOM 0 HZ3 LYS A 522 -7.076 -16.907 75.658 1.00 36.83 H new ATOM 761 N ALA A 523 -4.626 -11.175 75.730 1.00 27.51 N ATOM 762 CA ALA A 523 -5.051 -9.770 75.743 1.00 26.82 C ATOM 763 C ALA A 523 -4.592 -8.966 74.517 1.00 27.17 C ATOM 764 O ALA A 523 -5.238 -7.986 74.138 1.00 27.54 O ATOM 765 CB ALA A 523 -4.605 -9.109 77.018 1.00 27.67 C ATOM 0 H ALA A 523 -4.056 -11.376 76.342 1.00 27.51 H new ATOM 0 HA ALA A 523 -6.020 -9.776 75.698 1.00 26.82 H new ATOM 0 HB1 ALA A 523 -4.890 -8.182 77.019 1.00 27.67 H new ATOM 0 HB2 ALA A 523 -4.999 -9.568 77.776 1.00 27.67 H new ATOM 0 HB3 ALA A 523 -3.638 -9.150 77.083 1.00 27.67 H new ATOM 766 N CYS A 524 -3.487 -9.385 73.898 1.00 27.47 N ATOM 767 CA CYS A 524 -2.964 -8.729 72.686 1.00 27.55 C ATOM 768 C CYS A 524 -3.403 -9.435 71.399 1.00 29.32 C ATOM 769 O CYS A 524 -2.897 -9.140 70.310 1.00 29.77 O ATOM 770 CB CYS A 524 -1.445 -8.619 72.756 1.00 27.39 C ATOM 771 SG CYS A 524 -0.840 -7.624 74.146 1.00 25.91 S ATOM 0 H CYS A 524 -3.018 -10.055 74.164 1.00 27.47 H new ATOM 0 HA CYS A 524 -3.344 -7.837 72.656 1.00 27.55 H new ATOM 0 HB2 CYS A 524 -1.068 -9.510 72.820 1.00 27.39 H new ATOM 0 HB3 CYS A 524 -1.120 -8.233 71.928 1.00 27.39 H new ATOM 0 HG CYS A 524 -0.806 -8.299 75.137 1.00 25.91 H new ATOM 772 N GLN A 525 -4.340 -10.373 71.544 1.00 29.86 N ATOM 773 CA GLN A 525 -4.897 -11.166 70.438 1.00 31.99 C ATOM 774 C GLN A 525 -3.869 -11.889 69.581 1.00 32.40 C ATOM 775 O GLN A 525 -3.955 -11.860 68.357 1.00 33.48 O ATOM 776 CB GLN A 525 -5.772 -10.312 69.528 1.00 31.44 C ATOM 777 CG GLN A 525 -6.934 -9.621 70.209 1.00 34.57 C ATOM 778 CD GLN A 525 -8.023 -9.285 69.220 1.00 36.50 C ATOM 779 OE1 GLN A 525 -8.129 -9.907 68.163 1.00 40.71 O ATOM 780 NE2 GLN A 525 -8.839 -8.306 69.552 1.00 38.58 N ATOM 0 H GLN A 525 -4.680 -10.573 72.308 1.00 29.86 H new ATOM 0 HA GLN A 525 -5.422 -11.848 70.884 1.00 31.99 H new ATOM 0 HB2 GLN A 525 -5.215 -9.638 69.108 1.00 31.44 H new ATOM 0 HB3 GLN A 525 -6.120 -10.874 68.818 1.00 31.44 H new ATOM 0 HG2 GLN A 525 -7.291 -10.194 70.906 1.00 34.57 H new ATOM 0 HG3 GLN A 525 -6.624 -8.810 70.640 1.00 34.57 H new ATOM 0 HE21 GLN A 525 -8.734 -7.894 70.299 1.00 38.58 H new ATOM 0 HE22 GLN A 525 -9.477 -8.079 69.021 1.00 38.58 H new ATOM 781 N LEU A 526 -2.893 -12.520 70.220 1.00 33.08 N ATOM 782 CA LEU A 526 -1.889 -13.286 69.498 1.00 32.64 C ATOM 783 C LEU A 526 -2.176 -14.783 69.550 1.00 33.92 C ATOM 784 O LEU A 526 -1.484 -15.560 68.915 1.00 34.09 O ATOM 785 CB LEU A 526 -0.493 -12.991 70.048 1.00 32.18 C ATOM 786 CG LEU A 526 0.083 -11.636 69.645 1.00 29.80 C ATOM 787 CD1 LEU A 526 1.136 -11.189 70.625 1.00 23.69 C ATOM 788 CD2 LEU A 526 0.650 -11.717 68.216 1.00 31.26 C ATOM 0 H LEU A 526 -2.794 -12.517 71.074 1.00 33.08 H new ATOM 0 HA LEU A 526 -1.925 -13.012 68.568 1.00 32.64 H new ATOM 0 HB2 LEU A 526 -0.524 -13.040 71.016 1.00 32.18 H new ATOM 0 HB3 LEU A 526 0.112 -13.687 69.748 1.00 32.18 H new ATOM 0 HG LEU A 526 -0.626 -10.974 69.659 1.00 29.80 H new ATOM 0 HD11 LEU A 526 1.488 -10.328 70.351 1.00 23.69 H new ATOM 0 HD12 LEU A 526 0.744 -11.111 71.509 1.00 23.69 H new ATOM 0 HD13 LEU A 526 1.855 -11.840 70.647 1.00 23.69 H new ATOM 0 HD21 LEU A 526 1.015 -10.855 67.963 1.00 31.26 H new ATOM 0 HD22 LEU A 526 1.351 -12.387 68.183 1.00 31.26 H new ATOM 0 HD23 LEU A 526 -0.058 -11.961 67.600 1.00 31.26 H new ATOM 789 N GLU A 527 -3.193 -15.188 70.299 1.00 35.76 N ATOM 790 CA GLU A 527 -3.463 -16.615 70.463 1.00 39.64 C ATOM 791 C GLU A 527 -3.736 -17.286 69.120 1.00 41.54 C ATOM 792 O GLU A 527 -3.119 -18.303 68.804 1.00 41.81 O ATOM 793 CB GLU A 527 -4.615 -16.858 71.431 1.00 39.99 C ATOM 794 CG GLU A 527 -4.246 -16.590 72.870 1.00 41.64 C ATOM 795 CD GLU A 527 -5.232 -17.186 73.851 1.00 44.38 C ATOM 796 OE1 GLU A 527 -4.772 -17.833 74.812 1.00 48.25 O ATOM 797 OE2 GLU A 527 -6.456 -17.015 73.668 1.00 45.90 O ATOM 0 H GLU A 527 -3.733 -14.664 70.716 1.00 35.76 H new ATOM 0 HA GLU A 527 -2.666 -17.016 70.843 1.00 39.64 H new ATOM 0 HB2 GLU A 527 -5.363 -16.292 71.184 1.00 39.99 H new ATOM 0 HB3 GLU A 527 -4.914 -17.777 71.345 1.00 39.99 H new ATOM 0 HG2 GLU A 527 -3.363 -16.952 73.046 1.00 41.64 H new ATOM 0 HG3 GLU A 527 -4.194 -15.632 73.013 1.00 41.64 H new ATOM 798 N GLU A 528 -4.629 -16.690 68.331 1.00 43.75 N ATOM 799 CA GLU A 528 -5.008 -17.230 67.018 1.00 46.84 C ATOM 800 C GLU A 528 -3.843 -17.273 66.022 1.00 48.71 C ATOM 801 O GLU A 528 -3.630 -18.296 65.362 1.00 49.05 O ATOM 802 CB GLU A 528 -6.207 -16.465 66.440 1.00 46.87 C ATOM 0 H GLU A 528 -5.034 -15.961 68.539 1.00 43.75 H new ATOM 0 HA GLU A 528 -5.269 -18.153 67.164 1.00 46.84 H new ATOM 803 N ASP A 529 -3.089 -16.171 65.937 1.00 50.67 N ATOM 804 CA ASP A 529 -1.903 -16.070 65.074 1.00 52.70 C ATOM 805 C ASP A 529 -0.861 -17.137 65.378 1.00 54.39 C ATOM 806 O ASP A 529 -0.211 -17.655 64.469 1.00 54.43 O ATOM 807 CB ASP A 529 -1.237 -14.701 65.220 1.00 52.91 C ATOM 808 CG ASP A 529 -2.135 -13.567 64.791 1.00 53.35 C ATOM 809 OD1 ASP A 529 -2.204 -13.281 63.577 1.00 53.42 O ATOM 810 OD2 ASP A 529 -2.763 -12.956 65.676 1.00 54.92 O ATOM 0 H ASP A 529 -3.253 -15.454 66.383 1.00 50.67 H new ATOM 0 HA ASP A 529 -2.225 -16.199 64.168 1.00 52.70 H new ATOM 0 HB2 ASP A 529 -0.976 -14.570 66.145 1.00 52.91 H new ATOM 0 HB3 ASP A 529 -0.424 -14.683 64.691 1.00 52.91 H new ATOM 811 N ILE A 530 -0.693 -17.430 66.666 1.00 56.12 N ATOM 812 CA ILE A 530 0.233 -18.458 67.138 1.00 57.91 C ATOM 813 C ILE A 530 -0.320 -19.871 66.893 1.00 59.10 C ATOM 814 O ILE A 530 0.432 -20.774 66.521 1.00 59.65 O ATOM 815 CB ILE A 530 0.596 -18.229 68.632 1.00 57.76 C ATOM 816 CG1 ILE A 530 1.702 -17.173 68.743 1.00 57.23 C ATOM 817 CG2 ILE A 530 1.000 -19.537 69.327 1.00 58.00 C ATOM 818 CD1 ILE A 530 1.642 -16.328 70.004 1.00 56.59 C ATOM 0 H ILE A 530 -1.119 -17.032 67.298 1.00 56.12 H new ATOM 0 HA ILE A 530 1.051 -18.384 66.622 1.00 57.91 H new ATOM 0 HB ILE A 530 -0.194 -17.902 69.091 1.00 57.76 H new ATOM 0 HG12 ILE A 530 2.563 -17.618 68.706 1.00 57.23 H new ATOM 0 HG13 ILE A 530 1.652 -16.587 67.972 1.00 57.23 H new ATOM 0 HG21 ILE A 530 1.219 -19.357 70.255 1.00 58.00 H new ATOM 0 HG22 ILE A 530 0.263 -20.167 69.286 1.00 58.00 H new ATOM 0 HG23 ILE A 530 1.773 -19.915 68.880 1.00 58.00 H new ATOM 0 HD11 ILE A 530 2.371 -15.688 70.000 1.00 56.59 H new ATOM 0 HD12 ILE A 530 0.796 -15.854 70.037 1.00 56.59 H new ATOM 0 HD13 ILE A 530 1.721 -16.902 70.782 1.00 56.59 H new ATOM 819 N SER A 531 -1.629 -20.045 67.076 1.00 60.32 N ATOM 820 CA SER A 531 -2.277 -21.351 66.907 1.00 61.77 C ATOM 821 C SER A 531 -2.336 -21.819 65.441 1.00 62.73 C ATOM 822 O SER A 531 -2.468 -23.018 65.168 1.00 62.71 O ATOM 823 CB SER A 531 -3.683 -21.345 67.528 1.00 61.61 C ATOM 824 OG SER A 531 -4.662 -20.914 66.598 1.00 61.87 O ATOM 0 H SER A 531 -2.167 -19.413 67.301 1.00 60.32 H new ATOM 0 HA SER A 531 -1.721 -21.992 67.377 1.00 61.77 H new ATOM 0 HB2 SER A 531 -3.903 -22.236 67.841 1.00 61.61 H new ATOM 0 HB3 SER A 531 -3.693 -20.762 68.303 1.00 61.61 H new ATOM 0 HG SER A 531 -4.406 -20.204 66.230 1.00 61.87 H new ATOM 825 N LYS A 532 -2.240 -20.865 64.516 1.00 63.87 N ATOM 826 CA LYS A 532 -2.270 -21.147 63.082 1.00 65.02 C ATOM 827 C LYS A 532 -0.939 -21.727 62.585 1.00 65.89 C ATOM 828 O LYS A 532 -0.927 -22.620 61.729 1.00 66.16 O ATOM 829 CB LYS A 532 -2.636 -19.885 62.294 1.00 65.12 C ATOM 0 H LYS A 532 -2.155 -20.030 64.705 1.00 63.87 H new ATOM 0 HA LYS A 532 -2.953 -21.819 62.932 1.00 65.02 H new ATOM 830 N PHE A 533 0.170 -21.220 63.129 1.00 66.24 N ATOM 831 CA PHE A 533 1.514 -21.685 62.774 1.00 66.33 C ATOM 832 C PHE A 533 1.764 -23.133 63.224 1.00 66.66 C ATOM 833 O PHE A 533 1.149 -23.617 64.186 1.00 66.88 O ATOM 834 CB PHE A 533 2.578 -20.749 63.360 1.00 66.32 C ATOM 0 H PHE A 533 0.163 -20.593 63.718 1.00 66.24 H new ATOM 0 HA PHE A 533 1.578 -21.670 61.806 1.00 66.33 H new ATOM 835 N ALA A 534 2.671 -23.808 62.518 1.00 66.62 N ATOM 836 CA ALA A 534 3.003 -25.211 62.772 1.00 66.22 C ATOM 837 C ALA A 534 3.673 -25.430 64.134 1.00 65.99 C ATOM 838 O ALA A 534 3.258 -26.297 64.910 1.00 65.96 O ATOM 839 CB ALA A 534 3.890 -25.749 61.650 1.00 66.33 C ATOM 0 H ALA A 534 3.116 -23.460 61.870 1.00 66.62 H new ATOM 0 HA ALA A 534 2.166 -25.701 62.793 1.00 66.22 H new ATOM 0 HB1 ALA A 534 4.106 -26.678 61.825 1.00 66.33 H new ATOM 0 HB2 ALA A 534 3.420 -25.680 60.804 1.00 66.33 H new ATOM 0 HB3 ALA A 534 4.708 -25.230 61.607 1.00 66.33 H new ATOM 840 N GLU A 535 4.707 -24.638 64.411 1.00 65.28 N ATOM 841 CA GLU A 535 5.477 -24.751 65.645 1.00 64.40 C ATOM 842 C GLU A 535 4.864 -23.913 66.770 1.00 63.86 C ATOM 843 O GLU A 535 5.410 -23.858 67.877 1.00 64.11 O ATOM 844 CB GLU A 535 6.931 -24.328 65.398 1.00 64.52 C ATOM 0 H GLU A 535 4.982 -24.017 63.884 1.00 65.28 H new ATOM 0 HA GLU A 535 5.457 -25.679 65.925 1.00 64.40 H new ATOM 845 N LYS A 536 3.725 -23.280 66.475 1.00 62.83 N ATOM 846 CA LYS A 536 3.043 -22.349 67.384 1.00 61.73 C ATOM 847 C LYS A 536 3.928 -21.140 67.744 1.00 61.08 C ATOM 848 O LYS A 536 4.410 -20.431 66.849 1.00 60.86 O ATOM 849 CB LYS A 536 2.494 -23.067 68.631 1.00 61.82 C ATOM 0 H LYS A 536 3.318 -23.382 65.724 1.00 62.83 H new ATOM 0 HA LYS A 536 2.276 -21.995 66.907 1.00 61.73 H new ATOM 850 N ASP A 537 4.144 -20.915 69.040 1.00 59.89 N ATOM 851 CA ASP A 537 4.942 -19.780 69.516 1.00 59.12 C ATOM 852 C ASP A 537 6.440 -19.997 69.321 1.00 58.40 C ATOM 853 O ASP A 537 7.233 -19.081 69.538 1.00 57.95 O ATOM 854 CB ASP A 537 4.654 -19.507 70.993 1.00 59.02 C ATOM 0 H ASP A 537 3.834 -21.414 69.668 1.00 59.89 H new ATOM 0 HA ASP A 537 4.683 -19.013 68.982 1.00 59.12 H new ATOM 855 N ASN A 538 6.809 -21.215 68.916 1.00 57.94 N ATOM 856 CA ASN A 538 8.208 -21.625 68.752 1.00 56.83 C ATOM 857 C ASN A 538 8.765 -21.500 67.319 1.00 56.14 C ATOM 858 O ASN A 538 9.812 -22.077 67.001 1.00 55.95 O ATOM 859 CB ASN A 538 8.407 -23.049 69.294 1.00 57.34 C ATOM 0 H ASN A 538 6.245 -21.836 68.726 1.00 57.94 H new ATOM 0 HA ASN A 538 8.726 -20.991 69.272 1.00 56.83 H new ATOM 860 N ILE A 539 8.069 -20.742 66.468 1.00 54.85 N ATOM 861 CA ILE A 539 8.555 -20.429 65.117 1.00 53.51 C ATOM 862 C ILE A 539 9.603 -19.312 65.174 1.00 51.92 C ATOM 863 O ILE A 539 9.358 -18.251 65.757 1.00 52.22 O ATOM 864 CB ILE A 539 7.397 -20.004 64.179 1.00 54.04 C ATOM 0 H ILE A 539 7.305 -20.395 66.655 1.00 54.85 H new ATOM 0 HA ILE A 539 8.957 -21.235 64.758 1.00 53.51 H new ATOM 865 N VAL A 540 10.761 -19.556 64.563 1.00 49.65 N ATOM 866 CA VAL A 540 11.911 -18.650 64.657 1.00 47.43 C ATOM 867 C VAL A 540 11.841 -17.484 63.657 1.00 46.37 C ATOM 868 O VAL A 540 11.703 -17.691 62.448 1.00 46.64 O ATOM 869 CB VAL A 540 13.248 -19.429 64.504 1.00 47.58 C ATOM 870 CG1 VAL A 540 14.449 -18.487 64.477 1.00 47.50 C ATOM 871 CG2 VAL A 540 13.392 -20.454 65.625 1.00 46.85 C ATOM 0 H VAL A 540 10.904 -20.253 64.080 1.00 49.65 H new ATOM 0 HA VAL A 540 11.878 -18.257 65.543 1.00 47.43 H new ATOM 0 HB VAL A 540 13.226 -19.895 63.653 1.00 47.58 H new ATOM 0 HG11 VAL A 540 15.264 -19.004 64.381 1.00 47.50 H new ATOM 0 HG12 VAL A 540 14.364 -17.876 63.729 1.00 47.50 H new ATOM 0 HG13 VAL A 540 14.483 -17.982 65.304 1.00 47.50 H new ATOM 0 HG21 VAL A 540 14.229 -20.934 65.520 1.00 46.85 H new ATOM 0 HG22 VAL A 540 13.386 -20.000 66.482 1.00 46.85 H new ATOM 0 HG23 VAL A 540 12.653 -21.081 65.587 1.00 46.85 H new ATOM 872 N LEU A 541 11.946 -16.264 64.181 1.00 43.88 N ATOM 873 CA LEU A 541 11.900 -15.044 63.378 1.00 41.41 C ATOM 874 C LEU A 541 13.289 -14.503 63.050 1.00 40.96 C ATOM 875 O LEU A 541 14.253 -14.703 63.802 1.00 40.57 O ATOM 876 CB LEU A 541 11.089 -13.964 64.100 1.00 40.68 C ATOM 877 CG LEU A 541 9.647 -14.308 64.480 1.00 38.73 C ATOM 878 CD1 LEU A 541 9.113 -13.298 65.480 1.00 37.67 C ATOM 879 CD2 LEU A 541 8.739 -14.420 63.262 1.00 39.39 C ATOM 0 H LEU A 541 12.047 -16.120 65.023 1.00 43.88 H new ATOM 0 HA LEU A 541 11.472 -15.278 62.540 1.00 41.41 H new ATOM 0 HB2 LEU A 541 11.564 -13.723 64.911 1.00 40.68 H new ATOM 0 HB3 LEU A 541 11.071 -13.175 63.537 1.00 40.68 H new ATOM 0 HG LEU A 541 9.653 -15.184 64.897 1.00 38.73 H new ATOM 0 HD11 LEU A 541 8.199 -13.525 65.714 1.00 37.67 H new ATOM 0 HD12 LEU A 541 9.663 -13.311 66.279 1.00 37.67 H new ATOM 0 HD13 LEU A 541 9.135 -12.411 65.088 1.00 37.67 H new ATOM 0 HD21 LEU A 541 7.838 -14.638 63.549 1.00 39.39 H new ATOM 0 HD22 LEU A 541 8.730 -13.575 62.786 1.00 39.39 H new ATOM 0 HD23 LEU A 541 9.069 -15.118 62.675 1.00 39.39 H new ATOM 880 N GLY A 542 13.386 -13.823 61.914 1.00 39.96 N ATOM 881 CA GLY A 542 14.587 -13.065 61.585 1.00 38.84 C ATOM 882 C GLY A 542 14.534 -11.666 62.172 1.00 37.84 C ATOM 883 O GLY A 542 13.534 -11.273 62.789 1.00 37.14 O ATOM 0 H GLY A 542 12.766 -13.787 61.319 1.00 39.96 H new ATOM 0 HA2 GLY A 542 15.368 -13.530 61.923 1.00 38.84 H new ATOM 0 HA3 GLY A 542 14.684 -13.010 60.621 1.00 38.84 H new ATOM 884 N GLU A 543 15.616 -10.920 61.974 1.00 37.30 N ATOM 885 CA GLU A 543 15.722 -9.543 62.445 1.00 37.47 C ATOM 886 C GLU A 543 14.744 -8.668 61.680 1.00 36.62 C ATOM 887 O GLU A 543 14.821 -8.563 60.460 1.00 36.94 O ATOM 888 CB GLU A 543 17.146 -9.010 62.259 1.00 37.57 C ATOM 0 H GLU A 543 16.315 -11.201 61.559 1.00 37.30 H new ATOM 0 HA GLU A 543 15.509 -9.523 63.391 1.00 37.47 H new ATOM 889 N GLY A 544 13.818 -8.050 62.400 1.00 35.19 N ATOM 890 CA GLY A 544 12.821 -7.200 61.767 1.00 33.27 C ATOM 891 C GLY A 544 11.477 -7.877 61.681 1.00 32.21 C ATOM 892 O GLY A 544 10.456 -7.209 61.577 1.00 31.37 O ATOM 0 H GLY A 544 13.749 -8.109 63.255 1.00 35.19 H new ATOM 0 HA2 GLY A 544 12.735 -6.374 62.269 1.00 33.27 H new ATOM 0 HA3 GLY A 544 13.120 -6.961 60.876 1.00 33.27 H new ATOM 893 N GLY A 545 11.477 -9.206 61.737 1.00 32.41 N ATOM 894 CA GLY A 545 10.255 -9.987 61.580 1.00 31.47 C ATOM 895 C GLY A 545 9.576 -9.627 60.274 1.00 31.84 C ATOM 896 O GLY A 545 8.404 -9.255 60.261 1.00 31.85 O ATOM 0 H GLY A 545 12.184 -9.679 61.867 1.00 32.41 H new ATOM 0 HA2 GLY A 545 10.463 -10.934 61.595 1.00 31.47 H new ATOM 0 HA3 GLY A 545 9.655 -9.817 62.323 1.00 31.47 H new ATOM 897 N ILE A 546 10.321 -9.712 59.176 1.00 32.26 N ATOM 898 CA ILE A 546 9.798 -9.317 57.851 1.00 33.52 C ATOM 899 C ILE A 546 8.746 -10.285 57.285 1.00 32.60 C ATOM 900 O ILE A 546 7.954 -9.910 56.424 1.00 33.13 O ATOM 901 CB ILE A 546 10.929 -8.992 56.826 1.00 33.63 C ATOM 902 CG1 ILE A 546 11.855 -10.185 56.598 1.00 35.11 C ATOM 903 CG2 ILE A 546 11.736 -7.749 57.287 1.00 34.27 C ATOM 904 CD1 ILE A 546 12.611 -10.130 55.274 1.00 35.30 C ATOM 0 H ILE A 546 11.133 -9.995 59.168 1.00 32.26 H new ATOM 0 HA ILE A 546 9.322 -8.486 58.006 1.00 33.52 H new ATOM 0 HB ILE A 546 10.505 -8.793 55.977 1.00 33.63 H new ATOM 0 HG12 ILE A 546 12.495 -10.231 57.325 1.00 35.11 H new ATOM 0 HG13 ILE A 546 11.332 -11.001 56.629 1.00 35.11 H new ATOM 0 HG21 ILE A 546 12.435 -7.559 56.641 1.00 34.27 H new ATOM 0 HG22 ILE A 546 11.143 -6.985 57.355 1.00 34.27 H new ATOM 0 HG23 ILE A 546 12.136 -7.926 58.153 1.00 34.27 H new ATOM 0 HD11 ILE A 546 13.178 -10.913 55.192 1.00 35.30 H new ATOM 0 HD12 ILE A 546 11.977 -10.112 54.540 1.00 35.30 H new ATOM 0 HD13 ILE A 546 13.159 -9.330 55.247 1.00 35.30 H new ATOM 905 N THR A 547 8.721 -11.507 57.815 1.00 31.64 N ATOM 906 CA THR A 547 7.754 -12.527 57.429 1.00 32.16 C ATOM 907 C THR A 547 6.439 -12.426 58.220 1.00 30.51 C ATOM 908 O THR A 547 5.532 -13.214 58.007 1.00 31.79 O ATOM 909 CB THR A 547 8.348 -13.961 57.569 1.00 32.53 C ATOM 910 OG1 THR A 547 8.590 -14.251 58.951 1.00 35.84 O ATOM 911 CG2 THR A 547 9.666 -14.100 56.768 1.00 33.88 C ATOM 0 H THR A 547 9.275 -11.768 58.418 1.00 31.64 H new ATOM 0 HA THR A 547 7.550 -12.361 56.495 1.00 32.16 H new ATOM 0 HB THR A 547 7.706 -14.593 57.209 1.00 32.53 H new ATOM 0 HG1 THR A 547 9.241 -13.795 59.223 1.00 35.84 H new ATOM 0 HG21 THR A 547 10.014 -14.999 56.871 1.00 33.88 H new ATOM 0 HG22 THR A 547 9.494 -13.926 55.829 1.00 33.88 H new ATOM 0 HG23 THR A 547 10.316 -13.462 57.101 1.00 33.88 H new ATOM 912 N LEU A 548 6.352 -11.467 59.142 1.00 28.41 N ATOM 913 CA LEU A 548 5.124 -11.215 59.899 1.00 25.85 C ATOM 914 C LEU A 548 4.350 -10.083 59.251 1.00 24.26 C ATOM 915 O LEU A 548 4.921 -9.257 58.552 1.00 23.62 O ATOM 916 CB LEU A 548 5.432 -10.827 61.356 1.00 26.43 C ATOM 917 CG LEU A 548 6.039 -11.866 62.311 1.00 26.61 C ATOM 918 CD1 LEU A 548 6.171 -11.254 63.660 1.00 26.54 C ATOM 919 CD2 LEU A 548 5.227 -13.163 62.397 1.00 30.02 C ATOM 0 H LEU A 548 7.003 -10.944 59.347 1.00 28.41 H new ATOM 0 HA LEU A 548 4.601 -12.032 59.896 1.00 25.85 H new ATOM 0 HB2 LEU A 548 6.036 -10.069 61.332 1.00 26.43 H new ATOM 0 HB3 LEU A 548 4.604 -10.517 61.754 1.00 26.43 H new ATOM 0 HG LEU A 548 6.906 -12.117 61.957 1.00 26.61 H new ATOM 0 HD11 LEU A 548 6.554 -11.901 64.273 1.00 26.54 H new ATOM 0 HD12 LEU A 548 6.749 -10.477 63.608 1.00 26.54 H new ATOM 0 HD13 LEU A 548 5.296 -10.984 63.980 1.00 26.54 H new ATOM 0 HD21 LEU A 548 5.659 -13.775 63.012 1.00 30.02 H new ATOM 0 HD22 LEU A 548 4.332 -12.964 62.714 1.00 30.02 H new ATOM 0 HD23 LEU A 548 5.175 -13.571 61.519 1.00 30.02 H new ATOM 920 N SER A 549 3.049 -10.039 59.501 1.00 22.99 N ATOM 921 CA SER A 549 2.253 -8.886 59.099 1.00 22.19 C ATOM 922 C SER A 549 2.614 -7.679 59.981 1.00 22.11 C ATOM 923 O SER A 549 3.231 -7.844 61.067 1.00 22.30 O ATOM 924 CB SER A 549 0.781 -9.225 59.198 1.00 20.39 C ATOM 925 OG SER A 549 0.346 -9.227 60.538 1.00 21.76 O ATOM 0 H SER A 549 2.609 -10.661 59.900 1.00 22.99 H new ATOM 0 HA SER A 549 2.446 -8.654 58.177 1.00 22.19 H new ATOM 0 HB2 SER A 549 0.264 -8.582 58.689 1.00 20.39 H new ATOM 0 HB3 SER A 549 0.620 -10.096 58.802 1.00 20.39 H new ATOM 0 HG SER A 549 -0.472 -9.416 60.567 1.00 21.76 H new ATOM 926 N GLY A 550 2.283 -6.471 59.526 1.00 21.42 N ATOM 927 CA GLY A 550 2.551 -5.277 60.326 1.00 21.04 C ATOM 928 C GLY A 550 1.787 -5.286 61.649 1.00 22.07 C ATOM 929 O GLY A 550 2.317 -4.871 62.686 1.00 22.14 O ATOM 0 H GLY A 550 1.907 -6.322 58.767 1.00 21.42 H new ATOM 0 HA2 GLY A 550 3.503 -5.216 60.504 1.00 21.04 H new ATOM 0 HA3 GLY A 550 2.306 -4.488 59.818 1.00 21.04 H new ATOM 930 N GLY A 551 0.543 -5.749 61.602 1.00 22.23 N ATOM 931 CA GLY A 551 -0.275 -5.966 62.798 1.00 23.40 C ATOM 932 C GLY A 551 0.307 -6.973 63.780 1.00 23.78 C ATOM 933 O GLY A 551 0.153 -6.833 64.996 1.00 24.18 O ATOM 0 H GLY A 551 0.142 -5.949 60.868 1.00 22.23 H new ATOM 0 HA2 GLY A 551 -0.395 -5.118 63.253 1.00 23.40 H new ATOM 0 HA3 GLY A 551 -1.155 -6.268 62.525 1.00 23.40 H new ATOM 934 N GLN A 552 0.961 -8.003 63.257 1.00 23.34 N ATOM 935 CA GLN A 552 1.566 -9.022 64.092 1.00 22.68 C ATOM 936 C GLN A 552 2.778 -8.464 64.802 1.00 21.14 C ATOM 937 O GLN A 552 2.918 -8.700 65.993 1.00 19.81 O ATOM 938 CB GLN A 552 1.952 -10.269 63.284 1.00 22.27 C ATOM 939 CG GLN A 552 0.833 -11.297 63.143 1.00 24.10 C ATOM 940 CD GLN A 552 1.083 -12.313 62.005 1.00 26.56 C ATOM 941 OE1 GLN A 552 2.096 -12.245 61.306 1.00 23.61 O ATOM 942 NE2 GLN A 552 0.140 -13.245 61.820 1.00 27.94 N ATOM 0 H GLN A 552 1.064 -8.128 62.412 1.00 23.34 H new ATOM 0 HA GLN A 552 0.905 -9.292 64.749 1.00 22.68 H new ATOM 0 HB2 GLN A 552 2.236 -9.993 62.399 1.00 22.27 H new ATOM 0 HB3 GLN A 552 2.715 -10.693 63.708 1.00 22.27 H new ATOM 0 HG2 GLN A 552 0.734 -11.776 63.981 1.00 24.10 H new ATOM 0 HG3 GLN A 552 -0.004 -10.835 62.979 1.00 24.10 H new ATOM 0 HE21 GLN A 552 -0.554 -13.261 62.328 1.00 27.94 H new ATOM 0 HE22 GLN A 552 0.228 -13.827 61.193 1.00 27.94 H new ATOM 943 N ARG A 553 3.650 -7.741 64.081 1.00 20.21 N ATOM 944 CA ARG A 553 4.792 -7.098 64.709 1.00 21.45 C ATOM 945 C ARG A 553 4.314 -6.125 65.784 1.00 21.13 C ATOM 946 O ARG A 553 4.888 -6.078 66.866 1.00 19.66 O ATOM 947 CB ARG A 553 5.698 -6.363 63.711 1.00 21.83 C ATOM 948 CG ARG A 553 6.256 -7.226 62.614 1.00 25.06 C ATOM 949 CD ARG A 553 7.235 -6.411 61.770 1.00 28.14 C ATOM 950 NE ARG A 553 6.528 -5.470 60.890 1.00 28.13 N ATOM 951 CZ ARG A 553 6.088 -5.769 59.670 1.00 28.84 C ATOM 952 NH1 ARG A 553 6.285 -6.989 59.176 1.00 25.54 N ATOM 953 NH2 ARG A 553 5.456 -4.849 58.944 1.00 28.71 N ATOM 0 H ARG A 553 3.590 -7.617 63.232 1.00 20.21 H new ATOM 0 HA ARG A 553 5.326 -7.804 65.105 1.00 21.45 H new ATOM 0 HB2 ARG A 553 5.195 -5.637 63.310 1.00 21.83 H new ATOM 0 HB3 ARG A 553 6.436 -5.962 64.197 1.00 21.83 H new ATOM 0 HG2 ARG A 553 6.706 -7.997 62.993 1.00 25.06 H new ATOM 0 HG3 ARG A 553 5.537 -7.563 62.057 1.00 25.06 H new ATOM 0 HD2 ARG A 553 7.838 -5.922 62.352 1.00 28.14 H new ATOM 0 HD3 ARG A 553 7.780 -7.009 61.236 1.00 28.14 H new ATOM 0 HE ARG A 553 6.389 -4.673 61.183 1.00 28.13 H new ATOM 0 HH11 ARG A 553 6.696 -7.582 59.645 1.00 25.54 H new ATOM 0 HH12 ARG A 553 6.002 -7.185 58.388 1.00 25.54 H new ATOM 0 HH21 ARG A 553 5.332 -4.060 59.263 1.00 28.71 H new ATOM 0 HH22 ARG A 553 5.172 -5.044 58.156 1.00 28.71 H new ATOM 954 N ALA A 554 3.271 -5.348 65.487 1.00 21.66 N ATOM 955 CA ALA A 554 2.736 -4.393 66.465 1.00 21.21 C ATOM 956 C ALA A 554 2.261 -5.100 67.760 1.00 21.20 C ATOM 957 O ALA A 554 2.568 -4.652 68.861 1.00 19.52 O ATOM 958 CB ALA A 554 1.618 -3.566 65.853 1.00 21.31 C ATOM 0 H ALA A 554 2.860 -5.357 64.731 1.00 21.66 H new ATOM 0 HA ALA A 554 3.458 -3.794 66.714 1.00 21.21 H new ATOM 0 HB1 ALA A 554 1.278 -2.942 66.513 1.00 21.31 H new ATOM 0 HB2 ALA A 554 1.960 -3.074 65.090 1.00 21.31 H new ATOM 0 HB3 ALA A 554 0.902 -4.153 65.565 1.00 21.31 H new ATOM 959 N ARG A 555 1.519 -6.200 67.618 1.00 20.44 N ATOM 960 CA ARG A 555 0.990 -6.910 68.784 1.00 20.47 C ATOM 961 C ARG A 555 2.084 -7.643 69.574 1.00 20.81 C ATOM 962 O ARG A 555 2.018 -7.703 70.805 1.00 20.35 O ATOM 963 CB ARG A 555 -0.194 -7.819 68.418 1.00 19.93 C ATOM 964 CG ARG A 555 -1.418 -7.005 68.017 1.00 21.44 C ATOM 965 CD ARG A 555 -2.567 -7.845 67.511 1.00 24.93 C ATOM 966 NE ARG A 555 -2.373 -8.348 66.150 1.00 30.30 N ATOM 967 CZ ARG A 555 -2.353 -9.631 65.823 1.00 31.73 C ATOM 968 NH1 ARG A 555 -2.499 -10.555 66.756 1.00 36.52 N ATOM 969 NH2 ARG A 555 -2.194 -9.994 64.562 1.00 35.17 N ATOM 0 H ARG A 555 1.312 -6.549 66.860 1.00 20.44 H new ATOM 0 HA ARG A 555 0.639 -6.235 69.386 1.00 20.47 H new ATOM 0 HB2 ARG A 555 0.060 -8.405 67.688 1.00 19.93 H new ATOM 0 HB3 ARG A 555 -0.414 -8.386 69.174 1.00 19.93 H new ATOM 0 HG2 ARG A 555 -1.718 -6.488 68.781 1.00 21.44 H new ATOM 0 HG3 ARG A 555 -1.163 -6.371 67.328 1.00 21.44 H new ATOM 0 HD2 ARG A 555 -2.696 -8.597 68.110 1.00 24.93 H new ATOM 0 HD3 ARG A 555 -3.380 -7.317 67.539 1.00 24.93 H new ATOM 0 HE ARG A 555 -2.265 -7.772 65.521 1.00 30.30 H new ATOM 0 HH11 ARG A 555 -2.607 -10.324 67.577 1.00 36.52 H new ATOM 0 HH12 ARG A 555 -2.486 -11.388 66.542 1.00 36.52 H new ATOM 0 HH21 ARG A 555 -2.103 -9.396 63.951 1.00 35.17 H new ATOM 0 HH22 ARG A 555 -2.181 -10.828 64.353 1.00 35.17 H new ATOM 970 N ILE A 556 3.096 -8.154 68.881 1.00 20.12 N ATOM 971 CA ILE A 556 4.234 -8.781 69.563 1.00 21.66 C ATOM 972 C ILE A 556 5.025 -7.731 70.351 1.00 22.16 C ATOM 973 O ILE A 556 5.453 -7.982 71.480 1.00 22.12 O ATOM 974 CB ILE A 556 5.160 -9.534 68.591 1.00 23.14 C ATOM 975 CG1 ILE A 556 4.415 -10.739 68.008 1.00 22.17 C ATOM 976 CG2 ILE A 556 6.469 -9.975 69.297 1.00 20.75 C ATOM 977 CD1 ILE A 556 5.087 -11.302 66.787 1.00 23.67 C ATOM 0 H ILE A 556 3.147 -8.150 68.023 1.00 20.12 H new ATOM 0 HA ILE A 556 3.873 -9.439 70.178 1.00 21.66 H new ATOM 0 HB ILE A 556 5.410 -8.938 67.868 1.00 23.14 H new ATOM 0 HG12 ILE A 556 4.349 -11.431 68.684 1.00 22.17 H new ATOM 0 HG13 ILE A 556 3.509 -10.476 67.782 1.00 22.17 H new ATOM 0 HG21 ILE A 556 7.035 -10.446 68.665 1.00 20.75 H new ATOM 0 HG22 ILE A 556 6.937 -9.193 69.629 1.00 20.75 H new ATOM 0 HG23 ILE A 556 6.255 -10.562 70.039 1.00 20.75 H new ATOM 0 HD11 ILE A 556 4.578 -12.060 66.458 1.00 23.67 H new ATOM 0 HD12 ILE A 556 5.132 -10.620 66.099 1.00 23.67 H new ATOM 0 HD13 ILE A 556 5.985 -11.590 67.015 1.00 23.67 H new ATOM 978 N SER A 557 5.198 -6.550 69.758 1.00 20.66 N ATOM 979 CA SER A 557 5.902 -5.482 70.428 1.00 20.41 C ATOM 980 C SER A 557 5.151 -4.976 71.661 1.00 20.10 C ATOM 981 O SER A 557 5.773 -4.667 72.691 1.00 20.19 O ATOM 982 CB ASER A 557 6.134 -4.328 69.450 0.65 21.35 C ATOM 983 CB BSER A 557 6.215 -4.361 69.445 0.35 20.23 C ATOM 984 OG ASER A 557 6.468 -3.140 70.142 0.65 25.40 O ATOM 985 OG BSER A 557 7.082 -4.858 68.442 0.35 15.74 O ATOM 0 H SER A 557 4.913 -6.356 68.970 1.00 20.66 H new ATOM 0 HA SER A 557 6.752 -5.837 70.733 1.00 20.41 H new ATOM 0 HB2ASER A 557 6.847 -4.559 68.834 0.65 20.23 H new ATOM 0 HB2BSER A 557 5.397 -4.027 69.045 0.35 20.23 H new ATOM 0 HB3ASER A 557 5.335 -4.184 68.919 0.65 20.23 H new ATOM 0 HB3BSER A 557 6.629 -3.616 69.907 0.35 20.23 H new ATOM 0 HG ASER A 557 7.230 -3.221 70.487 0.65 15.74 H new ATOM 0 HG BSER A 557 6.633 -5.265 67.860 0.35 15.74 H new ATOM 986 N LEU A 558 3.830 -4.900 71.568 1.00 18.81 N ATOM 987 CA LEU A 558 3.014 -4.492 72.703 1.00 20.21 C ATOM 988 C LEU A 558 3.051 -5.563 73.789 1.00 20.72 C ATOM 989 O LEU A 558 3.303 -5.257 74.958 1.00 20.29 O ATOM 990 CB LEU A 558 1.575 -4.189 72.280 1.00 20.44 C ATOM 991 CG LEU A 558 0.592 -3.907 73.413 1.00 17.94 C ATOM 992 CD1 LEU A 558 1.027 -2.677 74.258 1.00 17.19 C ATOM 993 CD2 LEU A 558 -0.808 -3.712 72.872 1.00 20.79 C ATOM 0 H LEU A 558 3.385 -5.081 70.854 1.00 18.81 H new ATOM 0 HA LEU A 558 3.386 -3.672 73.063 1.00 20.21 H new ATOM 0 HB2 LEU A 558 1.586 -3.422 71.686 1.00 20.44 H new ATOM 0 HB3 LEU A 558 1.242 -4.941 71.766 1.00 20.44 H new ATOM 0 HG LEU A 558 0.593 -4.681 73.998 1.00 17.94 H new ATOM 0 HD11 LEU A 558 0.382 -2.527 74.967 1.00 17.19 H new ATOM 0 HD12 LEU A 558 1.900 -2.843 74.646 1.00 17.19 H new ATOM 0 HD13 LEU A 558 1.070 -1.892 73.689 1.00 17.19 H new ATOM 0 HD21 LEU A 558 -1.417 -3.534 73.606 1.00 20.79 H new ATOM 0 HD22 LEU A 558 -0.816 -2.962 72.257 1.00 20.79 H new ATOM 0 HD23 LEU A 558 -1.090 -4.515 72.406 1.00 20.79 H new ATOM 994 N ALA A 559 2.820 -6.813 73.388 1.00 19.21 N ATOM 995 CA ALA A 559 2.907 -7.947 74.308 1.00 19.36 C ATOM 996 C ALA A 559 4.229 -8.026 75.090 1.00 19.93 C ATOM 997 O ALA A 559 4.224 -8.341 76.279 1.00 20.36 O ATOM 998 CB ALA A 559 2.625 -9.264 73.563 1.00 17.53 C ATOM 0 H ALA A 559 2.610 -7.026 72.582 1.00 19.21 H new ATOM 0 HA ALA A 559 2.222 -7.801 74.979 1.00 19.36 H new ATOM 0 HB1 ALA A 559 2.686 -10.007 74.184 1.00 17.53 H new ATOM 0 HB2 ALA A 559 1.734 -9.235 73.180 1.00 17.53 H new ATOM 0 HB3 ALA A 559 3.277 -9.381 72.854 1.00 17.53 H new ATOM 999 N ARG A 560 5.345 -7.749 74.417 1.00 18.48 N ATOM 1000 CA ARG A 560 6.650 -7.706 75.044 1.00 20.52 C ATOM 1001 C ARG A 560 6.662 -6.650 76.150 1.00 19.44 C ATOM 1002 O ARG A 560 7.137 -6.907 77.275 1.00 21.24 O ATOM 1003 CB ARG A 560 7.730 -7.385 73.995 1.00 19.89 C ATOM 1004 CG ARG A 560 9.166 -7.374 74.530 1.00 22.83 C ATOM 1005 CD ARG A 560 10.153 -6.691 73.564 1.00 24.52 C ATOM 1006 NE ARG A 560 10.249 -7.388 72.280 1.00 30.30 N ATOM 1007 CZ ARG A 560 10.081 -6.832 71.077 1.00 30.42 C ATOM 1008 NH1 ARG A 560 10.183 -7.594 69.993 1.00 27.44 N ATOM 1009 NH2 ARG A 560 9.824 -5.534 70.947 1.00 26.29 N ATOM 0 H ARG A 560 5.359 -7.580 73.574 1.00 18.48 H new ATOM 0 HA ARG A 560 6.841 -8.573 75.434 1.00 20.52 H new ATOM 0 HB2 ARG A 560 7.671 -8.037 73.279 1.00 19.89 H new ATOM 0 HB3 ARG A 560 7.537 -6.518 73.606 1.00 19.89 H new ATOM 0 HG2 ARG A 560 9.186 -6.916 75.385 1.00 22.83 H new ATOM 0 HG3 ARG A 560 9.455 -8.286 74.691 1.00 22.83 H new ATOM 0 HD2 ARG A 560 9.872 -5.775 73.412 1.00 24.52 H new ATOM 0 HD3 ARG A 560 11.031 -6.653 73.975 1.00 24.52 H new ATOM 0 HE ARG A 560 10.429 -8.229 72.302 1.00 30.30 H new ATOM 0 HH11 ARG A 560 10.355 -8.433 70.072 1.00 27.44 H new ATOM 0 HH12 ARG A 560 10.077 -7.248 69.213 1.00 27.44 H new ATOM 0 HH21 ARG A 560 9.763 -5.036 71.645 1.00 26.29 H new ATOM 0 HH22 ARG A 560 9.719 -5.193 70.165 1.00 26.29 H new ATOM 1010 N ALA A 561 6.154 -5.464 75.826 1.00 18.81 N ATOM 1011 CA ALA A 561 6.119 -4.343 76.772 1.00 18.63 C ATOM 1012 C ALA A 561 5.222 -4.621 77.968 1.00 19.07 C ATOM 1013 O ALA A 561 5.566 -4.300 79.101 1.00 19.58 O ATOM 1014 CB ALA A 561 5.670 -3.058 76.067 1.00 17.95 C ATOM 0 H ALA A 561 5.820 -5.283 75.054 1.00 18.81 H new ATOM 0 HA ALA A 561 7.022 -4.229 77.107 1.00 18.63 H new ATOM 0 HB1 ALA A 561 5.652 -2.328 76.705 1.00 17.95 H new ATOM 0 HB2 ALA A 561 6.291 -2.847 75.352 1.00 17.95 H new ATOM 0 HB3 ALA A 561 4.782 -3.185 75.697 1.00 17.95 H new ATOM 1015 N VAL A 562 4.066 -5.216 77.698 1.00 20.41 N ATOM 1016 CA VAL A 562 3.066 -5.499 78.727 1.00 21.11 C ATOM 1017 C VAL A 562 3.501 -6.658 79.646 1.00 21.96 C ATOM 1018 O VAL A 562 3.210 -6.634 80.852 1.00 22.63 O ATOM 1019 CB VAL A 562 1.681 -5.768 78.060 1.00 21.67 C ATOM 1020 CG1 VAL A 562 0.664 -6.353 79.061 1.00 23.22 C ATOM 1021 CG2 VAL A 562 1.145 -4.463 77.473 1.00 23.75 C ATOM 0 H VAL A 562 3.836 -5.469 76.909 1.00 20.41 H new ATOM 0 HA VAL A 562 2.982 -4.719 79.298 1.00 21.11 H new ATOM 0 HB VAL A 562 1.806 -6.425 77.357 1.00 21.67 H new ATOM 0 HG11 VAL A 562 -0.182 -6.506 78.611 1.00 23.22 H new ATOM 0 HG12 VAL A 562 1.000 -7.193 79.411 1.00 23.22 H new ATOM 0 HG13 VAL A 562 0.533 -5.728 79.791 1.00 23.22 H new ATOM 0 HG21 VAL A 562 0.284 -4.625 77.057 1.00 23.75 H new ATOM 0 HG22 VAL A 562 1.044 -3.807 78.181 1.00 23.75 H new ATOM 0 HG23 VAL A 562 1.767 -4.127 76.808 1.00 23.75 H new ATOM 1022 N TYR A 563 4.195 -7.650 79.081 1.00 21.86 N ATOM 1023 CA TYR A 563 4.710 -8.797 79.840 1.00 23.86 C ATOM 1024 C TYR A 563 5.765 -8.417 80.874 1.00 24.47 C ATOM 1025 O TYR A 563 5.815 -9.016 81.946 1.00 24.12 O ATOM 1026 CB TYR A 563 5.284 -9.880 78.916 1.00 24.00 C ATOM 1027 CG TYR A 563 5.880 -11.102 79.621 1.00 23.90 C ATOM 1028 CD1 TYR A 563 5.076 -12.168 79.978 1.00 26.34 C ATOM 1029 CD2 TYR A 563 7.251 -11.174 79.921 1.00 24.58 C ATOM 1030 CE1 TYR A 563 5.593 -13.289 80.601 1.00 24.14 C ATOM 1031 CE2 TYR A 563 7.791 -12.301 80.565 1.00 27.10 C ATOM 1032 CZ TYR A 563 6.943 -13.355 80.889 1.00 25.60 C ATOM 1033 OH TYR A 563 7.424 -14.484 81.516 1.00 27.43 O ATOM 0 H TYR A 563 4.382 -7.677 78.242 1.00 21.86 H new ATOM 0 HA TYR A 563 3.940 -9.147 80.315 1.00 23.86 H new ATOM 0 HB2 TYR A 563 4.580 -10.181 78.321 1.00 24.00 H new ATOM 0 HB3 TYR A 563 5.972 -9.479 78.362 1.00 24.00 H new ATOM 0 HD1 TYR A 563 4.165 -12.130 79.795 1.00 26.34 H new ATOM 0 HD2 TYR A 563 7.809 -10.466 79.690 1.00 24.58 H new ATOM 0 HE1 TYR A 563 5.033 -13.997 80.826 1.00 24.14 H new ATOM 0 HE2 TYR A 563 8.697 -12.341 80.770 1.00 27.10 H new ATOM 0 HH TYR A 563 8.247 -14.395 81.661 1.00 27.43 H new ATOM 1034 N LYS A 564 6.614 -7.448 80.544 1.00 24.59 N ATOM 1035 CA LYS A 564 7.622 -6.980 81.477 1.00 25.79 C ATOM 1036 C LYS A 564 6.935 -6.548 82.780 1.00 24.91 C ATOM 1037 O LYS A 564 5.887 -5.880 82.758 1.00 26.45 O ATOM 1038 CB LYS A 564 8.447 -5.840 80.851 1.00 25.66 C ATOM 1039 CG LYS A 564 9.690 -5.471 81.635 1.00 26.33 C ATOM 1040 CD LYS A 564 10.570 -4.491 80.854 1.00 29.50 C ATOM 1041 CE LYS A 564 11.703 -3.958 81.729 1.00 34.15 C ATOM 1042 NZ LYS A 564 12.320 -2.720 81.150 1.00 33.41 N ATOM 0 H LYS A 564 6.620 -7.050 79.782 1.00 24.59 H new ATOM 0 HA LYS A 564 8.243 -7.696 81.682 1.00 25.79 H new ATOM 0 HB2 LYS A 564 8.708 -6.098 79.953 1.00 25.66 H new ATOM 0 HB3 LYS A 564 7.884 -5.055 80.768 1.00 25.66 H new ATOM 0 HG2 LYS A 564 9.434 -5.075 82.483 1.00 26.33 H new ATOM 0 HG3 LYS A 564 10.197 -6.273 81.838 1.00 26.33 H new ATOM 0 HD2 LYS A 564 10.940 -4.934 80.074 1.00 29.50 H new ATOM 0 HD3 LYS A 564 10.030 -3.752 80.532 1.00 29.50 H new ATOM 0 HE2 LYS A 564 11.363 -3.765 82.617 1.00 34.15 H new ATOM 0 HE3 LYS A 564 12.383 -4.642 81.829 1.00 34.15 H new ATOM 0 HZ1 LYS A 564 13.124 -2.593 81.510 1.00 33.41 H new ATOM 0 HZ2 LYS A 564 12.401 -2.813 80.269 1.00 33.41 H new ATOM 0 HZ3 LYS A 564 11.802 -2.019 81.328 1.00 33.41 H new ATOM 1043 N ASP A 565 7.488 -6.991 83.909 1.00 24.45 N ATOM 1044 CA ASP A 565 7.043 -6.534 85.224 1.00 23.93 C ATOM 1045 C ASP A 565 7.668 -5.176 85.507 1.00 23.89 C ATOM 1046 O ASP A 565 8.839 -5.093 85.899 1.00 25.25 O ATOM 1047 CB ASP A 565 7.450 -7.548 86.317 1.00 25.73 C ATOM 1048 CG ASP A 565 7.133 -7.051 87.733 1.00 26.67 C ATOM 1049 OD1 ASP A 565 7.754 -7.551 88.696 1.00 35.42 O ATOM 1050 OD2 ASP A 565 6.279 -6.152 87.881 1.00 29.77 O ATOM 0 H ASP A 565 8.130 -7.563 83.934 1.00 24.45 H new ATOM 0 HA ASP A 565 6.076 -6.459 85.230 1.00 23.93 H new ATOM 0 HB2 ASP A 565 6.989 -8.387 86.162 1.00 25.73 H new ATOM 0 HB3 ASP A 565 8.400 -7.729 86.247 1.00 25.73 H new ATOM 1051 N ALA A 566 6.897 -4.110 85.306 1.00 23.62 N ATOM 1052 CA ALA A 566 7.425 -2.761 85.431 1.00 22.16 C ATOM 1053 C ALA A 566 6.549 -1.909 86.340 1.00 23.16 C ATOM 1054 O ALA A 566 5.427 -2.305 86.706 1.00 22.62 O ATOM 1055 CB ALA A 566 7.562 -2.121 84.035 1.00 22.91 C ATOM 0 H ALA A 566 6.064 -4.150 85.096 1.00 23.62 H new ATOM 0 HA ALA A 566 8.304 -2.809 85.839 1.00 22.16 H new ATOM 0 HB1 ALA A 566 7.914 -1.222 84.124 1.00 22.91 H new ATOM 0 HB2 ALA A 566 8.166 -2.652 83.493 1.00 22.91 H new ATOM 0 HB3 ALA A 566 6.692 -2.086 83.608 1.00 22.91 H new ATOM 1056 N ASP A 567 7.065 -0.743 86.718 1.00 22.17 N ATOM 1057 CA ASP A 567 6.299 0.210 87.502 1.00 21.54 C ATOM 1058 C ASP A 567 5.654 1.287 86.634 1.00 21.96 C ATOM 1059 O ASP A 567 4.661 1.903 87.031 1.00 21.75 O ATOM 1060 CB ASP A 567 7.194 0.838 88.574 1.00 22.74 C ATOM 1061 CG ASP A 567 7.870 -0.209 89.445 1.00 25.17 C ATOM 1062 OD1 ASP A 567 7.150 -1.085 89.977 1.00 26.19 O ATOM 1063 OD2 ASP A 567 9.113 -0.168 89.572 1.00 23.06 O ATOM 0 H ASP A 567 7.863 -0.486 86.527 1.00 22.17 H new ATOM 0 HA ASP A 567 5.575 -0.273 87.931 1.00 21.54 H new ATOM 0 HB2 ASP A 567 7.870 1.387 88.147 1.00 22.74 H new ATOM 0 HB3 ASP A 567 6.662 1.426 89.133 1.00 22.74 H new ATOM 1064 N LEU A 568 6.212 1.491 85.440 1.00 19.48 N ATOM 1065 CA LEU A 568 5.671 2.460 84.511 1.00 19.39 C ATOM 1066 C LEU A 568 5.718 1.909 83.085 1.00 18.73 C ATOM 1067 O LEU A 568 6.776 1.489 82.600 1.00 19.53 O ATOM 1068 CB LEU A 568 6.437 3.786 84.593 1.00 17.90 C ATOM 1069 CG LEU A 568 5.970 4.890 83.640 1.00 18.32 C ATOM 1070 CD1 LEU A 568 4.488 5.208 83.859 1.00 16.39 C ATOM 1071 CD2 LEU A 568 6.831 6.139 83.854 1.00 19.09 C ATOM 0 H LEU A 568 6.907 1.073 85.155 1.00 19.48 H new ATOM 0 HA LEU A 568 4.747 2.629 84.753 1.00 19.39 H new ATOM 0 HB2 LEU A 568 6.375 4.120 85.502 1.00 17.90 H new ATOM 0 HB3 LEU A 568 7.375 3.609 84.420 1.00 17.90 H new ATOM 0 HG LEU A 568 6.072 4.585 82.725 1.00 18.32 H new ATOM 0 HD11 LEU A 568 4.213 5.908 83.247 1.00 16.39 H new ATOM 0 HD12 LEU A 568 3.959 4.411 83.697 1.00 16.39 H new ATOM 0 HD13 LEU A 568 4.352 5.506 84.772 1.00 16.39 H new ATOM 0 HD21 LEU A 568 6.538 6.841 83.252 1.00 19.09 H new ATOM 0 HD22 LEU A 568 6.740 6.442 84.771 1.00 19.09 H new ATOM 0 HD23 LEU A 568 7.760 5.926 83.675 1.00 19.09 H new ATOM 1072 N TYR A 569 4.564 1.917 82.430 1.00 17.60 N ATOM 1073 CA TYR A 569 4.464 1.412 81.059 1.00 17.61 C ATOM 1074 C TYR A 569 4.264 2.565 80.097 1.00 17.71 C ATOM 1075 O TYR A 569 3.307 3.311 80.214 1.00 17.22 O ATOM 1076 CB TYR A 569 3.317 0.413 80.934 1.00 17.77 C ATOM 1077 CG TYR A 569 3.544 -0.864 81.732 1.00 17.33 C ATOM 1078 CD1 TYR A 569 3.283 -0.897 83.108 1.00 18.53 C ATOM 1079 CD2 TYR A 569 4.037 -2.010 81.128 1.00 16.85 C ATOM 1080 CE1 TYR A 569 3.496 -2.046 83.857 1.00 19.20 C ATOM 1081 CE2 TYR A 569 4.259 -3.176 81.865 1.00 18.69 C ATOM 1082 CZ TYR A 569 3.971 -3.176 83.241 1.00 19.80 C ATOM 1083 OH TYR A 569 4.182 -4.306 83.996 1.00 22.94 O ATOM 0 H TYR A 569 3.825 2.210 82.758 1.00 17.60 H new ATOM 0 HA TYR A 569 5.290 0.955 80.837 1.00 17.61 H new ATOM 0 HB2 TYR A 569 2.496 0.833 81.234 1.00 17.77 H new ATOM 0 HB3 TYR A 569 3.194 0.186 79.999 1.00 17.77 H new ATOM 0 HD1 TYR A 569 2.960 -0.133 83.529 1.00 18.53 H new ATOM 0 HD2 TYR A 569 4.223 -2.003 80.217 1.00 16.85 H new ATOM 0 HE1 TYR A 569 3.318 -2.050 84.770 1.00 19.20 H new ATOM 0 HE2 TYR A 569 4.592 -3.940 81.452 1.00 18.69 H new ATOM 0 HH TYR A 569 4.781 -4.774 83.639 1.00 22.94 H new ATOM 1084 N LEU A 570 5.177 2.710 79.148 1.00 16.87 N ATOM 1085 CA LEU A 570 5.119 3.851 78.222 1.00 15.71 C ATOM 1086 C LEU A 570 4.776 3.272 76.881 1.00 15.09 C ATOM 1087 O LEU A 570 5.602 2.642 76.258 1.00 15.08 O ATOM 1088 CB LEU A 570 6.460 4.580 78.193 1.00 17.00 C ATOM 1089 CG LEU A 570 6.876 5.132 79.550 1.00 18.01 C ATOM 1090 CD1 LEU A 570 8.248 5.783 79.476 1.00 19.45 C ATOM 1091 CD2 LEU A 570 5.828 6.115 80.089 1.00 15.84 C ATOM 0 H LEU A 570 5.834 2.170 79.017 1.00 16.87 H new ATOM 0 HA LEU A 570 4.458 4.507 78.493 1.00 15.71 H new ATOM 0 HB2 LEU A 570 7.145 3.971 77.875 1.00 17.00 H new ATOM 0 HB3 LEU A 570 6.411 5.310 77.556 1.00 17.00 H new ATOM 0 HG LEU A 570 6.933 4.388 80.170 1.00 18.01 H new ATOM 0 HD11 LEU A 570 8.491 6.126 80.350 1.00 19.45 H new ATOM 0 HD12 LEU A 570 8.903 5.126 79.194 1.00 19.45 H new ATOM 0 HD13 LEU A 570 8.226 6.513 78.837 1.00 19.45 H new ATOM 0 HD21 LEU A 570 6.114 6.452 80.952 1.00 15.84 H new ATOM 0 HD22 LEU A 570 5.729 6.855 79.470 1.00 15.84 H new ATOM 0 HD23 LEU A 570 4.977 5.660 80.186 1.00 15.84 H new ATOM 1092 N LEU A 571 3.525 3.440 76.474 1.00 15.16 N ATOM 1093 CA LEU A 571 2.997 2.778 75.275 1.00 15.76 C ATOM 1094 C LEU A 571 2.868 3.801 74.147 1.00 16.08 C ATOM 1095 O LEU A 571 1.944 4.616 74.124 1.00 15.80 O ATOM 1096 CB LEU A 571 1.668 2.097 75.598 1.00 15.65 C ATOM 1097 CG LEU A 571 1.717 1.161 76.825 1.00 18.41 C ATOM 1098 CD1 LEU A 571 0.374 0.552 77.072 1.00 19.76 C ATOM 1099 CD2 LEU A 571 2.781 0.035 76.618 1.00 12.04 C ATOM 0 H LEU A 571 2.954 3.939 76.880 1.00 15.16 H new ATOM 0 HA LEU A 571 3.607 2.085 74.977 1.00 15.76 H new ATOM 0 HB2 LEU A 571 0.996 2.779 75.751 1.00 15.65 H new ATOM 0 HB3 LEU A 571 1.382 1.585 74.825 1.00 15.65 H new ATOM 0 HG LEU A 571 1.970 1.690 77.598 1.00 18.41 H new ATOM 0 HD11 LEU A 571 0.421 -0.033 77.845 1.00 19.76 H new ATOM 0 HD12 LEU A 571 -0.275 1.254 77.237 1.00 19.76 H new ATOM 0 HD13 LEU A 571 0.103 0.039 76.295 1.00 19.76 H new ATOM 0 HD21 LEU A 571 2.798 -0.542 77.397 1.00 12.04 H new ATOM 0 HD22 LEU A 571 2.551 -0.488 75.834 1.00 12.04 H new ATOM 0 HD23 LEU A 571 3.656 0.435 76.494 1.00 12.04 H new ATOM 1100 N ASP A 572 3.840 3.790 73.239 1.00 16.43 N ATOM 1101 CA ASP A 572 3.938 4.869 72.255 1.00 18.75 C ATOM 1102 C ASP A 572 3.247 4.472 70.959 1.00 19.02 C ATOM 1103 O ASP A 572 3.860 3.810 70.129 1.00 20.60 O ATOM 1104 CB ASP A 572 5.401 5.203 71.997 1.00 18.27 C ATOM 1105 CG ASP A 572 5.595 6.566 71.351 1.00 20.13 C ATOM 1106 OD1 ASP A 572 4.609 7.171 70.879 1.00 16.23 O ATOM 1107 OD2 ASP A 572 6.762 7.013 71.306 1.00 17.25 O ATOM 0 H ASP A 572 4.443 3.180 73.174 1.00 16.43 H new ATOM 0 HA ASP A 572 3.494 5.656 72.608 1.00 18.75 H new ATOM 0 HB2 ASP A 572 5.886 5.177 72.836 1.00 18.27 H new ATOM 0 HB3 ASP A 572 5.787 4.522 71.425 1.00 18.27 H new ATOM 1108 N SER A 573 1.987 4.882 70.813 1.00 20.42 N ATOM 1109 CA SER A 573 1.119 4.559 69.660 1.00 21.25 C ATOM 1110 C SER A 573 1.218 3.081 69.271 1.00 21.04 C ATOM 1111 O SER A 573 1.528 2.786 68.136 1.00 20.48 O ATOM 1112 CB SER A 573 1.425 5.417 68.408 1.00 22.72 C ATOM 1113 OG SER A 573 1.761 6.755 68.741 1.00 28.47 O ATOM 0 H SER A 573 1.594 5.373 71.399 1.00 20.42 H new ATOM 0 HA SER A 573 0.219 4.763 69.960 1.00 21.25 H new ATOM 0 HB2 SER A 573 2.157 5.015 67.914 1.00 22.72 H new ATOM 0 HB3 SER A 573 0.653 5.416 67.821 1.00 22.72 H new ATOM 0 HG SER A 573 1.663 7.245 68.066 1.00 28.47 H new ATOM 1114 N PRO A 574 0.888 2.163 70.204 1.00 21.82 N ATOM 1115 CA PRO A 574 1.037 0.738 69.926 1.00 22.01 C ATOM 1116 C PRO A 574 -0.001 0.204 68.919 1.00 23.45 C ATOM 1117 O PRO A 574 0.157 -0.918 68.433 1.00 24.48 O ATOM 1118 CB PRO A 574 0.822 0.096 71.302 1.00 22.06 C ATOM 1119 CG PRO A 574 -0.138 1.033 71.998 1.00 22.17 C ATOM 1120 CD PRO A 574 0.293 2.411 71.537 1.00 19.86 C ATOM 0 HA PRO A 574 1.895 0.540 69.519 1.00 22.01 H new ATOM 0 HB2 PRO A 574 0.452 -0.797 71.223 1.00 22.06 H new ATOM 0 HB3 PRO A 574 1.656 0.015 71.790 1.00 22.06 H new ATOM 0 HG2 PRO A 574 -1.057 0.847 71.751 1.00 22.17 H new ATOM 0 HG3 PRO A 574 -0.081 0.947 72.963 1.00 22.17 H new ATOM 0 HD2 PRO A 574 -0.459 3.021 71.484 1.00 19.86 H new ATOM 0 HD3 PRO A 574 0.936 2.806 72.147 1.00 19.86 H new ATOM 1121 N PHE A 575 -1.031 1.002 68.610 1.00 23.43 N ATOM 1122 CA PHE A 575 -2.160 0.551 67.798 1.00 24.69 C ATOM 1123 C PHE A 575 -2.143 1.089 66.359 1.00 27.05 C ATOM 1124 O PHE A 575 -3.063 0.798 65.584 1.00 26.36 O ATOM 1125 CB PHE A 575 -3.506 0.932 68.432 1.00 23.85 C ATOM 1126 CG PHE A 575 -3.662 0.515 69.883 1.00 22.96 C ATOM 1127 CD1 PHE A 575 -3.433 -0.793 70.282 1.00 22.65 C ATOM 1128 CD2 PHE A 575 -4.083 1.437 70.831 1.00 22.11 C ATOM 1129 CE1 PHE A 575 -3.583 -1.170 71.621 1.00 26.51 C ATOM 1130 CE2 PHE A 575 -4.239 1.073 72.170 1.00 23.81 C ATOM 1131 CZ PHE A 575 -3.991 -0.229 72.566 1.00 23.49 C ATOM 0 H PHE A 575 -1.091 1.820 68.868 1.00 23.43 H new ATOM 0 HA PHE A 575 -2.061 -0.413 67.764 1.00 24.69 H new ATOM 0 HB2 PHE A 575 -3.618 1.893 68.370 1.00 23.85 H new ATOM 0 HB3 PHE A 575 -4.220 0.529 67.913 1.00 23.85 H new ATOM 0 HD1 PHE A 575 -3.177 -1.427 69.652 1.00 22.65 H new ATOM 0 HD2 PHE A 575 -4.264 2.311 70.570 1.00 22.11 H new ATOM 0 HE1 PHE A 575 -3.411 -2.046 71.880 1.00 26.51 H new ATOM 0 HE2 PHE A 575 -4.510 1.706 72.795 1.00 23.81 H new ATOM 0 HZ PHE A 575 -4.096 -0.475 73.457 1.00 23.49 H new ATOM 1132 N GLY A 576 -1.101 1.850 66.010 1.00 27.79 N ATOM 1133 CA GLY A 576 -1.064 2.617 64.760 1.00 30.65 C ATOM 1134 C GLY A 576 -1.345 1.809 63.507 1.00 31.15 C ATOM 1135 O GLY A 576 -2.064 2.264 62.593 1.00 31.66 O ATOM 0 H GLY A 576 -0.394 1.936 66.493 1.00 27.79 H new ATOM 0 HA2 GLY A 576 -1.712 3.336 64.818 1.00 30.65 H new ATOM 0 HA3 GLY A 576 -0.190 3.029 64.674 1.00 30.65 H new ATOM 1136 N TYR A 577 -0.823 0.588 63.479 1.00 30.50 N ATOM 1137 CA TYR A 577 -0.916 -0.224 62.272 1.00 30.95 C ATOM 1138 C TYR A 577 -1.971 -1.324 62.374 1.00 29.59 C ATOM 1139 O TYR A 577 -2.007 -2.256 61.560 1.00 31.02 O ATOM 1140 CB TYR A 577 0.479 -0.713 61.854 1.00 31.37 C ATOM 1141 CG TYR A 577 1.309 0.437 61.285 1.00 33.81 C ATOM 1142 CD1 TYR A 577 1.510 0.572 59.907 1.00 33.32 C ATOM 1143 CD2 TYR A 577 1.837 1.428 62.127 1.00 32.60 C ATOM 1144 CE1 TYR A 577 2.245 1.638 59.386 1.00 33.45 C ATOM 1145 CE2 TYR A 577 2.570 2.494 61.620 1.00 33.49 C ATOM 1146 CZ TYR A 577 2.773 2.599 60.251 1.00 33.34 C ATOM 1147 OH TYR A 577 3.510 3.656 59.760 1.00 32.62 O ATOM 0 H TYR A 577 -0.416 0.215 64.138 1.00 30.50 H new ATOM 0 HA TYR A 577 -1.242 0.335 61.549 1.00 30.95 H new ATOM 0 HB2 TYR A 577 0.934 -1.098 62.619 1.00 31.37 H new ATOM 0 HB3 TYR A 577 0.395 -1.416 61.191 1.00 31.37 H new ATOM 0 HD1 TYR A 577 1.148 -0.059 59.328 1.00 33.32 H new ATOM 0 HD2 TYR A 577 1.693 1.370 63.044 1.00 32.60 H new ATOM 0 HE1 TYR A 577 2.382 1.708 58.469 1.00 33.45 H new ATOM 0 HE2 TYR A 577 2.923 3.134 62.195 1.00 33.49 H new ATOM 0 HH TYR A 577 3.563 3.596 58.924 1.00 32.62 H new ATOM 1148 N LEU A 578 -2.841 -1.177 63.368 1.00 27.10 N ATOM 1149 CA LEU A 578 -3.960 -2.071 63.586 1.00 26.98 C ATOM 1150 C LEU A 578 -5.229 -1.501 62.969 1.00 27.41 C ATOM 1151 O LEU A 578 -5.411 -0.285 62.902 1.00 27.84 O ATOM 1152 CB LEU A 578 -4.167 -2.338 65.081 1.00 25.52 C ATOM 1153 CG LEU A 578 -3.040 -3.081 65.832 1.00 28.01 C ATOM 1154 CD1 LEU A 578 -3.410 -3.286 67.288 1.00 24.85 C ATOM 1155 CD2 LEU A 578 -2.707 -4.420 65.189 1.00 27.18 C ATOM 0 H LEU A 578 -2.792 -0.540 63.944 1.00 27.10 H new ATOM 0 HA LEU A 578 -3.757 -2.915 63.153 1.00 26.98 H new ATOM 0 HB2 LEU A 578 -4.309 -1.485 65.521 1.00 25.52 H new ATOM 0 HB3 LEU A 578 -4.984 -2.850 65.184 1.00 25.52 H new ATOM 0 HG LEU A 578 -2.249 -2.522 65.778 1.00 28.01 H new ATOM 0 HD11 LEU A 578 -2.691 -3.753 67.742 1.00 24.85 H new ATOM 0 HD12 LEU A 578 -3.552 -2.424 67.710 1.00 24.85 H new ATOM 0 HD13 LEU A 578 -4.223 -3.812 67.344 1.00 24.85 H new ATOM 0 HD21 LEU A 578 -1.997 -4.852 65.690 1.00 27.18 H new ATOM 0 HD22 LEU A 578 -3.495 -4.986 65.192 1.00 27.18 H new ATOM 0 HD23 LEU A 578 -2.416 -4.277 64.275 1.00 27.18 H new ATOM 1156 N ASP A 579 -6.086 -2.385 62.481 1.00 27.34 N ATOM 1157 CA ASP A 579 -7.406 -1.973 62.017 1.00 27.92 C ATOM 1158 C ASP A 579 -8.232 -1.501 63.224 1.00 27.45 C ATOM 1159 O ASP A 579 -7.904 -1.800 64.384 1.00 24.86 O ATOM 1160 CB ASP A 579 -8.100 -3.116 61.245 1.00 28.77 C ATOM 1161 CG ASP A 579 -8.370 -4.322 62.108 1.00 27.73 C ATOM 1162 OD1 ASP A 579 -9.485 -4.387 62.659 1.00 31.74 O ATOM 1163 OD2 ASP A 579 -7.479 -5.200 62.245 1.00 29.43 O ATOM 0 H ASP A 579 -5.926 -3.227 62.409 1.00 27.34 H new ATOM 0 HA ASP A 579 -7.321 -1.234 61.394 1.00 27.92 H new ATOM 0 HB2 ASP A 579 -8.937 -2.792 60.878 1.00 28.77 H new ATOM 0 HB3 ASP A 579 -7.544 -3.378 60.494 1.00 28.77 H new ATOM 1164 N VAL A 580 -9.292 -0.751 62.953 1.00 28.85 N ATOM 1165 CA VAL A 580 -10.073 -0.123 64.015 1.00 31.07 C ATOM 1166 C VAL A 580 -10.707 -1.080 65.029 1.00 31.74 C ATOM 1167 O VAL A 580 -10.775 -0.765 66.222 1.00 31.36 O ATOM 1168 CB VAL A 580 -11.139 0.882 63.479 1.00 31.53 C ATOM 1169 CG1 VAL A 580 -10.477 2.199 63.111 1.00 34.31 C ATOM 1170 CG2 VAL A 580 -11.910 0.303 62.293 1.00 32.55 C ATOM 0 H VAL A 580 -9.578 -0.592 62.158 1.00 28.85 H new ATOM 0 HA VAL A 580 -9.397 0.370 64.506 1.00 31.07 H new ATOM 0 HB VAL A 580 -11.783 1.046 64.186 1.00 31.53 H new ATOM 0 HG11 VAL A 580 -11.147 2.817 62.779 1.00 34.31 H new ATOM 0 HG12 VAL A 580 -10.050 2.577 63.896 1.00 34.31 H new ATOM 0 HG13 VAL A 580 -9.811 2.045 62.423 1.00 34.31 H new ATOM 0 HG21 VAL A 580 -12.563 0.950 61.984 1.00 32.55 H new ATOM 0 HG22 VAL A 580 -11.292 0.099 61.574 1.00 32.55 H new ATOM 0 HG23 VAL A 580 -12.365 -0.509 62.568 1.00 32.55 H new ATOM 1171 N LEU A 581 -11.166 -2.242 64.562 1.00 32.83 N ATOM 1172 CA LEU A 581 -11.791 -3.211 65.459 1.00 33.14 C ATOM 1173 C LEU A 581 -10.747 -3.815 66.401 1.00 32.35 C ATOM 1174 O LEU A 581 -10.949 -3.815 67.625 1.00 31.55 O ATOM 1175 CB LEU A 581 -12.510 -4.314 64.680 1.00 33.89 C ATOM 1176 CG LEU A 581 -13.388 -5.260 65.521 1.00 34.95 C ATOM 1177 CD1 LEU A 581 -14.541 -4.513 66.208 1.00 38.23 C ATOM 1178 CD2 LEU A 581 -13.936 -6.368 64.637 1.00 35.64 C ATOM 0 H LEU A 581 -11.125 -2.485 63.738 1.00 32.83 H new ATOM 0 HA LEU A 581 -12.456 -2.741 65.986 1.00 33.14 H new ATOM 0 HB2 LEU A 581 -13.067 -3.899 64.003 1.00 33.89 H new ATOM 0 HB3 LEU A 581 -11.845 -4.845 64.214 1.00 33.89 H new ATOM 0 HG LEU A 581 -12.833 -5.641 66.219 1.00 34.95 H new ATOM 0 HD11 LEU A 581 -15.070 -5.140 66.726 1.00 38.23 H new ATOM 0 HD12 LEU A 581 -14.180 -3.831 66.796 1.00 38.23 H new ATOM 0 HD13 LEU A 581 -15.102 -4.096 65.536 1.00 38.23 H new ATOM 0 HD21 LEU A 581 -14.488 -6.963 65.168 1.00 35.64 H new ATOM 0 HD22 LEU A 581 -14.470 -5.981 63.926 1.00 35.64 H new ATOM 0 HD23 LEU A 581 -13.200 -6.869 64.252 1.00 35.64 H new ATOM 1179 N THR A 582 -9.647 -4.320 65.822 1.00 31.37 N ATOM 1180 CA THR A 582 -8.537 -4.914 66.581 1.00 30.80 C ATOM 1181 C THR A 582 -7.982 -3.956 67.626 1.00 30.46 C ATOM 1182 O THR A 582 -7.704 -4.361 68.755 1.00 30.62 O ATOM 1183 CB THR A 582 -7.366 -5.394 65.673 1.00 30.99 C ATOM 1184 OG1 THR A 582 -7.854 -6.292 64.675 1.00 30.37 O ATOM 1185 CG2 THR A 582 -6.293 -6.116 66.501 1.00 29.41 C ATOM 0 H THR A 582 -9.525 -4.327 64.971 1.00 31.37 H new ATOM 0 HA THR A 582 -8.922 -5.688 67.021 1.00 30.80 H new ATOM 0 HB THR A 582 -6.975 -4.611 65.254 1.00 30.99 H new ATOM 0 HG1 THR A 582 -7.655 -6.000 63.913 1.00 30.37 H new ATOM 0 HG21 THR A 582 -5.574 -6.406 65.917 1.00 29.41 H new ATOM 0 HG22 THR A 582 -5.940 -5.511 67.172 1.00 29.41 H new ATOM 0 HG23 THR A 582 -6.686 -6.888 66.938 1.00 29.41 H new ATOM 1186 N GLU A 583 -7.808 -2.695 67.238 1.00 29.78 N ATOM 1187 CA GLU A 583 -7.386 -1.646 68.160 1.00 30.55 C ATOM 1188 C GLU A 583 -8.334 -1.516 69.355 1.00 29.89 C ATOM 1189 O GLU A 583 -7.904 -1.537 70.500 1.00 29.94 O ATOM 1190 CB GLU A 583 -7.311 -0.309 67.417 1.00 29.46 C ATOM 1191 CG GLU A 583 -7.248 0.912 68.325 1.00 29.97 C ATOM 1192 CD GLU A 583 -6.992 2.189 67.547 1.00 33.26 C ATOM 1193 OE1 GLU A 583 -6.170 3.015 68.007 1.00 34.72 O ATOM 1194 OE2 GLU A 583 -7.600 2.357 66.465 1.00 37.21 O ATOM 0 H GLU A 583 -7.932 -2.424 66.431 1.00 29.78 H new ATOM 0 HA GLU A 583 -6.512 -1.889 68.502 1.00 30.55 H new ATOM 0 HB2 GLU A 583 -6.528 -0.313 66.844 1.00 29.46 H new ATOM 0 HB3 GLU A 583 -8.086 -0.229 66.839 1.00 29.46 H new ATOM 0 HG2 GLU A 583 -8.082 0.994 68.813 1.00 29.97 H new ATOM 0 HG3 GLU A 583 -6.545 0.789 68.982 1.00 29.97 H new ATOM 1195 N LYS A 584 -9.628 -1.379 69.075 1.00 30.45 N ATOM 1196 CA LYS A 584 -10.652 -1.239 70.125 1.00 30.52 C ATOM 1197 C LYS A 584 -10.604 -2.388 71.124 1.00 31.11 C ATOM 1198 O LYS A 584 -10.609 -2.155 72.334 1.00 31.35 O ATOM 1199 CB LYS A 584 -12.052 -1.112 69.514 1.00 30.73 C ATOM 1200 CG LYS A 584 -13.209 -1.226 70.520 1.00 32.92 C ATOM 0 H LYS A 584 -9.942 -1.364 68.275 1.00 30.45 H new ATOM 0 HA LYS A 584 -10.453 -0.423 70.610 1.00 30.52 H new ATOM 0 HB2 LYS A 584 -12.117 -0.256 69.062 1.00 30.73 H new ATOM 0 HB3 LYS A 584 -12.159 -1.799 68.838 1.00 30.73 H new ATOM 1201 N GLU A 585 -10.541 -3.616 70.610 1.00 31.72 N ATOM 1202 CA GLU A 585 -10.605 -4.808 71.447 1.00 32.26 C ATOM 1203 C GLU A 585 -9.369 -4.943 72.337 1.00 30.57 C ATOM 1204 O GLU A 585 -9.492 -5.351 73.495 1.00 31.11 O ATOM 1205 CB GLU A 585 -10.806 -6.066 70.588 1.00 33.15 C ATOM 1206 CG GLU A 585 -12.149 -6.126 69.854 1.00 34.51 C ATOM 1207 CD GLU A 585 -12.149 -7.080 68.661 1.00 36.39 C ATOM 1208 OE1 GLU A 585 -13.251 -7.518 68.255 1.00 44.22 O ATOM 1209 OE2 GLU A 585 -11.067 -7.397 68.111 1.00 41.97 O ATOM 0 H GLU A 585 -10.460 -3.779 69.769 1.00 31.72 H new ATOM 0 HA GLU A 585 -11.372 -4.713 72.033 1.00 32.26 H new ATOM 0 HB2 GLU A 585 -10.091 -6.115 69.935 1.00 33.15 H new ATOM 0 HB3 GLU A 585 -10.726 -6.848 71.156 1.00 33.15 H new ATOM 0 HG2 GLU A 585 -12.839 -6.400 70.478 1.00 34.51 H new ATOM 0 HG3 GLU A 585 -12.382 -5.236 69.547 1.00 34.51 H new ATOM 1210 N ILE A 586 -8.194 -4.585 71.802 1.00 28.07 N ATOM 1211 CA ILE A 586 -6.926 -4.655 72.548 1.00 26.07 C ATOM 1212 C ILE A 586 -6.758 -3.504 73.538 1.00 25.48 C ATOM 1213 O ILE A 586 -6.193 -3.687 74.626 1.00 25.31 O ATOM 1214 CB ILE A 586 -5.692 -4.731 71.611 1.00 26.58 C ATOM 1215 CG1 ILE A 586 -5.730 -6.019 70.783 1.00 26.46 C ATOM 1216 CG2 ILE A 586 -4.397 -4.687 72.407 1.00 24.05 C ATOM 1217 CD1 ILE A 586 -4.555 -6.171 69.819 1.00 25.74 C ATOM 0 H ILE A 586 -8.109 -4.295 70.997 1.00 28.07 H new ATOM 0 HA ILE A 586 -6.975 -5.480 73.055 1.00 26.07 H new ATOM 0 HB ILE A 586 -5.724 -3.963 71.020 1.00 26.58 H new ATOM 0 HG12 ILE A 586 -5.743 -6.780 71.385 1.00 26.46 H new ATOM 0 HG13 ILE A 586 -6.557 -6.043 70.277 1.00 26.46 H new ATOM 0 HG21 ILE A 586 -3.642 -4.736 71.800 1.00 24.05 H new ATOM 0 HG22 ILE A 586 -4.354 -3.859 72.910 1.00 24.05 H new ATOM 0 HG23 ILE A 586 -4.368 -5.438 73.020 1.00 24.05 H new ATOM 0 HD11 ILE A 586 -4.643 -7.004 69.330 1.00 25.74 H new ATOM 0 HD12 ILE A 586 -4.551 -5.429 69.194 1.00 25.74 H new ATOM 0 HD13 ILE A 586 -3.724 -6.177 70.320 1.00 25.74 H new ATOM 1218 N PHE A 587 -7.228 -2.323 73.167 1.00 23.50 N ATOM 1219 CA PHE A 587 -7.346 -1.243 74.138 1.00 25.43 C ATOM 1220 C PHE A 587 -8.142 -1.711 75.362 1.00 24.82 C ATOM 1221 O PHE A 587 -7.735 -1.509 76.513 1.00 24.21 O ATOM 1222 CB PHE A 587 -8.013 0.002 73.543 1.00 24.77 C ATOM 1223 CG PHE A 587 -8.140 1.131 74.534 1.00 26.13 C ATOM 1224 CD1 PHE A 587 -9.385 1.523 75.008 1.00 26.57 C ATOM 1225 CD2 PHE A 587 -7.007 1.772 75.024 1.00 28.41 C ATOM 1226 CE1 PHE A 587 -9.507 2.570 75.927 1.00 28.14 C ATOM 1227 CE2 PHE A 587 -7.118 2.821 75.952 1.00 30.64 C ATOM 1228 CZ PHE A 587 -8.368 3.211 76.408 1.00 25.99 C ATOM 0 H PHE A 587 -7.482 -2.126 72.369 1.00 23.50 H new ATOM 0 HA PHE A 587 -6.445 -1.001 74.403 1.00 25.43 H new ATOM 0 HB2 PHE A 587 -7.498 0.305 72.779 1.00 24.77 H new ATOM 0 HB3 PHE A 587 -8.895 -0.235 73.215 1.00 24.77 H new ATOM 0 HD1 PHE A 587 -10.148 1.083 74.710 1.00 26.57 H new ATOM 0 HD2 PHE A 587 -6.165 1.503 74.734 1.00 28.41 H new ATOM 0 HE1 PHE A 587 -10.349 2.838 76.217 1.00 28.14 H new ATOM 0 HE2 PHE A 587 -6.354 3.253 76.260 1.00 30.64 H new ATOM 0 HZ PHE A 587 -8.445 3.897 77.031 1.00 25.99 H new ATOM 1229 N GLU A 588 -9.279 -2.348 75.107 1.00 26.55 N ATOM 1230 CA GLU A 588 -10.109 -2.882 76.179 1.00 25.66 C ATOM 1231 C GLU A 588 -9.410 -3.991 76.961 1.00 25.54 C ATOM 1232 O GLU A 588 -9.186 -3.842 78.151 1.00 25.85 O ATOM 1233 CB GLU A 588 -11.449 -3.372 75.619 1.00 27.75 C ATOM 0 H GLU A 588 -9.589 -2.482 74.316 1.00 26.55 H new ATOM 0 HA GLU A 588 -10.272 -2.159 76.805 1.00 25.66 H new ATOM 1234 N SER A 589 -9.056 -5.091 76.301 1.00 25.62 N ATOM 1235 CA SER A 589 -8.571 -6.273 77.013 1.00 26.13 C ATOM 1236 C SER A 589 -7.203 -6.055 77.674 1.00 25.71 C ATOM 1237 O SER A 589 -6.960 -6.536 78.769 1.00 25.40 O ATOM 1238 CB SER A 589 -8.562 -7.513 76.100 1.00 26.82 C ATOM 1239 OG SER A 589 -7.792 -7.307 74.906 1.00 28.87 O ATOM 0 H SER A 589 -9.088 -5.174 75.446 1.00 25.62 H new ATOM 0 HA SER A 589 -9.199 -6.434 77.734 1.00 26.13 H new ATOM 0 HB2 SER A 589 -8.200 -8.269 76.589 1.00 26.82 H new ATOM 0 HB3 SER A 589 -9.474 -7.741 75.859 1.00 26.82 H new ATOM 0 HG SER A 589 -7.025 -7.635 75.007 1.00 28.87 H new ATOM 1240 N CYS A 590 -6.330 -5.306 77.008 1.00 25.95 N ATOM 1241 CA CYS A 590 -4.948 -5.119 77.455 1.00 25.85 C ATOM 1242 C CYS A 590 -4.781 -3.861 78.305 1.00 26.18 C ATOM 1243 O CYS A 590 -4.496 -3.953 79.487 1.00 27.13 O ATOM 1244 CB CYS A 590 -4.022 -5.034 76.246 1.00 25.18 C ATOM 1245 SG CYS A 590 -2.294 -5.050 76.666 1.00 27.47 S ATOM 0 H CYS A 590 -6.521 -4.889 76.281 1.00 25.95 H new ATOM 0 HA CYS A 590 -4.717 -5.883 78.006 1.00 25.85 H new ATOM 0 HB2 CYS A 590 -4.209 -5.778 75.652 1.00 25.18 H new ATOM 0 HB3 CYS A 590 -4.220 -4.222 75.754 1.00 25.18 H new ATOM 0 HG CYS A 590 -1.718 -5.835 75.964 1.00 27.47 H new ATOM 1246 N VAL A 591 -4.959 -2.688 77.703 1.00 25.33 N ATOM 1247 CA VAL A 591 -4.685 -1.421 78.399 1.00 25.50 C ATOM 1248 C VAL A 591 -5.644 -1.221 79.579 1.00 26.69 C ATOM 1249 O VAL A 591 -5.229 -0.845 80.677 1.00 26.66 O ATOM 1250 CB VAL A 591 -4.678 -0.209 77.398 1.00 25.74 C ATOM 1251 CG1 VAL A 591 -4.599 1.142 78.115 1.00 23.40 C ATOM 1252 CG2 VAL A 591 -3.499 -0.331 76.435 1.00 24.14 C ATOM 0 H VAL A 591 -5.237 -2.598 76.894 1.00 25.33 H new ATOM 0 HA VAL A 591 -3.792 -1.466 78.776 1.00 25.50 H new ATOM 0 HB VAL A 591 -5.517 -0.241 76.912 1.00 25.74 H new ATOM 0 HG11 VAL A 591 -4.597 1.857 77.459 1.00 23.40 H new ATOM 0 HG12 VAL A 591 -5.365 1.243 78.701 1.00 23.40 H new ATOM 0 HG13 VAL A 591 -3.784 1.183 78.639 1.00 23.40 H new ATOM 0 HG21 VAL A 591 -3.503 0.420 75.822 1.00 24.14 H new ATOM 0 HG22 VAL A 591 -2.669 -0.333 76.938 1.00 24.14 H new ATOM 0 HG23 VAL A 591 -3.575 -1.158 75.933 1.00 24.14 H new ATOM 1253 N CYS A 592 -6.916 -1.537 79.360 1.00 27.69 N ATOM 1254 CA CYS A 592 -7.960 -1.257 80.349 1.00 30.34 C ATOM 1255 C CYS A 592 -8.196 -2.364 81.357 1.00 30.67 C ATOM 1256 O CYS A 592 -8.477 -2.085 82.514 1.00 33.08 O ATOM 1257 CB CYS A 592 -9.272 -0.908 79.649 1.00 29.63 C ATOM 1258 SG CYS A 592 -9.194 0.661 78.793 1.00 34.26 S ATOM 0 H CYS A 592 -7.200 -1.916 78.642 1.00 27.69 H new ATOM 0 HA CYS A 592 -7.631 -0.501 80.860 1.00 30.34 H new ATOM 0 HB2 CYS A 592 -9.494 -1.608 79.015 1.00 29.63 H new ATOM 0 HB3 CYS A 592 -9.987 -0.881 80.304 1.00 29.63 H new ATOM 0 HG CYS A 592 -9.534 0.512 77.652 1.00 34.26 H new ATOM 1259 N LYS A 593 -8.082 -3.615 80.921 1.00 30.75 N ATOM 1260 CA LYS A 593 -8.387 -4.752 81.769 1.00 30.48 C ATOM 1261 C LYS A 593 -7.154 -5.438 82.358 1.00 29.95 C ATOM 1262 O LYS A 593 -6.984 -5.448 83.571 1.00 30.05 O ATOM 1263 CB LYS A 593 -9.274 -5.740 81.020 1.00 31.89 C ATOM 1264 CG LYS A 593 -10.740 -5.412 81.149 1.00 36.65 C ATOM 1265 CD LYS A 593 -11.604 -6.231 80.202 1.00 44.17 C ATOM 1266 CE LYS A 593 -13.057 -5.778 80.312 1.00 44.76 C ATOM 1267 NZ LYS A 593 -13.738 -5.772 78.988 1.00 50.09 N ATOM 0 H LYS A 593 -7.826 -3.824 80.127 1.00 30.75 H new ATOM 0 HA LYS A 593 -8.870 -4.405 82.535 1.00 30.48 H new ATOM 0 HB2 LYS A 593 -9.028 -5.744 80.082 1.00 31.89 H new ATOM 0 HB3 LYS A 593 -9.115 -6.635 81.359 1.00 31.89 H new ATOM 0 HG2 LYS A 593 -11.025 -5.571 82.062 1.00 36.65 H new ATOM 0 HG3 LYS A 593 -10.874 -4.468 80.971 1.00 36.65 H new ATOM 0 HD2 LYS A 593 -11.291 -6.125 79.290 1.00 44.17 H new ATOM 0 HD3 LYS A 593 -11.532 -7.174 80.418 1.00 44.17 H new ATOM 0 HE2 LYS A 593 -13.534 -6.366 80.918 1.00 44.76 H new ATOM 0 HE3 LYS A 593 -13.090 -4.888 80.696 1.00 44.76 H new ATOM 0 HZ1 LYS A 593 -14.581 -5.504 79.089 1.00 50.09 H new ATOM 0 HZ2 LYS A 593 -13.314 -5.216 78.438 1.00 50.09 H new ATOM 0 HZ3 LYS A 593 -13.727 -6.593 78.645 1.00 50.09 H new ATOM 1268 N LEU A 594 -6.292 -6.005 81.520 1.00 28.14 N ATOM 1269 CA LEU A 594 -5.087 -6.651 82.034 1.00 28.33 C ATOM 1270 C LEU A 594 -4.195 -5.693 82.837 1.00 28.73 C ATOM 1271 O LEU A 594 -3.624 -6.081 83.856 1.00 27.81 O ATOM 1272 CB LEU A 594 -4.278 -7.315 80.916 1.00 27.50 C ATOM 1273 CG LEU A 594 -3.193 -8.299 81.362 1.00 29.19 C ATOM 1274 CD1 LEU A 594 -3.806 -9.626 81.842 1.00 29.82 C ATOM 1275 CD2 LEU A 594 -2.194 -8.548 80.240 1.00 27.47 C ATOM 0 H LEU A 594 -6.382 -6.028 80.665 1.00 28.14 H new ATOM 0 HA LEU A 594 -5.396 -7.340 82.643 1.00 28.33 H new ATOM 0 HB2 LEU A 594 -4.894 -7.784 80.331 1.00 27.50 H new ATOM 0 HB3 LEU A 594 -3.859 -6.618 80.387 1.00 27.50 H new ATOM 0 HG LEU A 594 -2.722 -7.899 82.110 1.00 29.19 H new ATOM 0 HD11 LEU A 594 -3.098 -10.229 82.118 1.00 29.82 H new ATOM 0 HD12 LEU A 594 -4.397 -9.457 82.593 1.00 29.82 H new ATOM 0 HD13 LEU A 594 -4.310 -10.030 81.119 1.00 29.82 H new ATOM 0 HD21 LEU A 594 -1.516 -9.173 80.542 1.00 27.47 H new ATOM 0 HD22 LEU A 594 -2.656 -8.919 79.472 1.00 27.47 H new ATOM 0 HD23 LEU A 594 -1.773 -7.711 79.990 1.00 27.47 H new ATOM 1276 N MET A 595 -4.093 -4.448 82.375 1.00 27.87 N ATOM 1277 CA MET A 595 -3.190 -3.476 82.966 1.00 27.17 C ATOM 1278 C MET A 595 -3.888 -2.468 83.887 1.00 27.37 C ATOM 1279 O MET A 595 -3.336 -1.394 84.158 1.00 26.84 O ATOM 1280 CB MET A 595 -2.464 -2.713 81.857 1.00 26.41 C ATOM 1281 CG MET A 595 -1.663 -3.574 80.900 1.00 26.81 C ATOM 1282 SD MET A 595 -0.910 -2.543 79.618 1.00 24.65 S ATOM 1283 CE MET A 595 0.548 -1.974 80.504 1.00 25.19 C ATOM 0 H MET A 595 -4.547 -4.147 81.710 1.00 27.87 H new ATOM 0 HA MET A 595 -2.568 -3.979 83.515 1.00 27.17 H new ATOM 0 HB2 MET A 595 -3.119 -2.211 81.347 1.00 26.41 H new ATOM 0 HB3 MET A 595 -1.867 -2.067 82.266 1.00 26.41 H new ATOM 0 HG2 MET A 595 -0.974 -4.054 81.385 1.00 26.81 H new ATOM 0 HG3 MET A 595 -2.239 -4.240 80.493 1.00 26.81 H new ATOM 0 HE1 MET A 595 1.078 -1.405 79.924 1.00 25.19 H new ATOM 0 HE2 MET A 595 0.275 -1.471 81.288 1.00 25.19 H new ATOM 0 HE3 MET A 595 1.078 -2.738 80.779 1.00 25.19 H new ATOM 1284 N ALA A 596 -5.074 -2.821 84.379 1.00 28.28 N ATOM 1285 CA ALA A 596 -5.909 -1.914 85.190 1.00 29.07 C ATOM 1286 C ALA A 596 -5.192 -1.268 86.381 1.00 29.28 C ATOM 1287 O ALA A 596 -5.459 -0.115 86.711 1.00 31.29 O ATOM 1288 CB ALA A 596 -7.199 -2.630 85.662 1.00 29.02 C ATOM 0 H ALA A 596 -5.424 -3.596 84.255 1.00 28.28 H new ATOM 0 HA ALA A 596 -6.133 -1.181 84.595 1.00 29.07 H new ATOM 0 HB1 ALA A 596 -7.733 -2.018 86.192 1.00 29.02 H new ATOM 0 HB2 ALA A 596 -7.710 -2.919 84.890 1.00 29.02 H new ATOM 0 HB3 ALA A 596 -6.963 -3.402 86.200 1.00 29.02 H new ATOM 1289 N ASN A 597 -4.283 -1.991 87.018 1.00 29.25 N ATOM 1290 CA ASN A 597 -3.651 -1.452 88.226 1.00 30.64 C ATOM 1291 C ASN A 597 -2.254 -0.908 87.973 1.00 29.46 C ATOM 1292 O ASN A 597 -1.525 -0.591 88.912 1.00 30.20 O ATOM 1293 CB ASN A 597 -3.619 -2.505 89.348 1.00 31.07 C ATOM 1294 CG ASN A 597 -4.959 -2.643 90.080 1.00 36.81 C ATOM 1295 OD1 ASN A 597 -5.876 -1.701 89.841 1.00 41.03 O flip ATOM 1296 ND2 ASN A 597 -5.166 -3.602 90.845 1.00 39.74 N flip ATOM 0 H ASN A 597 -4.020 -2.775 86.781 1.00 29.25 H new ATOM 0 HA ASN A 597 -4.200 -0.703 88.508 1.00 30.64 H new ATOM 0 HB2 ASN A 597 -3.372 -3.364 88.971 1.00 31.07 H new ATOM 0 HB3 ASN A 597 -2.930 -2.267 89.988 1.00 31.07 H new ATOM 0 HD21 ASN A 597 -4.551 -4.189 90.974 1.00 39.74 H new ATOM 0 HD22 ASN A 597 -5.924 -3.678 91.244 1.00 39.74 H new ATOM 1297 N LYS A 598 -1.900 -0.791 86.696 1.00 28.44 N ATOM 1298 CA LYS A 598 -0.544 -0.438 86.285 1.00 26.27 C ATOM 1299 C LYS A 598 -0.508 1.037 85.906 1.00 23.95 C ATOM 1300 O LYS A 598 -1.467 1.572 85.356 1.00 25.17 O ATOM 1301 CB LYS A 598 -0.101 -1.336 85.125 1.00 27.44 C ATOM 1302 CG LYS A 598 0.032 -2.854 85.484 1.00 30.13 C ATOM 1303 CD LYS A 598 1.220 -3.129 86.457 1.00 31.17 C ATOM 1304 CE LYS A 598 1.727 -4.575 86.390 1.00 35.36 C ATOM 1305 NZ LYS A 598 3.162 -4.705 86.920 1.00 37.97 N ATOM 0 H LYS A 598 -2.443 -0.915 86.040 1.00 28.44 H new ATOM 0 HA LYS A 598 0.078 -0.580 87.016 1.00 26.27 H new ATOM 0 HB2 LYS A 598 -0.738 -1.243 84.399 1.00 27.44 H new ATOM 0 HB3 LYS A 598 0.754 -1.018 84.795 1.00 27.44 H new ATOM 0 HG2 LYS A 598 -0.794 -3.162 85.889 1.00 30.13 H new ATOM 0 HG3 LYS A 598 0.157 -3.367 84.670 1.00 30.13 H new ATOM 0 HD2 LYS A 598 1.950 -2.526 86.247 1.00 31.17 H new ATOM 0 HD3 LYS A 598 0.941 -2.931 87.365 1.00 31.17 H new ATOM 0 HE2 LYS A 598 1.139 -5.148 86.907 1.00 35.36 H new ATOM 0 HE3 LYS A 598 1.692 -4.887 85.472 1.00 35.36 H new ATOM 0 HZ1 LYS A 598 3.268 -5.503 87.299 1.00 37.97 H new ATOM 0 HZ2 LYS A 598 3.737 -4.619 86.246 1.00 37.97 H new ATOM 0 HZ3 LYS A 598 3.315 -4.068 87.523 1.00 37.97 H new ATOM 1306 N THR A 599 0.580 1.708 86.243 1.00 21.40 N ATOM 1307 CA THR A 599 0.753 3.102 85.844 1.00 19.94 C ATOM 1308 C THR A 599 1.152 3.079 84.353 1.00 19.62 C ATOM 1309 O THR A 599 2.166 2.462 83.979 1.00 18.12 O ATOM 1310 CB THR A 599 1.797 3.763 86.720 1.00 19.83 C ATOM 1311 OG1 THR A 599 1.431 3.541 88.090 1.00 19.66 O ATOM 1312 CG2 THR A 599 1.897 5.284 86.457 1.00 19.28 C ATOM 0 H THR A 599 1.230 1.380 86.701 1.00 21.40 H new ATOM 0 HA THR A 599 -0.058 3.623 85.956 1.00 19.94 H new ATOM 0 HB THR A 599 2.663 3.377 86.517 1.00 19.83 H new ATOM 0 HG1 THR A 599 2.105 3.646 88.581 1.00 19.66 H new ATOM 0 HG21 THR A 599 2.574 5.669 87.035 1.00 19.28 H new ATOM 0 HG22 THR A 599 2.139 5.437 85.530 1.00 19.28 H new ATOM 0 HG23 THR A 599 1.041 5.701 86.640 1.00 19.28 H new ATOM 1313 N ARG A 600 0.310 3.696 83.529 1.00 19.30 N ATOM 1314 CA ARG A 600 0.401 3.603 82.064 1.00 20.33 C ATOM 1315 C ARG A 600 0.354 4.990 81.466 1.00 20.60 C ATOM 1316 O ARG A 600 -0.472 5.807 81.857 1.00 20.36 O ATOM 1317 CB ARG A 600 -0.810 2.877 81.483 1.00 20.30 C ATOM 1318 CG ARG A 600 -0.878 1.379 81.664 1.00 24.13 C ATOM 1319 CD ARG A 600 -2.360 1.006 81.725 1.00 24.56 C ATOM 1320 NE ARG A 600 -2.869 1.493 82.997 1.00 28.90 N ATOM 1321 CZ ARG A 600 -4.141 1.624 83.333 1.00 28.20 C ATOM 1322 NH1 ARG A 600 -4.424 2.104 84.531 1.00 29.20 N ATOM 1323 NH2 ARG A 600 -5.109 1.313 82.491 1.00 25.65 N ATOM 0 H ARG A 600 -0.340 4.188 83.803 1.00 19.30 H new ATOM 0 HA ARG A 600 1.225 3.133 81.860 1.00 20.33 H new ATOM 0 HB2 ARG A 600 -1.608 3.263 81.877 1.00 20.30 H new ATOM 0 HB3 ARG A 600 -0.844 3.065 80.532 1.00 20.30 H new ATOM 0 HG2 ARG A 600 -0.439 0.924 80.929 1.00 24.13 H new ATOM 0 HG3 ARG A 600 -0.422 1.110 82.477 1.00 24.13 H new ATOM 0 HD2 ARG A 600 -2.845 1.405 80.986 1.00 24.56 H new ATOM 0 HD3 ARG A 600 -2.475 0.045 81.654 1.00 24.56 H new ATOM 0 HE ARG A 600 -2.286 1.718 83.588 1.00 28.90 H new ATOM 0 HH11 ARG A 600 -3.789 2.322 85.068 1.00 29.20 H new ATOM 0 HH12 ARG A 600 -5.244 2.199 84.774 1.00 29.20 H new ATOM 0 HH21 ARG A 600 -4.918 1.018 81.706 1.00 25.65 H new ATOM 0 HH22 ARG A 600 -5.931 1.405 82.728 1.00 25.65 H new ATOM 1324 N ILE A 601 1.210 5.235 80.478 1.00 19.90 N ATOM 1325 CA ILE A 601 1.073 6.414 79.651 1.00 19.00 C ATOM 1326 C ILE A 601 0.890 5.903 78.225 1.00 20.02 C ATOM 1327 O ILE A 601 1.738 5.182 77.691 1.00 20.00 O ATOM 1328 CB ILE A 601 2.295 7.381 79.737 1.00 18.94 C ATOM 1329 CG1 ILE A 601 2.501 7.885 81.180 1.00 18.71 C ATOM 1330 CG2 ILE A 601 2.092 8.532 78.766 1.00 18.63 C ATOM 1331 CD1 ILE A 601 3.788 8.729 81.427 1.00 19.10 C ATOM 0 H ILE A 601 1.874 4.728 80.275 1.00 19.90 H new ATOM 0 HA ILE A 601 0.319 6.942 79.957 1.00 19.00 H new ATOM 0 HB ILE A 601 3.101 6.903 79.488 1.00 18.94 H new ATOM 0 HG12 ILE A 601 1.731 8.419 81.431 1.00 18.71 H new ATOM 0 HG13 ILE A 601 2.519 7.118 81.773 1.00 18.71 H new ATOM 0 HG21 ILE A 601 2.850 9.136 78.816 1.00 18.63 H new ATOM 0 HG22 ILE A 601 2.015 8.185 77.864 1.00 18.63 H new ATOM 0 HG23 ILE A 601 1.281 9.012 78.997 1.00 18.63 H new ATOM 0 HD11 ILE A 601 3.826 8.997 82.359 1.00 19.10 H new ATOM 0 HD12 ILE A 601 4.570 8.197 81.212 1.00 19.10 H new ATOM 0 HD13 ILE A 601 3.770 9.519 80.864 1.00 19.10 H new ATOM 1332 N LEU A 602 -0.256 6.227 77.648 1.00 18.81 N ATOM 1333 CA LEU A 602 -0.590 5.773 76.311 1.00 19.63 C ATOM 1334 C LEU A 602 -0.621 6.978 75.398 1.00 19.24 C ATOM 1335 O LEU A 602 -1.337 7.944 75.664 1.00 19.38 O ATOM 1336 CB LEU A 602 -1.938 5.050 76.297 1.00 17.78 C ATOM 1337 CG LEU A 602 -2.505 4.612 74.938 1.00 17.64 C ATOM 1338 CD1 LEU A 602 -1.659 3.491 74.307 1.00 16.20 C ATOM 1339 CD2 LEU A 602 -3.936 4.185 75.158 1.00 18.23 C ATOM 0 H LEU A 602 -0.860 6.714 78.019 1.00 18.81 H new ATOM 0 HA LEU A 602 0.078 5.140 76.004 1.00 19.63 H new ATOM 0 HB2 LEU A 602 -1.858 4.260 76.854 1.00 17.78 H new ATOM 0 HB3 LEU A 602 -2.591 5.630 76.719 1.00 17.78 H new ATOM 0 HG LEU A 602 -2.475 5.349 74.308 1.00 17.64 H new ATOM 0 HD11 LEU A 602 -2.042 3.238 73.453 1.00 16.20 H new ATOM 0 HD12 LEU A 602 -0.752 3.807 74.173 1.00 16.20 H new ATOM 0 HD13 LEU A 602 -1.649 2.721 74.897 1.00 16.20 H new ATOM 0 HD21 LEU A 602 -4.323 3.902 74.315 1.00 18.23 H new ATOM 0 HD22 LEU A 602 -3.961 3.448 75.788 1.00 18.23 H new ATOM 0 HD23 LEU A 602 -4.445 4.930 75.513 1.00 18.23 H new ATOM 1340 N VAL A 603 0.195 6.928 74.348 1.00 19.78 N ATOM 1341 CA VAL A 603 0.181 7.949 73.299 1.00 20.29 C ATOM 1342 C VAL A 603 -0.827 7.454 72.267 1.00 21.99 C ATOM 1343 O VAL A 603 -0.627 6.388 71.684 1.00 21.38 O ATOM 1344 CB VAL A 603 1.581 8.138 72.648 1.00 19.33 C ATOM 1345 CG1 VAL A 603 1.487 9.089 71.430 1.00 18.52 C ATOM 1346 CG2 VAL A 603 2.598 8.688 73.643 1.00 19.99 C ATOM 0 H VAL A 603 0.772 6.303 74.222 1.00 19.78 H new ATOM 0 HA VAL A 603 -0.058 8.816 73.663 1.00 20.29 H new ATOM 0 HB VAL A 603 1.882 7.263 72.357 1.00 19.33 H new ATOM 0 HG11 VAL A 603 2.366 9.197 71.035 1.00 18.52 H new ATOM 0 HG12 VAL A 603 0.881 8.713 70.772 1.00 18.52 H new ATOM 0 HG13 VAL A 603 1.154 9.953 71.719 1.00 18.52 H new ATOM 0 HG21 VAL A 603 3.457 8.793 73.204 1.00 19.99 H new ATOM 0 HG22 VAL A 603 2.296 9.549 73.972 1.00 19.99 H new ATOM 0 HG23 VAL A 603 2.689 8.072 74.387 1.00 19.99 H new ATOM 1347 N THR A 604 -1.923 8.188 72.076 1.00 24.08 N ATOM 1348 CA THR A 604 -3.039 7.675 71.296 1.00 28.07 C ATOM 1349 C THR A 604 -3.780 8.704 70.437 1.00 30.96 C ATOM 1350 O THR A 604 -3.895 9.873 70.787 1.00 29.75 O ATOM 1351 CB THR A 604 -4.076 6.895 72.173 1.00 28.27 C ATOM 1352 OG1 THR A 604 -5.172 6.486 71.344 1.00 32.42 O ATOM 1353 CG2 THR A 604 -4.612 7.745 73.339 1.00 26.93 C ATOM 0 H THR A 604 -2.037 8.981 72.389 1.00 24.08 H new ATOM 0 HA THR A 604 -2.602 7.068 70.679 1.00 28.07 H new ATOM 0 HB THR A 604 -3.624 6.127 72.555 1.00 28.27 H new ATOM 0 HG1 THR A 604 -5.641 5.924 71.756 1.00 32.42 H new ATOM 0 HG21 THR A 604 -5.249 7.224 73.853 1.00 26.93 H new ATOM 0 HG22 THR A 604 -3.875 8.011 73.911 1.00 26.93 H new ATOM 0 HG23 THR A 604 -5.050 8.536 72.988 1.00 26.93 H new ATOM 1354 N SER A 605 -4.323 8.214 69.322 1.00 34.73 N ATOM 1355 CA SER A 605 -4.995 9.048 68.343 1.00 36.96 C ATOM 1356 C SER A 605 -6.529 9.094 68.505 1.00 38.63 C ATOM 1357 O SER A 605 -7.215 9.696 67.663 1.00 40.38 O ATOM 1358 CB SER A 605 -4.626 8.538 66.946 1.00 37.74 C ATOM 0 H SER A 605 -4.308 7.379 69.116 1.00 34.73 H new ATOM 0 HA SER A 605 -4.694 9.960 68.480 1.00 36.96 H new ATOM 1359 N LYS A 606 -7.070 8.485 69.568 1.00 37.78 N ATOM 1360 CA LYS A 606 -8.520 8.193 69.634 1.00 37.27 C ATOM 1361 C LYS A 606 -9.297 8.809 70.804 1.00 35.61 C ATOM 1362 O LYS A 606 -8.920 8.648 71.966 1.00 34.25 O ATOM 1363 CB LYS A 606 -8.755 6.678 69.612 1.00 37.95 C ATOM 1364 CG LYS A 606 -8.166 5.956 68.397 1.00 40.74 C ATOM 1365 CD LYS A 606 -9.035 6.133 67.149 1.00 41.13 C ATOM 1366 CE LYS A 606 -8.444 5.423 65.916 1.00 42.37 C ATOM 1367 NZ LYS A 606 -6.971 5.631 65.734 1.00 44.07 N ATOM 0 H LYS A 606 -6.623 8.233 70.258 1.00 37.78 H new ATOM 0 HA LYS A 606 -8.878 8.629 68.845 1.00 37.27 H new ATOM 0 HB2 LYS A 606 -8.375 6.293 70.417 1.00 37.95 H new ATOM 0 HB3 LYS A 606 -9.710 6.511 69.640 1.00 37.95 H new ATOM 0 HG2 LYS A 606 -7.275 6.296 68.221 1.00 40.74 H new ATOM 0 HG3 LYS A 606 -8.075 5.011 68.596 1.00 40.74 H new ATOM 0 HD2 LYS A 606 -9.923 5.785 67.325 1.00 41.13 H new ATOM 0 HD3 LYS A 606 -9.133 7.079 66.958 1.00 41.13 H new ATOM 0 HE2 LYS A 606 -8.620 4.472 65.988 1.00 42.37 H new ATOM 0 HE3 LYS A 606 -8.905 5.737 65.123 1.00 42.37 H new ATOM 0 HZ1 LYS A 606 -6.718 5.295 64.949 1.00 44.07 H new ATOM 0 HZ2 LYS A 606 -6.789 6.502 65.756 1.00 44.07 H new ATOM 0 HZ3 LYS A 606 -6.530 5.219 66.388 1.00 44.07 H new ATOM 1368 N MET A 607 -10.404 9.487 70.486 1.00 34.16 N ATOM 1369 CA MET A 607 -11.267 10.088 71.500 1.00 33.80 C ATOM 1370 C MET A 607 -11.806 9.042 72.474 1.00 33.19 C ATOM 1371 O MET A 607 -11.915 9.298 73.672 1.00 32.09 O ATOM 1372 CB MET A 607 -12.439 10.845 70.859 1.00 34.98 C ATOM 1373 CG MET A 607 -13.101 11.831 71.799 1.00 36.32 C ATOM 1374 SD MET A 607 -12.024 13.202 72.270 1.00 43.20 S ATOM 1375 CE MET A 607 -12.207 14.297 70.870 1.00 42.49 C ATOM 0 H MET A 607 -10.672 9.609 69.678 1.00 34.16 H new ATOM 0 HA MET A 607 -10.719 10.717 71.994 1.00 33.80 H new ATOM 0 HB2 MET A 607 -12.120 11.319 70.075 1.00 34.98 H new ATOM 0 HB3 MET A 607 -13.101 10.205 70.553 1.00 34.98 H new ATOM 0 HG2 MET A 607 -13.899 12.185 71.376 1.00 36.32 H new ATOM 0 HG3 MET A 607 -13.387 11.363 72.599 1.00 36.32 H new ATOM 0 HE1 MET A 607 -11.428 14.871 70.804 1.00 42.49 H new ATOM 0 HE2 MET A 607 -12.292 13.773 70.058 1.00 42.49 H new ATOM 0 HE3 MET A 607 -13.001 14.842 70.987 1.00 42.49 H new ATOM 1376 N GLU A 608 -12.139 7.866 71.943 1.00 32.65 N ATOM 1377 CA GLU A 608 -12.593 6.743 72.760 1.00 31.76 C ATOM 1378 C GLU A 608 -11.601 6.418 73.874 1.00 30.98 C ATOM 1379 O GLU A 608 -12.016 6.108 75.000 1.00 31.20 O ATOM 1380 CB GLU A 608 -12.862 5.507 71.887 1.00 31.64 C ATOM 0 H GLU A 608 -12.108 7.698 71.100 1.00 32.65 H new ATOM 0 HA GLU A 608 -13.426 7.006 73.182 1.00 31.76 H new ATOM 1381 N HIS A 609 -10.303 6.514 73.575 1.00 29.31 N ATOM 1382 CA HIS A 609 -9.256 6.231 74.574 1.00 28.70 C ATOM 1383 C HIS A 609 -9.089 7.367 75.586 1.00 28.95 C ATOM 1384 O HIS A 609 -8.676 7.134 76.728 1.00 28.53 O ATOM 1385 CB HIS A 609 -7.896 5.933 73.928 1.00 27.87 C ATOM 1386 CG HIS A 609 -7.923 4.855 72.887 1.00 28.15 C ATOM 1387 ND1 HIS A 609 -6.888 4.664 71.995 1.00 24.59 N ATOM 1388 CD2 HIS A 609 -8.856 3.922 72.586 1.00 27.85 C ATOM 1389 CE1 HIS A 609 -7.183 3.657 71.193 1.00 27.65 C ATOM 1390 NE2 HIS A 609 -8.373 3.192 71.528 1.00 29.44 N ATOM 0 H HIS A 609 -10.004 6.741 72.801 1.00 29.31 H new ATOM 0 HA HIS A 609 -9.561 5.438 75.042 1.00 28.70 H new ATOM 0 HB2 HIS A 609 -7.557 6.748 73.525 1.00 27.87 H new ATOM 0 HB3 HIS A 609 -7.269 5.679 74.624 1.00 27.87 H new ATOM 0 HD2 HIS A 609 -9.672 3.798 73.015 1.00 27.85 H new ATOM 0 HE1 HIS A 609 -6.644 3.331 70.509 1.00 27.65 H new ATOM 0 HE2 HIS A 609 -8.780 2.538 71.145 1.00 29.44 H new ATOM 1391 N LEU A 610 -9.385 8.594 75.153 1.00 28.49 N ATOM 1392 CA LEU A 610 -9.356 9.759 76.045 1.00 29.36 C ATOM 1393 C LEU A 610 -10.464 9.671 77.100 1.00 29.44 C ATOM 1394 O LEU A 610 -10.222 9.989 78.254 1.00 28.41 O ATOM 1395 CB LEU A 610 -9.462 11.077 75.264 1.00 28.98 C ATOM 1396 CG LEU A 610 -8.406 11.419 74.208 1.00 30.09 C ATOM 1397 CD1 LEU A 610 -8.354 12.927 73.935 1.00 29.42 C ATOM 1398 CD2 LEU A 610 -7.008 10.911 74.573 1.00 28.78 C ATOM 0 H LEU A 610 -9.606 8.775 74.342 1.00 28.49 H new ATOM 0 HA LEU A 610 -8.498 9.752 76.497 1.00 29.36 H new ATOM 0 HB2 LEU A 610 -10.326 11.084 74.823 1.00 28.98 H new ATOM 0 HB3 LEU A 610 -9.468 11.799 75.912 1.00 28.98 H new ATOM 0 HG LEU A 610 -8.683 10.958 73.401 1.00 30.09 H new ATOM 0 HD11 LEU A 610 -7.678 13.111 73.264 1.00 29.42 H new ATOM 0 HD12 LEU A 610 -9.218 13.228 73.614 1.00 29.42 H new ATOM 0 HD13 LEU A 610 -8.133 13.397 74.754 1.00 29.42 H new ATOM 0 HD21 LEU A 610 -6.382 11.154 73.873 1.00 28.78 H new ATOM 0 HD22 LEU A 610 -6.727 11.311 75.411 1.00 28.78 H new ATOM 0 HD23 LEU A 610 -7.029 9.946 74.667 1.00 28.78 H new ATOM 1399 N LYS A 611 -11.653 9.216 76.690 1.00 29.42 N ATOM 1400 CA LYS A 611 -12.795 9.013 77.594 1.00 30.69 C ATOM 1401 C LYS A 611 -12.529 8.055 78.744 1.00 31.01 C ATOM 1402 O LYS A 611 -13.029 8.261 79.846 1.00 31.36 O ATOM 1403 CB LYS A 611 -14.042 8.565 76.818 1.00 31.13 C ATOM 0 H LYS A 611 -11.822 9.014 75.871 1.00 29.42 H new ATOM 0 HA LYS A 611 -12.950 9.882 77.997 1.00 30.69 H new ATOM 1404 N LYS A 612 -11.726 7.023 78.486 1.00 31.77 N ATOM 1405 CA LYS A 612 -11.419 5.993 79.474 1.00 32.59 C ATOM 1406 C LYS A 612 -10.178 6.305 80.298 1.00 32.73 C ATOM 1407 O LYS A 612 -9.867 5.582 81.248 1.00 34.98 O ATOM 1408 CB LYS A 612 -11.264 4.610 78.797 1.00 32.88 C ATOM 1409 CG LYS A 612 -12.562 4.022 78.211 1.00 32.41 C ATOM 0 H LYS A 612 -11.342 6.901 77.726 1.00 31.77 H new ATOM 0 HA LYS A 612 -12.172 5.975 80.085 1.00 32.59 H new ATOM 0 HB2 LYS A 612 -10.609 4.685 78.086 1.00 32.88 H new ATOM 0 HB3 LYS A 612 -10.907 3.985 79.447 1.00 32.88 H new ATOM 1410 N ALA A 613 -9.468 7.373 79.938 1.00 31.99 N ATOM 1411 CA ALA A 613 -8.245 7.782 80.632 1.00 30.80 C ATOM 1412 C ALA A 613 -8.516 8.471 81.960 1.00 30.96 C ATOM 1413 O ALA A 613 -9.502 9.177 82.111 1.00 31.73 O ATOM 1414 CB ALA A 613 -7.407 8.689 79.745 1.00 29.88 C ATOM 0 H ALA A 613 -9.683 7.884 79.281 1.00 31.99 H new ATOM 0 HA ALA A 613 -7.756 6.967 80.826 1.00 30.80 H new ATOM 0 HB1 ALA A 613 -6.602 8.951 80.218 1.00 29.88 H new ATOM 0 HB2 ALA A 613 -7.165 8.215 78.934 1.00 29.88 H new ATOM 0 HB3 ALA A 613 -7.919 9.481 79.516 1.00 29.88 H new ATOM 1415 N ASP A 614 -7.618 8.280 82.920 1.00 30.20 N ATOM 1416 CA ASP A 614 -7.710 8.971 84.195 1.00 30.59 C ATOM 1417 C ASP A 614 -7.343 10.453 84.012 1.00 30.48 C ATOM 1418 O ASP A 614 -7.883 11.337 84.681 1.00 30.22 O ATOM 1419 CB ASP A 614 -6.814 8.272 85.224 1.00 30.15 C ATOM 1420 CG ASP A 614 -7.290 6.850 85.537 1.00 32.54 C ATOM 1421 OD1 ASP A 614 -8.462 6.681 85.942 1.00 34.87 O ATOM 1422 OD2 ASP A 614 -6.513 5.894 85.368 1.00 29.22 O ATOM 0 H ASP A 614 -6.944 7.750 82.850 1.00 30.20 H new ATOM 0 HA ASP A 614 -8.620 8.938 84.529 1.00 30.59 H new ATOM 0 HB2 ASP A 614 -5.904 8.240 84.889 1.00 30.15 H new ATOM 0 HB3 ASP A 614 -6.797 8.793 86.042 1.00 30.15 H new ATOM 1423 N LYS A 615 -6.421 10.710 83.087 1.00 29.25 N ATOM 1424 CA LYS A 615 -5.969 12.058 82.784 1.00 29.12 C ATOM 1425 C LYS A 615 -5.591 12.132 81.310 1.00 27.48 C ATOM 1426 O LYS A 615 -5.307 11.098 80.684 1.00 25.21 O ATOM 1427 CB LYS A 615 -4.746 12.388 83.626 1.00 30.05 C ATOM 1428 CG LYS A 615 -4.816 13.730 84.311 1.00 37.00 C ATOM 1429 CD LYS A 615 -5.365 13.553 85.715 1.00 43.36 C ATOM 1430 CE LYS A 615 -4.976 14.690 86.632 1.00 46.01 C ATOM 1431 NZ LYS A 615 -5.910 14.711 87.802 1.00 47.89 N ATOM 0 H LYS A 615 -6.039 10.100 82.616 1.00 29.25 H new ATOM 0 HA LYS A 615 -6.678 12.691 82.980 1.00 29.12 H new ATOM 0 HB2 LYS A 615 -4.632 11.698 84.298 1.00 30.05 H new ATOM 0 HB3 LYS A 615 -3.959 12.365 83.059 1.00 30.05 H new ATOM 0 HG2 LYS A 615 -3.934 14.132 84.346 1.00 37.00 H new ATOM 0 HG3 LYS A 615 -5.383 14.333 83.805 1.00 37.00 H new ATOM 0 HD2 LYS A 615 -6.332 13.488 85.676 1.00 43.36 H new ATOM 0 HD3 LYS A 615 -5.040 12.717 86.084 1.00 43.36 H new ATOM 0 HE2 LYS A 615 -4.061 14.579 86.935 1.00 46.01 H new ATOM 0 HE3 LYS A 615 -5.016 15.534 86.156 1.00 46.01 H new ATOM 0 HZ1 LYS A 615 -5.688 15.378 88.348 1.00 47.89 H new ATOM 0 HZ2 LYS A 615 -6.744 14.829 87.514 1.00 47.89 H new ATOM 0 HZ3 LYS A 615 -5.854 13.939 88.241 1.00 47.89 H new ATOM 1432 N ILE A 616 -5.599 13.354 80.773 1.00 25.47 N ATOM 1433 CA ILE A 616 -5.259 13.614 79.381 1.00 24.13 C ATOM 1434 C ILE A 616 -4.267 14.776 79.295 1.00 24.05 C ATOM 1435 O ILE A 616 -4.445 15.827 79.918 1.00 24.30 O ATOM 1436 CB ILE A 616 -6.532 13.933 78.534 1.00 25.13 C ATOM 1437 CG1 ILE A 616 -7.566 12.802 78.662 1.00 24.63 C ATOM 1438 CG2 ILE A 616 -6.177 14.180 77.052 1.00 23.54 C ATOM 1439 CD1 ILE A 616 -8.990 13.225 78.382 1.00 25.39 C ATOM 0 H ILE A 616 -5.805 14.061 81.216 1.00 25.47 H new ATOM 0 HA ILE A 616 -4.851 12.813 79.016 1.00 24.13 H new ATOM 0 HB ILE A 616 -6.922 14.749 78.884 1.00 25.13 H new ATOM 0 HG12 ILE A 616 -7.326 12.088 78.051 1.00 24.63 H new ATOM 0 HG13 ILE A 616 -7.519 12.435 79.559 1.00 24.63 H new ATOM 0 HG21 ILE A 616 -6.986 14.375 76.553 1.00 23.54 H new ATOM 0 HG22 ILE A 616 -5.568 14.932 76.986 1.00 23.54 H new ATOM 0 HG23 ILE A 616 -5.754 13.388 76.684 1.00 23.54 H new ATOM 0 HD11 ILE A 616 -9.580 12.462 78.482 1.00 25.39 H new ATOM 0 HD12 ILE A 616 -9.251 13.919 79.008 1.00 25.39 H new ATOM 0 HD13 ILE A 616 -9.054 13.566 77.476 1.00 25.39 H new ATOM 1440 N LEU A 617 -3.208 14.570 78.529 1.00 22.90 N ATOM 1441 CA LEU A 617 -2.315 15.651 78.150 1.00 21.59 C ATOM 1442 C LEU A 617 -2.346 15.801 76.630 1.00 21.27 C ATOM 1443 O LEU A 617 -2.014 14.856 75.901 1.00 20.59 O ATOM 1444 CB LEU A 617 -0.903 15.370 78.674 1.00 20.05 C ATOM 1445 CG LEU A 617 0.247 16.322 78.329 1.00 24.59 C ATOM 1446 CD1 LEU A 617 -0.013 17.737 78.816 1.00 21.58 C ATOM 1447 CD2 LEU A 617 1.576 15.793 78.902 1.00 22.01 C ATOM 0 H LEU A 617 -2.987 13.801 78.214 1.00 22.90 H new ATOM 0 HA LEU A 617 -2.604 16.488 78.546 1.00 21.59 H new ATOM 0 HB2 LEU A 617 -0.958 15.324 79.641 1.00 20.05 H new ATOM 0 HB3 LEU A 617 -0.650 14.487 78.362 1.00 20.05 H new ATOM 0 HG LEU A 617 0.309 16.357 77.362 1.00 24.59 H new ATOM 0 HD11 LEU A 617 0.737 18.304 78.578 1.00 21.58 H new ATOM 0 HD12 LEU A 617 -0.821 18.079 78.402 1.00 21.58 H new ATOM 0 HD13 LEU A 617 -0.121 17.733 79.780 1.00 21.58 H new ATOM 0 HD21 LEU A 617 2.293 16.406 78.675 1.00 22.01 H new ATOM 0 HD22 LEU A 617 1.506 15.720 79.867 1.00 22.01 H new ATOM 0 HD23 LEU A 617 1.766 14.920 78.525 1.00 22.01 H new ATOM 1448 N ILE A 618 -2.773 16.967 76.142 1.00 19.90 N ATOM 1449 CA ILE A 618 -2.689 17.233 74.712 1.00 20.84 C ATOM 1450 C ILE A 618 -1.551 18.184 74.434 1.00 21.24 C ATOM 1451 O ILE A 618 -1.506 19.292 74.964 1.00 22.13 O ATOM 1452 CB ILE A 618 -4.005 17.778 74.110 1.00 20.48 C ATOM 1453 CG1 ILE A 618 -5.180 16.864 74.463 1.00 20.66 C ATOM 1454 CG2 ILE A 618 -3.863 17.956 72.583 1.00 21.17 C ATOM 1455 CD1 ILE A 618 -6.537 17.451 74.134 1.00 24.62 C ATOM 0 H ILE A 618 -3.108 17.603 76.614 1.00 19.90 H new ATOM 0 HA ILE A 618 -2.525 16.381 74.278 1.00 20.84 H new ATOM 0 HB ILE A 618 -4.188 18.649 74.495 1.00 20.48 H new ATOM 0 HG12 ILE A 618 -5.078 16.024 73.989 1.00 20.66 H new ATOM 0 HG13 ILE A 618 -5.147 16.661 75.411 1.00 20.66 H new ATOM 0 HG21 ILE A 618 -4.694 18.298 72.218 1.00 21.17 H new ATOM 0 HG22 ILE A 618 -3.146 18.582 72.395 1.00 21.17 H new ATOM 0 HG23 ILE A 618 -3.659 17.100 72.175 1.00 21.17 H new ATOM 0 HD11 ILE A 618 -7.231 16.821 74.383 1.00 24.62 H new ATOM 0 HD12 ILE A 618 -6.660 18.278 74.626 1.00 24.62 H new ATOM 0 HD13 ILE A 618 -6.590 17.630 73.182 1.00 24.62 H new ATOM 1456 N LEU A 619 -0.627 17.756 73.595 1.00 20.42 N ATOM 1457 CA LEU A 619 0.495 18.602 73.241 1.00 21.78 C ATOM 1458 C LEU A 619 0.311 19.204 71.869 1.00 22.74 C ATOM 1459 O LEU A 619 -0.277 18.589 70.974 1.00 22.44 O ATOM 1460 CB LEU A 619 1.816 17.818 73.262 1.00 20.91 C ATOM 1461 CG LEU A 619 2.302 17.203 74.579 1.00 20.65 C ATOM 1462 CD1 LEU A 619 3.465 16.304 74.283 1.00 17.41 C ATOM 1463 CD2 LEU A 619 2.697 18.258 75.617 1.00 19.89 C ATOM 0 H LEU A 619 -0.630 16.982 73.220 1.00 20.42 H new ATOM 0 HA LEU A 619 0.532 19.310 73.903 1.00 21.78 H new ATOM 0 HB2 LEU A 619 1.739 17.099 72.616 1.00 20.91 H new ATOM 0 HB3 LEU A 619 2.513 18.412 72.943 1.00 20.91 H new ATOM 0 HG LEU A 619 1.568 16.701 74.967 1.00 20.65 H new ATOM 0 HD11 LEU A 619 3.785 15.906 75.108 1.00 17.41 H new ATOM 0 HD12 LEU A 619 3.185 15.603 73.674 1.00 17.41 H new ATOM 0 HD13 LEU A 619 4.178 16.820 73.876 1.00 17.41 H new ATOM 0 HD21 LEU A 619 2.996 17.818 76.428 1.00 19.89 H new ATOM 0 HD22 LEU A 619 3.415 18.807 75.264 1.00 19.89 H new ATOM 0 HD23 LEU A 619 1.931 18.818 75.817 1.00 19.89 H new ATOM 1464 N HIS A 620 0.857 20.396 71.693 1.00 23.35 N ATOM 1465 CA HIS A 620 0.803 21.059 70.409 1.00 25.14 C ATOM 1466 C HIS A 620 2.024 21.927 70.280 1.00 25.42 C ATOM 1467 O HIS A 620 2.208 22.839 71.078 1.00 25.80 O ATOM 1468 CB HIS A 620 -0.465 21.902 70.255 1.00 26.44 C ATOM 1469 CG HIS A 620 -0.544 22.591 68.928 1.00 30.90 C ATOM 1470 ND1 HIS A 620 -0.910 21.932 67.775 1.00 34.90 N ATOM 1471 CD2 HIS A 620 -0.225 23.855 68.556 1.00 33.56 C ATOM 1472 CE1 HIS A 620 -0.841 22.769 66.753 1.00 36.15 C ATOM 1473 NE2 HIS A 620 -0.432 23.942 67.202 1.00 34.22 N ATOM 0 H HIS A 620 1.264 20.837 72.308 1.00 23.35 H new ATOM 0 HA HIS A 620 0.782 20.389 69.708 1.00 25.14 H new ATOM 0 HB2 HIS A 620 -1.243 21.333 70.366 1.00 26.44 H new ATOM 0 HB3 HIS A 620 -0.495 22.566 70.962 1.00 26.44 H new ATOM 0 HD2 HIS A 620 0.077 24.535 69.113 1.00 33.56 H new ATOM 0 HE1 HIS A 620 -1.046 22.566 65.869 1.00 36.15 H new ATOM 0 HE2 HIS A 620 -0.314 24.647 66.723 1.00 34.22 H new ATOM 1474 N GLU A 621 2.889 21.597 69.319 1.00 26.08 N ATOM 1475 CA GLU A 621 4.144 22.322 69.096 1.00 28.16 C ATOM 1476 C GLU A 621 5.005 22.428 70.362 1.00 27.38 C ATOM 1477 O GLU A 621 5.602 23.476 70.644 1.00 26.22 O ATOM 1478 CB GLU A 621 3.873 23.716 68.492 1.00 28.59 C ATOM 1479 CG GLU A 621 3.538 23.689 66.991 1.00 31.36 C ATOM 1480 CD GLU A 621 3.000 25.018 66.465 1.00 34.19 C ATOM 1481 OE1 GLU A 621 2.258 24.987 65.452 1.00 44.31 O ATOM 1482 OE2 GLU A 621 3.309 26.091 67.050 1.00 41.64 O ATOM 0 H GLU A 621 2.764 20.943 68.775 1.00 26.08 H new ATOM 0 HA GLU A 621 4.657 21.801 68.458 1.00 28.16 H new ATOM 0 HB2 GLU A 621 3.138 24.129 68.971 1.00 28.59 H new ATOM 0 HB3 GLU A 621 4.653 24.276 68.631 1.00 28.59 H new ATOM 0 HG2 GLU A 621 4.335 23.451 66.493 1.00 31.36 H new ATOM 0 HG3 GLU A 621 2.882 22.994 66.825 1.00 31.36 H new ATOM 1483 N GLY A 622 5.075 21.344 71.130 1.00 25.40 N ATOM 1484 CA GLY A 622 5.993 21.322 72.253 1.00 25.70 C ATOM 1485 C GLY A 622 5.435 21.834 73.564 1.00 26.18 C ATOM 1486 O GLY A 622 6.061 21.673 74.602 1.00 26.23 O ATOM 0 H GLY A 622 4.610 20.629 71.019 1.00 25.40 H new ATOM 0 HA2 GLY A 622 6.297 20.410 72.384 1.00 25.70 H new ATOM 0 HA3 GLY A 622 6.773 21.851 72.023 1.00 25.70 H new ATOM 1487 N SER A 623 4.258 22.444 73.542 1.00 27.12 N ATOM 1488 CA SER A 623 3.634 22.820 74.799 1.00 28.50 C ATOM 1489 C SER A 623 2.267 22.193 75.035 1.00 27.76 C ATOM 1490 O SER A 623 1.654 21.612 74.133 1.00 27.89 O ATOM 1491 CB SER A 623 3.596 24.345 74.970 1.00 30.04 C ATOM 1492 OG SER A 623 2.986 24.984 73.879 1.00 33.60 O ATOM 0 H SER A 623 3.815 22.644 72.832 1.00 27.12 H new ATOM 0 HA SER A 623 4.203 22.447 75.490 1.00 28.50 H new ATOM 0 HB2 SER A 623 3.115 24.566 75.783 1.00 30.04 H new ATOM 0 HB3 SER A 623 4.500 24.680 75.075 1.00 30.04 H new ATOM 0 HG SER A 623 2.981 25.814 74.007 1.00 33.60 H new ATOM 1493 N SER A 624 1.810 22.296 76.277 1.00 26.03 N ATOM 1494 CA SER A 624 0.563 21.714 76.684 1.00 26.74 C ATOM 1495 C SER A 624 -0.587 22.567 76.157 1.00 27.53 C ATOM 1496 O SER A 624 -0.670 23.752 76.475 1.00 26.69 O ATOM 1497 CB SER A 624 0.530 21.593 78.214 1.00 26.19 C ATOM 1498 OG SER A 624 -0.754 21.245 78.667 1.00 29.93 O ATOM 0 H SER A 624 2.226 22.711 76.905 1.00 26.03 H new ATOM 0 HA SER A 624 0.469 20.822 76.314 1.00 26.74 H new ATOM 0 HB2 SER A 624 1.170 20.924 78.502 1.00 26.19 H new ATOM 0 HB3 SER A 624 0.800 22.435 78.614 1.00 26.19 H new ATOM 0 HG SER A 624 -0.749 21.183 79.505 1.00 29.93 H new ATOM 1499 N TYR A 625 -1.433 21.955 75.321 1.00 27.30 N ATOM 1500 CA TYR A 625 -2.677 22.537 74.831 1.00 27.29 C ATOM 1501 C TYR A 625 -3.826 22.268 75.812 1.00 27.61 C ATOM 1502 O TYR A 625 -4.753 23.053 75.949 1.00 27.04 O ATOM 1503 CB TYR A 625 -3.030 21.971 73.436 1.00 29.03 C ATOM 1504 CG TYR A 625 -4.444 22.299 73.050 1.00 29.84 C ATOM 1505 CD1 TYR A 625 -5.479 21.397 73.309 1.00 29.68 C ATOM 1506 CD2 TYR A 625 -4.768 23.546 72.499 1.00 33.15 C ATOM 1507 CE1 TYR A 625 -6.800 21.703 73.013 1.00 31.14 C ATOM 1508 CE2 TYR A 625 -6.091 23.867 72.195 1.00 31.47 C ATOM 1509 CZ TYR A 625 -7.097 22.941 72.457 1.00 33.81 C ATOM 1510 OH TYR A 625 -8.407 23.226 72.170 1.00 32.61 O ATOM 0 H TYR A 625 -1.289 21.164 75.017 1.00 27.30 H new ATOM 0 HA TYR A 625 -2.551 23.496 74.756 1.00 27.29 H new ATOM 0 HB2 TYR A 625 -2.420 22.334 72.775 1.00 29.03 H new ATOM 0 HB3 TYR A 625 -2.908 21.009 73.436 1.00 29.03 H new ATOM 0 HD1 TYR A 625 -5.278 20.572 73.689 1.00 29.68 H new ATOM 0 HD2 TYR A 625 -4.094 24.166 72.334 1.00 33.15 H new ATOM 0 HE1 TYR A 625 -7.476 21.088 73.184 1.00 31.14 H new ATOM 0 HE2 TYR A 625 -6.299 24.692 71.821 1.00 31.47 H new ATOM 0 HH TYR A 625 -8.887 22.566 72.369 1.00 32.61 H new ATOM 1511 N PHE A 626 -3.774 21.120 76.468 1.00 27.42 N ATOM 1512 CA PHE A 626 -4.758 20.767 77.463 1.00 27.93 C ATOM 1513 C PHE A 626 -4.137 19.768 78.427 1.00 27.68 C ATOM 1514 O PHE A 626 -3.460 18.828 78.000 1.00 27.49 O ATOM 1515 CB PHE A 626 -6.020 20.155 76.813 1.00 27.75 C ATOM 1516 CG PHE A 626 -6.996 19.590 77.817 1.00 28.33 C ATOM 1517 CD1 PHE A 626 -7.866 20.431 78.505 1.00 31.73 C ATOM 1518 CD2 PHE A 626 -7.014 18.225 78.101 1.00 29.24 C ATOM 1519 CE1 PHE A 626 -8.750 19.924 79.451 1.00 32.07 C ATOM 1520 CE2 PHE A 626 -7.891 17.694 79.047 1.00 27.77 C ATOM 1521 CZ PHE A 626 -8.764 18.543 79.730 1.00 31.36 C ATOM 0 H PHE A 626 -3.165 20.525 76.346 1.00 27.42 H new ATOM 0 HA PHE A 626 -5.030 21.569 77.936 1.00 27.93 H new ATOM 0 HB2 PHE A 626 -6.466 20.835 76.285 1.00 27.75 H new ATOM 0 HB3 PHE A 626 -5.752 19.452 76.201 1.00 27.75 H new ATOM 0 HD1 PHE A 626 -7.856 21.344 78.330 1.00 31.73 H new ATOM 0 HD2 PHE A 626 -6.430 17.658 77.651 1.00 29.24 H new ATOM 0 HE1 PHE A 626 -9.331 20.496 79.899 1.00 32.07 H new ATOM 0 HE2 PHE A 626 -7.894 16.781 79.222 1.00 27.77 H new ATOM 0 HZ PHE A 626 -9.351 18.199 80.365 1.00 31.36 H new ATOM 1522 N TYR A 627 -4.380 19.973 79.719 1.00 27.72 N ATOM 1523 CA TYR A 627 -4.110 18.964 80.729 1.00 27.27 C ATOM 1524 C TYR A 627 -5.294 18.873 81.711 1.00 28.53 C ATOM 1525 O TYR A 627 -5.747 19.899 82.253 1.00 27.85 O ATOM 1526 CB TYR A 627 -2.780 19.268 81.453 1.00 27.87 C ATOM 1527 CG TYR A 627 -2.529 18.386 82.656 1.00 28.24 C ATOM 1528 CD1 TYR A 627 -2.502 16.992 82.537 1.00 23.85 C ATOM 1529 CD2 TYR A 627 -2.349 18.946 83.925 1.00 25.95 C ATOM 1530 CE1 TYR A 627 -2.294 16.184 83.658 1.00 29.28 C ATOM 1531 CE2 TYR A 627 -2.139 18.143 85.046 1.00 27.93 C ATOM 1532 CZ TYR A 627 -2.113 16.771 84.907 1.00 28.26 C ATOM 1533 OH TYR A 627 -1.902 15.986 86.018 1.00 31.77 O ATOM 0 H TYR A 627 -4.707 20.704 80.032 1.00 27.72 H new ATOM 0 HA TYR A 627 -4.013 18.099 80.302 1.00 27.27 H new ATOM 0 HB2 TYR A 627 -2.048 19.162 80.826 1.00 27.87 H new ATOM 0 HB3 TYR A 627 -2.779 20.196 81.736 1.00 27.87 H new ATOM 0 HD1 TYR A 627 -2.624 16.599 81.703 1.00 23.85 H new ATOM 0 HD2 TYR A 627 -2.370 19.871 84.023 1.00 25.95 H new ATOM 0 HE1 TYR A 627 -2.277 15.258 83.570 1.00 29.28 H new ATOM 0 HE2 TYR A 627 -2.017 18.531 85.883 1.00 27.93 H new ATOM 0 HH TYR A 627 -1.810 16.476 86.694 1.00 31.77 H new ATOM 1534 N GLY A 628 -5.796 17.656 81.936 1.00 28.57 N ATOM 1535 CA GLY A 628 -7.008 17.469 82.744 1.00 29.09 C ATOM 1536 C GLY A 628 -7.713 16.148 82.509 1.00 29.60 C ATOM 1537 O GLY A 628 -7.181 15.270 81.820 1.00 28.37 O ATOM 0 H GLY A 628 -5.453 16.928 81.632 1.00 28.57 H new ATOM 0 HA2 GLY A 628 -6.772 17.536 83.683 1.00 29.09 H new ATOM 0 HA3 GLY A 628 -7.626 18.192 82.554 1.00 29.09 H new ATOM 1538 N THR A 629 -8.912 16.017 83.078 1.00 29.37 N ATOM 1539 CA THR A 629 -9.752 14.827 82.918 1.00 29.31 C ATOM 1540 C THR A 629 -10.591 14.979 81.660 1.00 30.67 C ATOM 1541 O THR A 629 -10.605 16.057 81.063 1.00 30.96 O ATOM 1542 CB THR A 629 -10.720 14.630 84.128 1.00 29.29 C ATOM 1543 OG1 THR A 629 -11.624 15.732 84.190 1.00 27.72 O ATOM 1544 CG2 THR A 629 -9.964 14.521 85.461 1.00 29.44 C ATOM 0 H THR A 629 -9.265 16.624 83.574 1.00 29.37 H new ATOM 0 HA THR A 629 -9.165 14.057 82.863 1.00 29.31 H new ATOM 0 HB THR A 629 -11.200 13.799 83.991 1.00 29.29 H new ATOM 0 HG1 THR A 629 -12.147 15.629 84.839 1.00 27.72 H new ATOM 0 HG21 THR A 629 -10.599 14.400 86.184 1.00 29.44 H new ATOM 0 HG22 THR A 629 -9.361 13.762 85.430 1.00 29.44 H new ATOM 0 HG23 THR A 629 -9.454 15.332 85.611 1.00 29.44 H new ATOM 1545 N PHE A 630 -11.318 13.923 81.277 1.00 31.67 N ATOM 1546 CA PHE A 630 -12.196 13.967 80.089 1.00 33.49 C ATOM 1547 C PHE A 630 -13.449 14.846 80.258 1.00 34.10 C ATOM 1548 O PHE A 630 -13.902 15.465 79.296 1.00 33.40 O ATOM 1549 CB PHE A 630 -12.593 12.566 79.631 1.00 33.49 C ATOM 1550 CG PHE A 630 -13.326 12.545 78.316 1.00 35.28 C ATOM 1551 CD1 PHE A 630 -12.623 12.612 77.111 1.00 34.84 C ATOM 1552 CD2 PHE A 630 -14.722 12.451 78.278 1.00 37.02 C ATOM 1553 CE1 PHE A 630 -13.292 12.585 75.887 1.00 35.14 C ATOM 1554 CE2 PHE A 630 -15.397 12.420 77.058 1.00 35.99 C ATOM 1555 CZ PHE A 630 -14.676 12.496 75.860 1.00 35.84 C ATOM 0 H PHE A 630 -11.320 13.169 81.690 1.00 31.67 H new ATOM 0 HA PHE A 630 -11.658 14.389 79.401 1.00 33.49 H new ATOM 0 HB2 PHE A 630 -11.795 12.020 79.556 1.00 33.49 H new ATOM 0 HB3 PHE A 630 -13.152 12.158 80.311 1.00 33.49 H new ATOM 0 HD1 PHE A 630 -11.695 12.676 77.125 1.00 34.84 H new ATOM 0 HD2 PHE A 630 -15.203 12.409 79.073 1.00 37.02 H new ATOM 0 HE1 PHE A 630 -12.812 12.627 75.092 1.00 35.14 H new ATOM 0 HE2 PHE A 630 -16.324 12.349 77.040 1.00 35.99 H new ATOM 0 HZ PHE A 630 -15.125 12.487 75.046 1.00 35.84 H new ATOM 1556 N SER A 631 -14.011 14.876 81.468 1.00 35.24 N ATOM 1557 CA SER A 631 -15.055 15.852 81.826 1.00 36.76 C ATOM 1558 C SER A 631 -14.579 17.268 81.534 1.00 36.52 C ATOM 1559 O SER A 631 -15.276 18.038 80.875 1.00 37.73 O ATOM 1560 CB SER A 631 -15.446 15.737 83.314 1.00 36.66 C ATOM 1561 OG SER A 631 -16.020 14.472 83.584 1.00 40.56 O ATOM 0 H SER A 631 -13.802 14.336 82.104 1.00 35.24 H new ATOM 0 HA SER A 631 -15.837 15.655 81.287 1.00 36.76 H new ATOM 0 HB2 SER A 631 -14.662 15.867 83.870 1.00 36.66 H new ATOM 0 HB3 SER A 631 -16.076 16.439 83.543 1.00 36.66 H new ATOM 0 HG SER A 631 -16.226 14.425 84.397 1.00 40.56 H new ATOM 1562 N GLU A 632 -13.381 17.597 82.013 1.00 37.03 N ATOM 1563 CA GLU A 632 -12.765 18.899 81.748 1.00 38.43 C ATOM 1564 C GLU A 632 -12.546 19.178 80.261 1.00 38.56 C ATOM 1565 O GLU A 632 -12.810 20.284 79.797 1.00 39.21 O ATOM 1566 CB GLU A 632 -11.473 19.066 82.546 1.00 38.11 C ATOM 1567 CG GLU A 632 -11.733 19.429 83.991 1.00 40.25 C ATOM 1568 CD GLU A 632 -10.521 19.247 84.893 1.00 43.72 C ATOM 1569 OE1 GLU A 632 -10.691 19.354 86.126 1.00 43.42 O ATOM 1570 OE2 GLU A 632 -9.405 18.994 84.388 1.00 42.77 O ATOM 0 H GLU A 632 -12.902 17.074 82.500 1.00 37.03 H new ATOM 0 HA GLU A 632 -13.401 19.567 82.049 1.00 38.43 H new ATOM 0 HB2 GLU A 632 -10.963 18.241 82.509 1.00 38.11 H new ATOM 0 HB3 GLU A 632 -10.928 19.755 82.135 1.00 38.11 H new ATOM 0 HG2 GLU A 632 -12.025 20.353 84.037 1.00 40.25 H new ATOM 0 HG3 GLU A 632 -12.462 18.884 84.327 1.00 40.25 H new ATOM 1571 N LEU A 633 -12.100 18.173 79.511 1.00 39.43 N ATOM 1572 CA LEU A 633 -11.952 18.314 78.052 1.00 40.01 C ATOM 1573 C LEU A 633 -13.298 18.496 77.354 1.00 41.28 C ATOM 1574 O LEU A 633 -13.401 19.290 76.413 1.00 40.81 O ATOM 1575 CB LEU A 633 -11.209 17.114 77.442 1.00 39.48 C ATOM 1576 CG LEU A 633 -10.990 17.141 75.918 1.00 39.44 C ATOM 1577 CD1 LEU A 633 -10.186 18.375 75.490 1.00 36.83 C ATOM 1578 CD2 LEU A 633 -10.328 15.862 75.438 1.00 38.56 C ATOM 0 H LEU A 633 -11.877 17.402 79.820 1.00 39.43 H new ATOM 0 HA LEU A 633 -11.424 19.115 77.908 1.00 40.01 H new ATOM 0 HB2 LEU A 633 -10.342 17.044 77.872 1.00 39.48 H new ATOM 0 HB3 LEU A 633 -11.701 16.308 77.663 1.00 39.48 H new ATOM 0 HG LEU A 633 -11.862 17.200 75.498 1.00 39.44 H new ATOM 0 HD11 LEU A 633 -10.064 18.364 74.528 1.00 36.83 H new ATOM 0 HD12 LEU A 633 -10.665 19.179 75.746 1.00 36.83 H new ATOM 0 HD13 LEU A 633 -9.319 18.364 75.925 1.00 36.83 H new ATOM 0 HD21 LEU A 633 -10.201 15.904 74.477 1.00 38.56 H new ATOM 0 HD22 LEU A 633 -9.467 15.760 75.873 1.00 38.56 H new ATOM 0 HD23 LEU A 633 -10.892 15.104 75.657 1.00 38.56 H new ATOM 1579 N GLN A 634 -14.295 17.718 77.794 1.00 43.20 N ATOM 1580 CA GLN A 634 -15.687 17.809 77.328 1.00 45.10 C ATOM 1581 C GLN A 634 -16.273 19.193 77.518 1.00 45.80 C ATOM 1582 O GLN A 634 -16.975 19.697 76.638 1.00 46.30 O ATOM 1583 CB GLN A 634 -16.578 16.813 78.073 1.00 45.31 C ATOM 1584 CG GLN A 634 -17.013 15.600 77.271 1.00 45.72 C ATOM 1585 CD GLN A 634 -18.048 14.757 78.015 1.00 47.01 C ATOM 1586 OE1 GLN A 634 -18.345 15.006 79.190 1.00 49.80 O ATOM 1587 NE2 GLN A 634 -18.597 13.753 77.334 1.00 47.88 N ATOM 0 H GLN A 634 -14.177 17.107 78.387 1.00 43.20 H new ATOM 0 HA GLN A 634 -15.664 17.604 76.380 1.00 45.10 H new ATOM 0 HB2 GLN A 634 -16.105 16.507 78.862 1.00 45.31 H new ATOM 0 HB3 GLN A 634 -17.371 17.279 78.381 1.00 45.31 H new ATOM 0 HG2 GLN A 634 -17.384 15.891 76.423 1.00 45.72 H new ATOM 0 HG3 GLN A 634 -16.238 15.053 77.069 1.00 45.72 H new ATOM 0 HE21 GLN A 634 -18.366 13.610 76.518 1.00 47.88 H new ATOM 0 HE22 GLN A 634 -19.183 13.248 77.710 1.00 47.88 H new ATOM 1588 N ASN A 635 -16.004 19.795 78.676 1.00 46.94 N ATOM 1589 CA ASN A 635 -16.471 21.157 78.977 1.00 48.27 C ATOM 1590 C ASN A 635 -15.986 22.224 77.974 1.00 49.14 C ATOM 1591 O ASN A 635 -16.589 23.297 77.861 1.00 49.71 O ATOM 1592 CB ASN A 635 -16.099 21.551 80.412 1.00 48.13 C ATOM 0 H ASN A 635 -15.549 19.431 79.308 1.00 46.94 H new ATOM 0 HA ASN A 635 -17.437 21.132 78.888 1.00 48.27 H new ATOM 1593 N LEU A 636 -14.901 21.917 77.257 1.00 49.97 N ATOM 1594 CA LEU A 636 -14.331 22.799 76.227 1.00 50.54 C ATOM 1595 C LEU A 636 -14.987 22.567 74.870 1.00 50.37 C ATOM 1596 O LEU A 636 -14.565 23.139 73.863 1.00 50.14 O ATOM 1597 CB LEU A 636 -12.817 22.568 76.104 1.00 50.55 C ATOM 1598 CG LEU A 636 -11.780 23.478 76.775 1.00 52.12 C ATOM 1599 CD1 LEU A 636 -12.134 23.869 78.221 1.00 51.93 C ATOM 1600 CD2 LEU A 636 -10.402 22.814 76.704 1.00 50.60 C ATOM 0 H LEU A 636 -14.468 21.180 77.355 1.00 49.97 H new ATOM 0 HA LEU A 636 -14.501 23.714 76.501 1.00 50.54 H new ATOM 0 HB2 LEU A 636 -12.647 21.670 76.429 1.00 50.55 H new ATOM 0 HB3 LEU A 636 -12.614 22.570 75.156 1.00 50.55 H new ATOM 0 HG LEU A 636 -11.773 24.314 76.282 1.00 52.12 H new ATOM 0 HD11 LEU A 636 -11.439 24.442 78.581 1.00 51.93 H new ATOM 0 HD12 LEU A 636 -12.980 24.343 78.230 1.00 51.93 H new ATOM 0 HD13 LEU A 636 -12.207 23.069 78.764 1.00 51.93 H new ATOM 0 HD21 LEU A 636 -9.744 23.387 77.128 1.00 50.60 H new ATOM 0 HD22 LEU A 636 -10.430 21.960 77.163 1.00 50.60 H new ATOM 0 HD23 LEU A 636 -10.158 22.673 75.776 1.00 50.60 H new ATOM 1601 N ASP A 639 -13.870 22.001 70.184 1.00 47.95 N ATOM 1602 CA ASP A 639 -12.518 22.560 70.179 1.00 47.71 C ATOM 1603 C ASP A 639 -11.568 21.768 69.270 1.00 47.60 C ATOM 1604 O ASP A 639 -11.972 20.790 68.626 1.00 47.12 O ATOM 1605 CB ASP A 639 -11.950 22.626 71.606 1.00 47.44 C ATOM 1606 CG ASP A 639 -11.453 21.264 72.113 1.00 48.58 C ATOM 1607 OD1 ASP A 639 -12.153 20.242 71.910 1.00 48.34 O ATOM 1608 OD2 ASP A 639 -10.361 21.219 72.722 1.00 48.84 O ATOM 0 HA ASP A 639 -12.586 23.459 69.822 1.00 47.71 H new ATOM 0 HB2 ASP A 639 -11.218 23.262 71.629 1.00 47.44 H new ATOM 0 HB3 ASP A 639 -12.634 22.960 72.207 1.00 47.44 H new ATOM 1609 N PHE A 640 -10.312 22.214 69.237 1.00 47.48 N ATOM 1610 CA PHE A 640 -9.221 21.573 68.503 1.00 48.07 C ATOM 1611 C PHE A 640 -9.174 20.053 68.727 1.00 48.19 C ATOM 1612 O PHE A 640 -9.088 19.297 67.762 1.00 48.18 O ATOM 1613 CB PHE A 640 -7.894 22.256 68.884 1.00 48.27 C ATOM 1614 CG PHE A 640 -6.651 21.537 68.406 1.00 48.98 C ATOM 1615 CD1 PHE A 640 -5.792 20.926 69.329 1.00 48.16 C ATOM 1616 CD2 PHE A 640 -6.324 21.495 67.046 1.00 48.94 C ATOM 1617 CE1 PHE A 640 -4.632 20.282 68.918 1.00 48.12 C ATOM 1618 CE2 PHE A 640 -5.165 20.844 66.614 1.00 50.48 C ATOM 1619 CZ PHE A 640 -4.316 20.233 67.558 1.00 50.21 C ATOM 0 H PHE A 640 -10.064 22.923 69.656 1.00 47.48 H new ATOM 0 HA PHE A 640 -9.376 21.687 67.552 1.00 48.07 H new ATOM 0 HB2 PHE A 640 -7.892 23.156 68.521 1.00 48.27 H new ATOM 0 HB3 PHE A 640 -7.853 22.339 69.850 1.00 48.27 H new ATOM 0 HD1 PHE A 640 -6.003 20.952 70.234 1.00 48.16 H new ATOM 0 HD2 PHE A 640 -6.882 21.904 66.425 1.00 48.94 H new ATOM 0 HE1 PHE A 640 -4.069 19.886 69.544 1.00 48.12 H new ATOM 0 HE2 PHE A 640 -4.955 20.814 65.708 1.00 50.48 H new ATOM 0 HZ PHE A 640 -3.545 19.797 67.276 1.00 50.21 H new ATOM 1620 N SER A 641 -9.269 19.621 69.990 1.00 48.60 N ATOM 1621 CA SER A 641 -9.240 18.200 70.343 1.00 48.99 C ATOM 1622 C SER A 641 -10.273 17.388 69.557 1.00 49.71 C ATOM 1623 O SER A 641 -9.991 16.271 69.125 1.00 49.99 O ATOM 1624 CB SER A 641 -9.439 18.000 71.852 1.00 49.08 C ATOM 1625 OG SER A 641 -10.815 17.856 72.195 1.00 46.30 O ATOM 0 H SER A 641 -9.352 20.147 70.666 1.00 48.60 H new ATOM 0 HA SER A 641 -8.361 17.870 70.099 1.00 48.99 H new ATOM 0 HB2 SER A 641 -8.951 17.213 72.140 1.00 49.08 H new ATOM 0 HB3 SER A 641 -9.065 18.757 72.330 1.00 49.08 H new ATOM 0 HG SER A 641 -11.209 18.591 72.090 1.00 46.30 H new ATOM 1626 N SER A 642 -11.460 17.960 69.364 1.00 50.36 N ATOM 1627 CA SER A 642 -12.546 17.294 68.632 1.00 51.09 C ATOM 1628 C SER A 642 -12.215 17.075 67.148 1.00 51.89 C ATOM 1629 O SER A 642 -12.747 16.160 66.516 1.00 51.65 O ATOM 1630 CB SER A 642 -13.862 18.069 68.791 1.00 51.14 C ATOM 0 H SER A 642 -11.662 18.745 69.652 1.00 50.36 H new ATOM 0 HA SER A 642 -12.651 16.414 69.025 1.00 51.09 H new ATOM 1631 N LYS A 643 -11.340 17.921 66.601 1.00 52.57 N ATOM 1632 CA LYS A 643 -10.877 17.772 65.220 1.00 53.30 C ATOM 1633 C LYS A 643 -9.658 16.836 65.122 1.00 53.97 C ATOM 1634 O LYS A 643 -9.505 16.105 64.141 1.00 53.89 O ATOM 1635 CB LYS A 643 -10.552 19.146 64.615 1.00 53.32 C ATOM 0 H LYS A 643 -11.000 18.593 67.017 1.00 52.57 H new ATOM 0 HA LYS A 643 -11.596 17.365 64.712 1.00 53.30 H new ATOM 1636 N LEU A 644 -8.813 16.855 66.155 1.00 54.56 N ATOM 1637 CA LEU A 644 -7.527 16.145 66.155 1.00 54.54 C ATOM 1638 C LEU A 644 -7.652 14.632 66.365 1.00 54.83 C ATOM 1639 O LEU A 644 -6.817 13.871 65.870 1.00 54.34 O ATOM 1640 CB LEU A 644 -6.583 16.756 67.203 1.00 54.65 C ATOM 1641 CG LEU A 644 -5.055 16.520 67.194 1.00 55.31 C ATOM 1642 CD1 LEU A 644 -4.637 15.370 68.099 1.00 55.52 C ATOM 1643 CD2 LEU A 644 -4.471 16.357 65.782 1.00 55.88 C ATOM 0 H LEU A 644 -8.970 17.284 66.883 1.00 54.56 H new ATOM 0 HA LEU A 644 -7.155 16.260 65.267 1.00 54.54 H new ATOM 0 HB2 LEU A 644 -6.714 17.716 67.166 1.00 54.65 H new ATOM 0 HB3 LEU A 644 -6.903 16.459 68.069 1.00 54.65 H new ATOM 0 HG LEU A 644 -4.672 17.333 67.559 1.00 55.31 H new ATOM 0 HD11 LEU A 644 -3.674 15.261 68.060 1.00 55.52 H new ATOM 0 HD12 LEU A 644 -4.904 15.563 69.012 1.00 55.52 H new ATOM 0 HD13 LEU A 644 -5.067 14.552 67.803 1.00 55.52 H new ATOM 0 HD21 LEU A 644 -3.514 16.213 65.842 1.00 55.88 H new ATOM 0 HD22 LEU A 644 -4.886 15.596 65.346 1.00 55.88 H new ATOM 0 HD23 LEU A 644 -4.645 17.159 65.265 1.00 55.88 H new ATOM 1644 N MET A 645 -8.688 14.206 67.091 1.00 55.25 N ATOM 1645 CA MET A 645 -8.868 12.788 67.431 1.00 55.77 C ATOM 1646 C MET A 645 -9.732 12.029 66.426 1.00 55.88 C ATOM 1647 O MET A 645 -10.594 12.611 65.759 1.00 56.00 O ATOM 1648 CB MET A 645 -9.487 12.624 68.831 1.00 56.23 C ATOM 1649 CG MET A 645 -8.879 13.473 69.937 1.00 56.99 C ATOM 1650 SD MET A 645 -7.135 13.182 70.293 1.00 59.68 S ATOM 1651 CE MET A 645 -6.762 14.739 71.109 1.00 57.22 C ATOM 0 H MET A 645 -9.302 14.724 67.399 1.00 55.25 H new ATOM 0 HA MET A 645 -7.976 12.407 67.410 1.00 55.77 H new ATOM 0 HB2 MET A 645 -10.433 12.831 68.772 1.00 56.23 H new ATOM 0 HB3 MET A 645 -9.416 11.691 69.088 1.00 56.23 H new ATOM 0 HG2 MET A 645 -8.991 14.407 69.701 1.00 56.99 H new ATOM 0 HG3 MET A 645 -9.386 13.323 70.750 1.00 56.99 H new ATOM 0 HE1 MET A 645 -5.837 14.978 70.943 1.00 57.22 H new ATOM 0 HE2 MET A 645 -7.342 15.434 70.761 1.00 57.22 H new ATOM 0 HE3 MET A 645 -6.905 14.647 72.064 1.00 57.22 H new ATOM 1652 N GLY A 646 -9.488 10.723 66.334 1.00 56.00 N ATOM 1653 CA GLY A 646 -10.397 9.800 65.657 1.00 56.23 C ATOM 1654 C GLY A 646 -11.378 9.171 66.639 1.00 56.14 C ATOM 1655 O GLY A 646 -11.381 9.457 67.840 1.00 55.38 O ATOM 1656 OXT GLY A 646 -12.212 8.347 66.258 1.00 56.56 O ATOM 0 H GLY A 646 -8.789 10.346 66.663 1.00 56.00 H new ATOM 0 HA2 GLY A 646 -10.886 10.273 64.966 1.00 56.23 H new ATOM 0 HA3 GLY A 646 -9.885 9.104 65.216 1.00 56.23 H new TER 1657 GLY A 646 ATOM 1658 N THR B 388 -2.589 -0.151 25.034 1.00 47.38 N ATOM 1659 CA THR B 388 -3.726 -0.403 25.977 1.00 48.33 C ATOM 1660 C THR B 388 -3.525 0.262 27.343 1.00 47.53 C ATOM 1661 O THR B 388 -2.396 0.407 27.828 1.00 48.44 O ATOM 1662 CB THR B 388 -4.038 -1.929 26.111 1.00 48.72 C ATOM 1663 OG1 THR B 388 -4.685 -2.378 24.914 1.00 51.27 O ATOM 1664 CG2 THR B 388 -4.962 -2.228 27.289 1.00 48.08 C ATOM 0 HA THR B 388 -4.506 0.019 25.584 1.00 48.33 H new ATOM 0 HB THR B 388 -3.196 -2.388 26.258 1.00 48.72 H new ATOM 0 HG1 THR B 388 -4.855 -3.198 24.978 1.00 51.27 H new ATOM 0 HG21 THR B 388 -5.129 -3.182 27.335 1.00 48.08 H new ATOM 0 HG22 THR B 388 -4.543 -1.933 28.112 1.00 48.08 H new ATOM 0 HG23 THR B 388 -5.802 -1.759 27.169 1.00 48.08 H new ATOM 1665 N THR B 389 -4.643 0.666 27.941 1.00 46.50 N ATOM 1666 CA THR B 389 -4.654 1.381 29.208 1.00 45.29 C ATOM 1667 C THR B 389 -4.606 0.472 30.454 1.00 43.85 C ATOM 1668 O THR B 389 -4.526 0.980 31.570 1.00 42.79 O ATOM 1669 CB THR B 389 -5.890 2.324 29.305 1.00 45.51 C ATOM 0 H THR B 389 -5.427 0.529 27.615 1.00 46.50 H new ATOM 0 HA THR B 389 -3.833 1.898 29.209 1.00 45.29 H new ATOM 1670 N THR B 390 -4.659 -0.852 30.272 1.00 41.91 N ATOM 1671 CA THR B 390 -4.633 -1.784 31.420 1.00 39.64 C ATOM 1672 C THR B 390 -3.201 -1.967 31.950 1.00 37.25 C ATOM 1673 O THR B 390 -2.313 -2.377 31.211 1.00 36.34 O ATOM 1674 CB THR B 390 -5.257 -3.163 31.085 1.00 40.72 C ATOM 1675 OG1 THR B 390 -6.535 -2.987 30.459 1.00 41.59 O ATOM 1676 CG2 THR B 390 -5.463 -3.981 32.359 1.00 41.07 C ATOM 0 H THR B 390 -4.710 -1.232 29.502 1.00 41.91 H new ATOM 0 HA THR B 390 -5.179 -1.380 32.112 1.00 39.64 H new ATOM 0 HB THR B 390 -4.650 -3.627 30.488 1.00 40.72 H new ATOM 0 HG1 THR B 390 -6.879 -2.267 30.721 1.00 41.59 H new ATOM 0 HG21 THR B 390 -5.854 -4.840 32.133 1.00 41.07 H new ATOM 0 HG22 THR B 390 -4.608 -4.120 32.796 1.00 41.07 H new ATOM 0 HG23 THR B 390 -6.058 -3.503 32.958 1.00 41.07 H new ATOM 1677 N GLU B 391 -2.982 -1.656 33.225 1.00 34.54 N ATOM 1678 CA GLU B 391 -1.632 -1.722 33.796 1.00 33.34 C ATOM 1679 C GLU B 391 -1.398 -2.970 34.642 1.00 31.22 C ATOM 1680 O GLU B 391 -0.330 -3.550 34.580 1.00 31.18 O ATOM 1681 CB GLU B 391 -1.295 -0.458 34.617 1.00 33.55 C ATOM 1682 CG GLU B 391 -1.053 0.821 33.806 1.00 36.18 C ATOM 1683 CD GLU B 391 0.240 0.814 32.976 1.00 42.20 C ATOM 1684 OE1 GLU B 391 0.298 1.564 31.973 1.00 46.48 O ATOM 1685 OE2 GLU B 391 1.194 0.073 33.309 1.00 42.05 O ATOM 0 H GLU B 391 -3.594 -1.406 33.775 1.00 34.54 H new ATOM 0 HA GLU B 391 -1.033 -1.772 33.035 1.00 33.34 H new ATOM 0 HB2 GLU B 391 -2.021 -0.294 35.239 1.00 33.55 H new ATOM 0 HB3 GLU B 391 -0.503 -0.639 35.147 1.00 33.55 H new ATOM 0 HG2 GLU B 391 -1.806 0.960 33.210 1.00 36.18 H new ATOM 0 HG3 GLU B 391 -1.030 1.576 34.414 1.00 36.18 H new ATOM 1686 N VAL B 392 -2.383 -3.351 35.453 1.00 30.64 N ATOM 1687 CA VAL B 392 -2.273 -4.528 36.325 1.00 30.41 C ATOM 1688 C VAL B 392 -3.509 -5.411 36.175 1.00 30.42 C ATOM 1689 O VAL B 392 -4.642 -4.924 36.226 1.00 30.64 O ATOM 1690 CB VAL B 392 -2.066 -4.153 37.836 1.00 30.48 C ATOM 1691 CG1 VAL B 392 -1.580 -5.367 38.652 1.00 30.71 C ATOM 1692 CG2 VAL B 392 -1.085 -2.992 37.989 1.00 29.89 C ATOM 0 H VAL B 392 -3.134 -2.937 35.516 1.00 30.64 H new ATOM 0 HA VAL B 392 -1.482 -5.013 36.041 1.00 30.41 H new ATOM 0 HB VAL B 392 -2.928 -3.875 38.183 1.00 30.48 H new ATOM 0 HG11 VAL B 392 -1.461 -5.107 39.579 1.00 30.71 H new ATOM 0 HG12 VAL B 392 -2.238 -6.078 38.598 1.00 30.71 H new ATOM 0 HG13 VAL B 392 -0.735 -5.681 38.293 1.00 30.71 H new ATOM 0 HG21 VAL B 392 -0.976 -2.782 38.930 1.00 29.89 H new ATOM 0 HG22 VAL B 392 -0.227 -3.242 37.612 1.00 29.89 H new ATOM 0 HG23 VAL B 392 -1.428 -2.214 37.522 1.00 29.89 H new ATOM 1693 N VAL B 393 -3.268 -6.704 35.967 1.00 29.80 N ATOM 1694 CA VAL B 393 -4.304 -7.716 35.932 1.00 29.42 C ATOM 1695 C VAL B 393 -3.933 -8.888 36.851 1.00 28.48 C ATOM 1696 O VAL B 393 -2.850 -9.456 36.745 1.00 28.22 O ATOM 1697 CB VAL B 393 -4.531 -8.272 34.489 1.00 30.70 C ATOM 1698 CG1 VAL B 393 -5.686 -9.271 34.462 1.00 31.26 C ATOM 1699 CG2 VAL B 393 -4.798 -7.167 33.503 1.00 29.48 C ATOM 0 H VAL B 393 -2.478 -7.018 35.840 1.00 29.80 H new ATOM 0 HA VAL B 393 -5.122 -7.292 36.235 1.00 29.42 H new ATOM 0 HB VAL B 393 -3.713 -8.724 34.229 1.00 30.70 H new ATOM 0 HG11 VAL B 393 -5.807 -9.601 33.558 1.00 31.26 H new ATOM 0 HG12 VAL B 393 -5.486 -10.014 35.053 1.00 31.26 H new ATOM 0 HG13 VAL B 393 -6.500 -8.833 34.758 1.00 31.26 H new ATOM 0 HG21 VAL B 393 -4.934 -7.546 32.621 1.00 29.48 H new ATOM 0 HG22 VAL B 393 -5.593 -6.679 33.771 1.00 29.48 H new ATOM 0 HG23 VAL B 393 -4.040 -6.562 33.481 1.00 29.48 H new ATOM 1700 N MET B 394 -4.836 -9.234 37.764 1.00 28.31 N ATOM 1701 CA MET B 394 -4.768 -10.516 38.440 1.00 28.70 C ATOM 1702 C MET B 394 -5.973 -11.342 38.023 1.00 27.56 C ATOM 1703 O MET B 394 -7.095 -10.849 38.038 1.00 26.28 O ATOM 1704 CB MET B 394 -4.741 -10.355 39.957 1.00 28.65 C ATOM 1705 CG MET B 394 -3.395 -9.905 40.509 1.00 30.87 C ATOM 1706 SD MET B 394 -3.252 -10.353 42.242 1.00 33.42 S ATOM 1707 CE MET B 394 -1.680 -9.601 42.622 1.00 31.00 C ATOM 0 H MET B 394 -5.496 -8.737 38.004 1.00 28.31 H new ATOM 0 HA MET B 394 -3.945 -10.962 38.186 1.00 28.70 H new ATOM 0 HB2 MET B 394 -5.418 -9.711 40.217 1.00 28.65 H new ATOM 0 HB3 MET B 394 -4.982 -11.200 40.367 1.00 28.65 H new ATOM 0 HG2 MET B 394 -2.677 -10.315 40.002 1.00 30.87 H new ATOM 0 HG3 MET B 394 -3.301 -8.945 40.408 1.00 30.87 H new ATOM 0 HE1 MET B 394 -1.460 -9.763 43.553 1.00 31.00 H new ATOM 0 HE2 MET B 394 -0.992 -9.985 42.056 1.00 31.00 H new ATOM 0 HE3 MET B 394 -1.732 -8.645 42.464 1.00 31.00 H new ATOM 1708 N GLU B 395 -5.732 -12.599 37.657 1.00 27.39 N ATOM 1709 CA GLU B 395 -6.804 -13.497 37.253 1.00 27.71 C ATOM 1710 C GLU B 395 -6.656 -14.832 37.961 1.00 27.62 C ATOM 1711 O GLU B 395 -5.651 -15.522 37.779 1.00 27.32 O ATOM 1712 CB GLU B 395 -6.812 -13.693 35.721 1.00 27.65 C ATOM 0 H GLU B 395 -4.948 -12.951 37.637 1.00 27.39 H new ATOM 0 HA GLU B 395 -7.651 -13.099 37.507 1.00 27.71 H new ATOM 1713 N ASN B 396 -7.653 -15.167 38.784 1.00 29.73 N ATOM 1714 CA ASN B 396 -7.755 -16.464 39.453 1.00 30.50 C ATOM 1715 C ASN B 396 -6.529 -16.770 40.321 1.00 30.00 C ATOM 1716 O ASN B 396 -6.125 -17.937 40.463 1.00 29.34 O ATOM 1717 CB ASN B 396 -7.983 -17.571 38.398 1.00 31.94 C ATOM 1718 CG ASN B 396 -8.248 -18.943 39.009 1.00 35.16 C ATOM 1719 OD1 ASN B 396 -7.620 -19.932 38.620 1.00 41.08 O ATOM 1720 ND2 ASN B 396 -9.175 -19.011 39.963 1.00 38.94 N ATOM 0 H ASN B 396 -8.302 -14.634 38.972 1.00 29.73 H new ATOM 0 HA ASN B 396 -8.514 -16.433 40.056 1.00 30.50 H new ATOM 0 HB2 ASN B 396 -8.734 -17.324 37.836 1.00 31.94 H new ATOM 0 HB3 ASN B 396 -7.204 -17.625 37.822 1.00 31.94 H new ATOM 0 HD21 ASN B 396 -9.356 -19.766 40.334 1.00 38.94 H new ATOM 0 HD22 ASN B 396 -9.592 -18.300 40.208 1.00 38.94 H new ATOM 1721 N VAL B 397 -5.956 -15.725 40.918 1.00 29.46 N ATOM 1722 CA VAL B 397 -4.694 -15.856 41.644 1.00 29.04 C ATOM 1723 C VAL B 397 -4.848 -16.449 43.049 1.00 29.38 C ATOM 1724 O VAL B 397 -5.592 -15.922 43.899 1.00 29.19 O ATOM 1725 CB VAL B 397 -3.900 -14.533 41.700 1.00 29.47 C ATOM 1726 CG1 VAL B 397 -2.697 -14.666 42.622 1.00 30.40 C ATOM 1727 CG2 VAL B 397 -3.449 -14.124 40.302 1.00 28.35 C ATOM 0 H VAL B 397 -6.283 -14.930 40.914 1.00 29.46 H new ATOM 0 HA VAL B 397 -4.181 -16.494 41.124 1.00 29.04 H new ATOM 0 HB VAL B 397 -4.483 -13.844 42.054 1.00 29.47 H new ATOM 0 HG11 VAL B 397 -2.212 -13.826 42.644 1.00 30.40 H new ATOM 0 HG12 VAL B 397 -2.998 -14.889 43.517 1.00 30.40 H new ATOM 0 HG13 VAL B 397 -2.113 -15.368 42.294 1.00 30.40 H new ATOM 0 HG21 VAL B 397 -2.952 -13.292 40.352 1.00 28.35 H new ATOM 0 HG22 VAL B 397 -2.882 -14.817 39.929 1.00 28.35 H new ATOM 0 HG23 VAL B 397 -4.226 -14.002 39.734 1.00 28.35 H new ATOM 1728 N THR B 398 -4.133 -17.557 43.259 1.00 29.10 N ATOM 1729 CA THR B 398 -3.959 -18.175 44.579 1.00 29.11 C ATOM 1730 C THR B 398 -2.474 -18.287 44.873 1.00 28.25 C ATOM 1731 O THR B 398 -1.677 -18.492 43.964 1.00 30.08 O ATOM 1732 CB THR B 398 -4.649 -19.550 44.645 1.00 29.49 C ATOM 1733 OG1 THR B 398 -6.066 -19.350 44.595 1.00 29.38 O ATOM 1734 CG2 THR B 398 -4.293 -20.304 45.937 1.00 29.32 C ATOM 0 H THR B 398 -3.728 -17.978 42.628 1.00 29.10 H new ATOM 0 HA THR B 398 -4.378 -17.619 45.254 1.00 29.11 H new ATOM 0 HB THR B 398 -4.344 -20.084 43.895 1.00 29.49 H new ATOM 0 HG1 THR B 398 -6.455 -20.093 44.629 1.00 29.38 H new ATOM 0 HG21 THR B 398 -4.743 -21.163 45.945 1.00 29.32 H new ATOM 0 HG22 THR B 398 -3.334 -20.442 45.978 1.00 29.32 H new ATOM 0 HG23 THR B 398 -4.577 -19.783 46.705 1.00 29.32 H new ATOM 1735 N ALA B 399 -2.086 -18.091 46.127 1.00 28.33 N ATOM 1736 CA ALA B 399 -0.671 -18.177 46.495 1.00 27.21 C ATOM 1737 C ALA B 399 -0.476 -18.593 47.935 1.00 27.36 C ATOM 1738 O ALA B 399 -1.314 -18.321 48.781 1.00 26.62 O ATOM 1739 CB ALA B 399 0.050 -16.872 46.225 1.00 27.50 C ATOM 0 H ALA B 399 -2.618 -17.908 46.778 1.00 28.33 H new ATOM 0 HA ALA B 399 -0.284 -18.868 45.935 1.00 27.21 H new ATOM 0 HB1 ALA B 399 0.982 -16.959 46.478 1.00 27.50 H new ATOM 0 HB2 ALA B 399 -0.010 -16.658 45.281 1.00 27.50 H new ATOM 0 HB3 ALA B 399 -0.360 -16.162 46.743 1.00 27.50 H new ATOM 1740 N PHE B 400 0.654 -19.258 48.175 1.00 27.45 N ATOM 1741 CA PHE B 400 1.051 -19.769 49.482 1.00 28.60 C ATOM 1742 C PHE B 400 2.414 -19.167 49.789 1.00 27.91 C ATOM 1743 O PHE B 400 3.280 -19.124 48.911 1.00 27.47 O ATOM 1744 CB PHE B 400 1.195 -21.316 49.441 1.00 29.05 C ATOM 1745 CG PHE B 400 -0.085 -22.054 49.090 1.00 31.63 C ATOM 1746 CD1 PHE B 400 -0.521 -22.138 47.774 1.00 32.71 C ATOM 1747 CD2 PHE B 400 -0.825 -22.700 50.077 1.00 33.73 C ATOM 1748 CE1 PHE B 400 -1.701 -22.813 47.448 1.00 33.71 C ATOM 1749 CE2 PHE B 400 -2.006 -23.385 49.767 1.00 34.92 C ATOM 1750 CZ PHE B 400 -2.442 -23.442 48.446 1.00 34.59 C ATOM 0 H PHE B 400 1.229 -19.429 47.558 1.00 27.45 H new ATOM 0 HA PHE B 400 0.387 -19.538 50.150 1.00 28.60 H new ATOM 0 HB2 PHE B 400 1.878 -21.550 48.794 1.00 29.05 H new ATOM 0 HB3 PHE B 400 1.507 -21.624 50.306 1.00 29.05 H new ATOM 0 HD1 PHE B 400 -0.020 -21.739 47.099 1.00 32.71 H new ATOM 0 HD2 PHE B 400 -0.529 -22.676 50.958 1.00 33.73 H new ATOM 0 HE1 PHE B 400 -1.991 -22.842 46.565 1.00 33.71 H new ATOM 0 HE2 PHE B 400 -2.496 -23.800 50.440 1.00 34.92 H new ATOM 0 HZ PHE B 400 -3.224 -23.898 48.231 1.00 34.59 H new ATOM 1751 N TRP B 401 2.625 -18.723 51.025 1.00 28.12 N ATOM 1752 CA TRP B 401 3.975 -18.357 51.449 1.00 30.10 C ATOM 1753 C TRP B 401 4.858 -19.581 51.691 1.00 33.46 C ATOM 1754 O TRP B 401 6.084 -19.535 51.466 1.00 34.56 O ATOM 1755 CB TRP B 401 3.964 -17.445 52.668 1.00 28.96 C ATOM 1756 CG TRP B 401 3.815 -15.961 52.339 1.00 25.60 C ATOM 1757 CD1 TRP B 401 2.752 -15.166 52.663 1.00 26.12 C ATOM 1758 CD2 TRP B 401 4.749 -15.117 51.652 1.00 25.18 C ATOM 1759 NE1 TRP B 401 2.968 -13.880 52.224 1.00 25.71 N ATOM 1760 CE2 TRP B 401 4.180 -13.822 51.593 1.00 25.34 C ATOM 1761 CE3 TRP B 401 6.010 -15.322 51.080 1.00 24.09 C ATOM 1762 CZ2 TRP B 401 4.835 -12.740 50.994 1.00 26.32 C ATOM 1763 CZ3 TRP B 401 6.651 -14.254 50.479 1.00 25.44 C ATOM 1764 CH2 TRP B 401 6.063 -12.978 50.435 1.00 27.27 C ATOM 0 H TRP B 401 2.015 -18.627 51.623 1.00 28.12 H new ATOM 0 HA TRP B 401 4.364 -17.859 50.713 1.00 30.10 H new ATOM 0 HB2 TRP B 401 3.236 -17.711 53.252 1.00 28.96 H new ATOM 0 HB3 TRP B 401 4.788 -17.575 53.164 1.00 28.96 H new ATOM 0 HD1 TRP B 401 1.992 -15.453 53.115 1.00 26.12 H new ATOM 0 HE1 TRP B 401 2.428 -13.219 52.329 1.00 25.71 H new ATOM 0 HE3 TRP B 401 6.410 -16.161 51.104 1.00 24.09 H new ATOM 0 HZ2 TRP B 401 4.452 -11.893 50.976 1.00 26.32 H new ATOM 0 HZ3 TRP B 401 7.489 -14.383 50.096 1.00 25.44 H new ATOM 0 HH2 TRP B 401 6.517 -12.281 50.018 1.00 27.27 H new ATOM 1765 N GLU B 402 4.237 -20.674 52.120 1.00 36.36 N ATOM 1766 CA GLU B 402 4.964 -21.929 52.333 1.00 39.49 C ATOM 1767 C GLU B 402 4.222 -23.128 51.726 1.00 40.75 C ATOM 1768 O GLU B 402 3.033 -23.343 51.981 1.00 41.31 O ATOM 1769 CB GLU B 402 5.265 -22.136 53.826 1.00 39.82 C ATOM 0 H GLU B 402 3.396 -20.714 52.295 1.00 36.36 H new ATOM 0 HA GLU B 402 5.812 -21.864 51.867 1.00 39.49 H new ATOM 1770 N GLU B 403 4.950 -23.899 50.923 1.00 43.72 N ATOM 1771 CA GLU B 403 4.394 -24.972 50.077 1.00 45.41 C ATOM 1772 C GLU B 403 3.382 -25.905 50.751 1.00 46.53 C ATOM 1773 O GLU B 403 2.479 -26.432 50.084 1.00 47.02 O ATOM 1774 CB GLU B 403 5.527 -25.789 49.437 1.00 45.69 C ATOM 0 H GLU B 403 5.803 -23.816 50.848 1.00 43.72 H new ATOM 0 HA GLU B 403 3.880 -24.504 49.401 1.00 45.41 H new ATOM 1775 N GLY B 404 3.515 -26.098 52.061 1.00 47.16 N ATOM 1776 CA GLY B 404 2.616 -26.992 52.785 1.00 47.52 C ATOM 1777 C GLY B 404 1.436 -26.333 53.478 1.00 47.88 C ATOM 1778 O GLY B 404 0.461 -27.009 53.836 1.00 48.72 O ATOM 0 H GLY B 404 4.117 -25.722 52.547 1.00 47.16 H new ATOM 0 HA2 GLY B 404 2.275 -27.652 52.162 1.00 47.52 H new ATOM 0 HA3 GLY B 404 3.133 -27.471 53.451 1.00 47.52 H new ATOM 1779 N GLY B 437 1.507 -25.014 53.655 1.00 46.96 N ATOM 1780 CA GLY B 437 0.562 -24.304 54.512 1.00 45.13 C ATOM 1781 C GLY B 437 -0.805 -24.026 53.921 1.00 44.04 C ATOM 1782 O GLY B 437 -1.244 -24.698 52.980 1.00 44.56 O ATOM 0 H GLY B 437 2.099 -24.511 53.285 1.00 46.96 H new ATOM 0 HA2 GLY B 437 0.443 -24.819 55.325 1.00 45.13 H new ATOM 0 HA3 GLY B 437 0.960 -23.458 54.768 1.00 45.13 H new ATOM 1783 N THR B 438 -1.486 -23.038 54.503 1.00 42.06 N ATOM 1784 CA THR B 438 -2.756 -22.520 53.977 1.00 40.86 C ATOM 1785 C THR B 438 -2.468 -21.381 52.955 1.00 38.04 C ATOM 1786 O THR B 438 -1.411 -20.750 53.026 1.00 37.30 O ATOM 1787 CB THR B 438 -3.673 -22.054 55.124 1.00 40.97 C ATOM 1788 OG1 THR B 438 -5.023 -21.966 54.663 1.00 44.65 O ATOM 1789 CG2 THR B 438 -3.236 -20.705 55.682 1.00 42.19 C ATOM 0 H THR B 438 -1.223 -22.644 55.221 1.00 42.06 H new ATOM 0 HA THR B 438 -3.229 -23.229 53.513 1.00 40.86 H new ATOM 0 HB THR B 438 -3.609 -22.709 55.837 1.00 40.97 H new ATOM 0 HG1 THR B 438 -5.518 -21.713 55.293 1.00 44.65 H new ATOM 0 HG21 THR B 438 -3.833 -20.443 56.400 1.00 42.19 H new ATOM 0 HG22 THR B 438 -2.331 -20.774 56.024 1.00 42.19 H new ATOM 0 HG23 THR B 438 -3.265 -20.038 54.978 1.00 42.19 H new ATOM 1790 N PRO B 439 -3.371 -21.152 51.973 1.00 35.77 N ATOM 1791 CA PRO B 439 -3.089 -20.040 51.049 1.00 33.73 C ATOM 1792 C PRO B 439 -3.186 -18.643 51.680 1.00 31.86 C ATOM 1793 O PRO B 439 -4.143 -18.323 52.401 1.00 31.61 O ATOM 1794 CB PRO B 439 -4.140 -20.213 49.946 1.00 33.41 C ATOM 1795 CG PRO B 439 -5.231 -20.930 50.575 1.00 35.68 C ATOM 1796 CD PRO B 439 -4.603 -21.867 51.591 1.00 35.75 C ATOM 0 HA PRO B 439 -2.171 -20.081 50.738 1.00 33.73 H new ATOM 0 HB2 PRO B 439 -4.435 -19.354 49.604 1.00 33.41 H new ATOM 0 HB3 PRO B 439 -3.781 -20.709 49.194 1.00 33.41 H new ATOM 0 HG2 PRO B 439 -5.845 -20.315 51.006 1.00 35.68 H new ATOM 0 HG3 PRO B 439 -5.742 -21.427 49.917 1.00 35.68 H new ATOM 0 HD2 PRO B 439 -5.185 -22.015 52.353 1.00 35.75 H new ATOM 0 HD3 PRO B 439 -4.411 -22.737 51.208 1.00 35.75 H new ATOM 1797 N VAL B 440 -2.195 -17.812 51.398 1.00 29.19 N ATOM 1798 CA VAL B 440 -2.230 -16.444 51.895 1.00 27.61 C ATOM 1799 C VAL B 440 -3.213 -15.602 51.061 1.00 26.17 C ATOM 1800 O VAL B 440 -3.816 -14.661 51.564 1.00 25.92 O ATOM 1801 CB VAL B 440 -0.799 -15.835 51.976 1.00 27.25 C ATOM 1802 CG1 VAL B 440 -0.205 -15.631 50.573 1.00 27.04 C ATOM 1803 CG2 VAL B 440 -0.799 -14.528 52.771 1.00 27.60 C ATOM 0 H VAL B 440 -1.503 -18.014 50.929 1.00 29.19 H new ATOM 0 HA VAL B 440 -2.564 -16.442 52.806 1.00 27.61 H new ATOM 0 HB VAL B 440 -0.234 -16.467 52.448 1.00 27.25 H new ATOM 0 HG11 VAL B 440 0.684 -15.252 50.650 1.00 27.04 H new ATOM 0 HG12 VAL B 440 -0.153 -16.485 50.116 1.00 27.04 H new ATOM 0 HG13 VAL B 440 -0.771 -15.027 50.066 1.00 27.04 H new ATOM 0 HG21 VAL B 440 0.102 -14.170 52.806 1.00 27.60 H new ATOM 0 HG22 VAL B 440 -1.384 -13.886 52.339 1.00 27.60 H new ATOM 0 HG23 VAL B 440 -1.115 -14.697 53.672 1.00 27.60 H new ATOM 1804 N LEU B 441 -3.385 -15.958 49.788 1.00 26.10 N ATOM 1805 CA LEU B 441 -4.353 -15.287 48.908 1.00 24.73 C ATOM 1806 C LEU B 441 -5.069 -16.333 48.080 1.00 24.60 C ATOM 1807 O LEU B 441 -4.439 -17.288 47.647 1.00 24.42 O ATOM 1808 CB LEU B 441 -3.653 -14.275 47.996 1.00 24.59 C ATOM 1809 CG LEU B 441 -2.982 -13.073 48.672 1.00 25.58 C ATOM 1810 CD1 LEU B 441 -1.978 -12.486 47.723 1.00 26.95 C ATOM 1811 CD2 LEU B 441 -4.004 -12.051 49.099 1.00 26.95 C ATOM 0 H LEU B 441 -2.947 -16.593 49.408 1.00 26.10 H new ATOM 0 HA LEU B 441 -4.994 -14.802 49.451 1.00 24.73 H new ATOM 0 HB2 LEU B 441 -2.978 -14.748 47.484 1.00 24.59 H new ATOM 0 HB3 LEU B 441 -4.306 -13.938 47.363 1.00 24.59 H new ATOM 0 HG LEU B 441 -2.526 -13.364 49.477 1.00 25.58 H new ATOM 0 HD11 LEU B 441 -1.546 -11.724 48.139 1.00 26.95 H new ATOM 0 HD12 LEU B 441 -1.311 -13.155 47.503 1.00 26.95 H new ATOM 0 HD13 LEU B 441 -2.427 -12.199 46.913 1.00 26.95 H new ATOM 0 HD21 LEU B 441 -3.556 -11.302 49.523 1.00 26.95 H new ATOM 0 HD22 LEU B 441 -4.492 -11.737 48.322 1.00 26.95 H new ATOM 0 HD23 LEU B 441 -4.623 -12.455 49.728 1.00 26.95 H new ATOM 1812 N LYS B 442 -6.379 -16.157 47.887 1.00 25.81 N ATOM 1813 CA LYS B 442 -7.215 -17.191 47.299 1.00 27.31 C ATOM 1814 C LYS B 442 -8.210 -16.612 46.316 1.00 26.66 C ATOM 1815 O LYS B 442 -9.020 -15.760 46.689 1.00 27.14 O ATOM 1816 CB LYS B 442 -7.965 -17.972 48.396 1.00 28.49 C ATOM 0 H LYS B 442 -6.801 -15.437 48.094 1.00 25.81 H new ATOM 0 HA LYS B 442 -6.629 -17.796 46.818 1.00 27.31 H new ATOM 1817 N ASP B 443 -8.138 -17.092 45.071 1.00 25.88 N ATOM 1818 CA ASP B 443 -9.009 -16.656 43.966 1.00 26.40 C ATOM 1819 C ASP B 443 -9.118 -15.129 43.834 1.00 26.13 C ATOM 1820 O ASP B 443 -10.216 -14.571 43.870 1.00 28.11 O ATOM 1821 CB ASP B 443 -10.411 -17.286 44.080 1.00 26.19 C ATOM 0 H ASP B 443 -7.570 -17.694 44.838 1.00 25.88 H new ATOM 0 HA ASP B 443 -8.581 -16.973 43.155 1.00 26.40 H new ATOM 1822 N ILE B 444 -7.979 -14.464 43.677 1.00 26.31 N ATOM 1823 CA ILE B 444 -7.958 -13.005 43.549 1.00 25.35 C ATOM 1824 C ILE B 444 -8.084 -12.567 42.081 1.00 25.62 C ATOM 1825 O ILE B 444 -7.376 -13.063 41.197 1.00 25.36 O ATOM 1826 CB ILE B 444 -6.674 -12.361 44.188 1.00 25.37 C ATOM 1827 CG1 ILE B 444 -6.457 -12.838 45.630 1.00 24.54 C ATOM 1828 CG2 ILE B 444 -6.721 -10.813 44.101 1.00 22.55 C ATOM 1829 CD1 ILE B 444 -7.564 -12.456 46.599 1.00 26.26 C ATOM 0 H ILE B 444 -7.205 -14.837 43.642 1.00 26.31 H new ATOM 0 HA ILE B 444 -8.728 -12.683 44.042 1.00 25.35 H new ATOM 0 HB ILE B 444 -5.910 -12.661 43.671 1.00 25.37 H new ATOM 0 HG12 ILE B 444 -6.365 -13.804 45.628 1.00 24.54 H new ATOM 0 HG13 ILE B 444 -5.619 -12.474 45.956 1.00 24.54 H new ATOM 0 HG21 ILE B 444 -5.919 -10.442 44.501 1.00 22.55 H new ATOM 0 HG22 ILE B 444 -6.773 -10.542 43.171 1.00 22.55 H new ATOM 0 HG23 ILE B 444 -7.501 -10.486 44.576 1.00 22.55 H new ATOM 0 HD11 ILE B 444 -7.351 -12.793 47.483 1.00 26.26 H new ATOM 0 HD12 ILE B 444 -7.646 -11.490 46.633 1.00 26.26 H new ATOM 0 HD13 ILE B 444 -8.403 -12.841 46.300 1.00 26.26 H new ATOM 1830 N ASN B 445 -8.981 -11.617 41.863 1.00 26.73 N ATOM 1831 CA ASN B 445 -9.276 -11.062 40.547 1.00 27.84 C ATOM 1832 C ASN B 445 -9.438 -9.548 40.648 1.00 28.11 C ATOM 1833 O ASN B 445 -10.271 -9.060 41.412 1.00 27.55 O ATOM 1834 CB ASN B 445 -10.582 -11.649 39.998 1.00 28.60 C ATOM 1835 CG ASN B 445 -10.477 -13.122 39.666 1.00 28.73 C ATOM 1836 OD1 ASN B 445 -9.860 -13.499 38.675 1.00 36.47 O ATOM 1837 ND2 ASN B 445 -11.072 -13.964 40.504 1.00 32.83 N ATOM 0 H ASN B 445 -9.449 -11.266 42.493 1.00 26.73 H new ATOM 0 HA ASN B 445 -8.542 -11.284 39.954 1.00 27.84 H new ATOM 0 HB2 ASN B 445 -11.288 -11.520 40.650 1.00 28.60 H new ATOM 0 HB3 ASN B 445 -10.840 -11.161 39.200 1.00 28.60 H new ATOM 0 HD21 ASN B 445 -11.033 -14.811 40.362 1.00 32.83 H new ATOM 0 HD22 ASN B 445 -11.496 -13.662 41.189 1.00 32.83 H new ATOM 1838 N PHE B 446 -8.648 -8.824 39.860 1.00 28.28 N ATOM 1839 CA PHE B 446 -8.865 -7.394 39.625 1.00 27.41 C ATOM 1840 C PHE B 446 -8.041 -6.931 38.432 1.00 26.93 C ATOM 1841 O PHE B 446 -7.205 -7.669 37.909 1.00 26.97 O ATOM 1842 CB PHE B 446 -8.534 -6.552 40.870 1.00 26.38 C ATOM 1843 CG PHE B 446 -7.078 -6.543 41.222 1.00 25.72 C ATOM 1844 CD1 PHE B 446 -6.214 -5.631 40.633 1.00 24.55 C ATOM 1845 CD2 PHE B 446 -6.570 -7.445 42.150 1.00 24.34 C ATOM 1846 CE1 PHE B 446 -4.866 -5.622 40.943 1.00 26.48 C ATOM 1847 CE2 PHE B 446 -5.229 -7.446 42.466 1.00 23.53 C ATOM 1848 CZ PHE B 446 -4.368 -6.533 41.862 1.00 25.81 C ATOM 0 H PHE B 446 -7.968 -9.147 39.444 1.00 28.28 H new ATOM 0 HA PHE B 446 -9.807 -7.264 39.432 1.00 27.41 H new ATOM 0 HB2 PHE B 446 -8.828 -5.640 40.721 1.00 26.38 H new ATOM 0 HB3 PHE B 446 -9.039 -6.893 41.625 1.00 26.38 H new ATOM 0 HD1 PHE B 446 -6.547 -5.016 40.020 1.00 24.55 H new ATOM 0 HD2 PHE B 446 -7.141 -8.053 42.561 1.00 24.34 H new ATOM 0 HE1 PHE B 446 -4.297 -5.008 40.537 1.00 26.48 H new ATOM 0 HE2 PHE B 446 -4.898 -8.057 43.084 1.00 23.53 H new ATOM 0 HZ PHE B 446 -3.463 -6.534 42.074 1.00 25.81 H new ATOM 1849 N LYS B 447 -8.305 -5.705 38.000 1.00 27.65 N ATOM 1850 CA LYS B 447 -7.547 -5.047 36.948 1.00 28.32 C ATOM 1851 C LYS B 447 -7.468 -3.586 37.349 1.00 27.64 C ATOM 1852 O LYS B 447 -8.388 -3.049 37.956 1.00 28.63 O ATOM 1853 CB LYS B 447 -8.241 -5.149 35.580 1.00 28.53 C ATOM 1854 CG LYS B 447 -8.651 -6.547 35.128 1.00 31.18 C ATOM 1855 CD LYS B 447 -9.377 -6.485 33.776 1.00 31.05 C ATOM 1856 CE LYS B 447 -9.768 -7.886 33.300 1.00 37.70 C ATOM 1857 NZ LYS B 447 -10.622 -7.852 32.076 1.00 38.24 N ATOM 0 H LYS B 447 -8.943 -5.223 38.317 1.00 27.65 H new ATOM 0 HA LYS B 447 -6.677 -5.467 36.855 1.00 28.32 H new ATOM 0 HB2 LYS B 447 -9.034 -4.591 35.600 1.00 28.53 H new ATOM 0 HB3 LYS B 447 -7.648 -4.775 34.910 1.00 28.53 H new ATOM 0 HG2 LYS B 447 -7.866 -7.112 35.054 1.00 31.18 H new ATOM 0 HG3 LYS B 447 -9.230 -6.951 35.794 1.00 31.18 H new ATOM 0 HD2 LYS B 447 -10.171 -5.933 33.856 1.00 31.05 H new ATOM 0 HD3 LYS B 447 -8.804 -6.064 33.116 1.00 31.05 H new ATOM 0 HE2 LYS B 447 -8.965 -8.399 33.117 1.00 37.70 H new ATOM 0 HE3 LYS B 447 -10.243 -8.346 34.010 1.00 37.70 H new ATOM 0 HZ1 LYS B 447 -10.826 -8.683 31.833 1.00 38.24 H new ATOM 0 HZ2 LYS B 447 -11.370 -7.401 32.248 1.00 38.24 H new ATOM 0 HZ3 LYS B 447 -10.180 -7.451 31.416 1.00 38.24 H new ATOM 1858 N ILE B 448 -6.364 -2.945 37.012 1.00 27.58 N ATOM 1859 CA ILE B 448 -6.217 -1.533 37.271 1.00 27.65 C ATOM 1860 C ILE B 448 -5.877 -0.869 35.955 1.00 26.96 C ATOM 1861 O ILE B 448 -4.909 -1.248 35.288 1.00 25.85 O ATOM 1862 CB ILE B 448 -5.101 -1.241 38.327 1.00 27.87 C ATOM 1863 CG1 ILE B 448 -5.245 -2.153 39.547 1.00 28.04 C ATOM 1864 CG2 ILE B 448 -5.150 0.225 38.760 1.00 27.78 C ATOM 1865 CD1 ILE B 448 -3.986 -2.224 40.378 1.00 27.56 C ATOM 0 H ILE B 448 -5.687 -3.313 36.631 1.00 27.58 H new ATOM 0 HA ILE B 448 -7.043 -1.184 37.641 1.00 27.65 H new ATOM 0 HB ILE B 448 -4.243 -1.421 37.913 1.00 27.87 H new ATOM 0 HG12 ILE B 448 -5.975 -1.833 40.100 1.00 28.04 H new ATOM 0 HG13 ILE B 448 -5.483 -3.046 39.252 1.00 28.04 H new ATOM 0 HG21 ILE B 448 -4.454 0.393 39.414 1.00 27.78 H new ATOM 0 HG22 ILE B 448 -5.012 0.795 37.988 1.00 27.78 H new ATOM 0 HG23 ILE B 448 -6.016 0.418 39.153 1.00 27.78 H new ATOM 0 HD11 ILE B 448 -4.131 -2.813 41.135 1.00 27.56 H new ATOM 0 HD12 ILE B 448 -3.259 -2.568 39.836 1.00 27.56 H new ATOM 0 HD13 ILE B 448 -3.758 -1.337 40.697 1.00 27.56 H new ATOM 1866 N GLU B 449 -6.695 0.101 35.567 1.00 28.48 N ATOM 1867 CA GLU B 449 -6.422 0.885 34.356 1.00 29.02 C ATOM 1868 C GLU B 449 -5.410 1.966 34.688 1.00 28.95 C ATOM 1869 O GLU B 449 -5.303 2.388 35.840 1.00 28.43 O ATOM 1870 CB GLU B 449 -7.704 1.527 33.796 1.00 29.42 C ATOM 1871 CG GLU B 449 -8.843 0.549 33.492 1.00 33.67 C ATOM 1872 CD GLU B 449 -8.445 -0.545 32.505 1.00 39.03 C ATOM 1873 OE1 GLU B 449 -8.589 -1.746 32.835 1.00 39.30 O ATOM 1874 OE2 GLU B 449 -7.975 -0.206 31.401 1.00 41.83 O ATOM 0 H GLU B 449 -7.412 0.325 35.985 1.00 28.48 H new ATOM 0 HA GLU B 449 -6.070 0.289 33.676 1.00 29.02 H new ATOM 0 HB2 GLU B 449 -8.023 2.186 34.432 1.00 29.42 H new ATOM 0 HB3 GLU B 449 -7.481 2.004 32.982 1.00 29.42 H new ATOM 0 HG2 GLU B 449 -9.139 0.138 34.319 1.00 33.67 H new ATOM 0 HG3 GLU B 449 -9.598 1.041 33.134 1.00 33.67 H new ATOM 1875 N ARG B 450 -4.687 2.432 33.673 1.00 29.32 N ATOM 1876 CA ARG B 450 -3.685 3.476 33.844 1.00 29.48 C ATOM 1877 C ARG B 450 -4.300 4.686 34.524 1.00 28.46 C ATOM 1878 O ARG B 450 -5.379 5.137 34.141 1.00 29.80 O ATOM 1879 CB ARG B 450 -3.088 3.884 32.497 1.00 30.94 C ATOM 1880 CG ARG B 450 -1.650 4.399 32.602 1.00 32.83 C ATOM 1881 CD ARG B 450 -1.241 5.139 31.330 1.00 37.68 C ATOM 0 H ARG B 450 -4.765 2.150 32.864 1.00 29.32 H new ATOM 0 HA ARG B 450 -2.974 3.124 34.402 1.00 29.48 H new ATOM 0 HB2 ARG B 450 -3.109 3.122 31.897 1.00 30.94 H new ATOM 0 HB3 ARG B 450 -3.643 4.573 32.100 1.00 30.94 H new ATOM 0 HG2 ARG B 450 -1.570 4.992 33.365 1.00 32.83 H new ATOM 0 HG3 ARG B 450 -1.047 3.655 32.756 1.00 32.83 H new ATOM 1882 N GLY B 451 -3.628 5.171 35.568 1.00 26.81 N ATOM 1883 CA GLY B 451 -4.039 6.366 36.281 1.00 24.85 C ATOM 1884 C GLY B 451 -5.078 6.151 37.360 1.00 23.07 C ATOM 1885 O GLY B 451 -5.528 7.101 37.984 1.00 21.70 O ATOM 0 H GLY B 451 -2.914 4.808 35.881 1.00 26.81 H new ATOM 0 HA2 GLY B 451 -3.255 6.770 36.684 1.00 24.85 H new ATOM 0 HA3 GLY B 451 -4.388 7.004 35.639 1.00 24.85 H new ATOM 1886 N GLN B 452 -5.467 4.906 37.592 1.00 22.10 N ATOM 1887 CA GLN B 452 -6.468 4.631 38.608 1.00 22.75 C ATOM 1888 C GLN B 452 -5.805 4.469 39.984 1.00 22.78 C ATOM 1889 O GLN B 452 -4.630 4.119 40.088 1.00 22.63 O ATOM 1890 CB GLN B 452 -7.266 3.370 38.273 1.00 23.69 C ATOM 1891 CG GLN B 452 -8.235 3.525 37.083 1.00 25.73 C ATOM 1892 CD GLN B 452 -9.166 2.349 36.969 1.00 28.08 C ATOM 1893 OE1 GLN B 452 -8.741 1.205 37.095 1.00 31.22 O ATOM 1894 NE2 GLN B 452 -10.455 2.618 36.754 1.00 28.62 N ATOM 0 H GLN B 452 -5.168 4.214 37.178 1.00 22.10 H new ATOM 0 HA GLN B 452 -7.078 5.385 38.631 1.00 22.75 H new ATOM 0 HB2 GLN B 452 -6.646 2.650 38.079 1.00 23.69 H new ATOM 0 HB3 GLN B 452 -7.773 3.104 39.056 1.00 23.69 H new ATOM 0 HG2 GLN B 452 -8.752 4.339 37.190 1.00 25.73 H new ATOM 0 HG3 GLN B 452 -7.727 3.617 36.262 1.00 25.73 H new ATOM 0 HE21 GLN B 452 -10.716 3.433 36.671 1.00 28.62 H new ATOM 0 HE22 GLN B 452 -11.025 1.976 36.699 1.00 28.62 H new ATOM 1895 N LEU B 453 -6.594 4.714 41.016 1.00 21.91 N ATOM 1896 CA LEU B 453 -6.231 4.445 42.393 1.00 21.91 C ATOM 1897 C LEU B 453 -7.073 3.261 42.851 1.00 21.51 C ATOM 1898 O LEU B 453 -8.315 3.316 42.844 1.00 22.31 O ATOM 1899 CB LEU B 453 -6.496 5.691 43.263 1.00 22.43 C ATOM 1900 CG LEU B 453 -6.517 5.577 44.802 1.00 22.66 C ATOM 1901 CD1 LEU B 453 -5.117 5.269 45.345 1.00 25.58 C ATOM 1902 CD2 LEU B 453 -7.085 6.859 45.432 1.00 22.27 C ATOM 0 H LEU B 453 -7.380 5.052 40.931 1.00 21.91 H new ATOM 0 HA LEU B 453 -5.287 4.236 42.476 1.00 21.91 H new ATOM 0 HB2 LEU B 453 -5.822 6.350 43.033 1.00 22.43 H new ATOM 0 HB3 LEU B 453 -7.353 6.054 42.990 1.00 22.43 H new ATOM 0 HG LEU B 453 -7.098 4.840 45.045 1.00 22.66 H new ATOM 0 HD11 LEU B 453 -5.152 5.202 46.312 1.00 25.58 H new ATOM 0 HD12 LEU B 453 -4.803 4.429 44.974 1.00 25.58 H new ATOM 0 HD13 LEU B 453 -4.508 5.981 45.093 1.00 25.58 H new ATOM 0 HD21 LEU B 453 -7.091 6.770 46.398 1.00 22.27 H new ATOM 0 HD22 LEU B 453 -6.532 7.616 45.181 1.00 22.27 H new ATOM 0 HD23 LEU B 453 -7.991 7.002 45.115 1.00 22.27 H new ATOM 1903 N LEU B 454 -6.399 2.170 43.187 1.00 19.88 N ATOM 1904 CA LEU B 454 -7.043 1.023 43.791 1.00 18.81 C ATOM 1905 C LEU B 454 -6.767 1.078 45.285 1.00 19.41 C ATOM 1906 O LEU B 454 -5.606 1.145 45.694 1.00 18.15 O ATOM 1907 CB LEU B 454 -6.509 -0.305 43.187 1.00 19.26 C ATOM 1908 CG LEU B 454 -6.896 -1.610 43.912 1.00 20.55 C ATOM 1909 CD1 LEU B 454 -8.375 -1.959 43.670 1.00 23.09 C ATOM 1910 CD2 LEU B 454 -6.040 -2.803 43.529 1.00 18.97 C ATOM 0 H LEU B 454 -5.552 2.077 43.069 1.00 19.88 H new ATOM 0 HA LEU B 454 -7.997 1.049 43.617 1.00 18.81 H new ATOM 0 HB2 LEU B 454 -6.820 -0.366 42.270 1.00 19.26 H new ATOM 0 HB3 LEU B 454 -5.541 -0.254 43.155 1.00 19.26 H new ATOM 0 HG LEU B 454 -6.740 -1.432 44.853 1.00 20.55 H new ATOM 0 HD11 LEU B 454 -8.594 -2.782 44.135 1.00 23.09 H new ATOM 0 HD12 LEU B 454 -8.936 -1.241 44.003 1.00 23.09 H new ATOM 0 HD13 LEU B 454 -8.529 -2.075 42.719 1.00 23.09 H new ATOM 0 HD21 LEU B 454 -6.337 -3.585 44.020 1.00 18.97 H new ATOM 0 HD22 LEU B 454 -6.123 -2.968 42.577 1.00 18.97 H new ATOM 0 HD23 LEU B 454 -5.113 -2.619 43.745 1.00 18.97 H new ATOM 1911 N ALA B 455 -7.825 1.075 46.098 1.00 20.19 N ATOM 1912 CA ALA B 455 -7.658 0.972 47.548 1.00 21.07 C ATOM 1913 C ALA B 455 -7.759 -0.483 47.969 1.00 20.94 C ATOM 1914 O ALA B 455 -8.661 -1.191 47.548 1.00 20.70 O ATOM 1915 CB ALA B 455 -8.675 1.788 48.261 1.00 22.60 C ATOM 0 H ALA B 455 -8.641 1.131 45.832 1.00 20.19 H new ATOM 0 HA ALA B 455 -6.782 1.315 47.785 1.00 21.07 H new ATOM 0 HB1 ALA B 455 -8.544 1.704 49.218 1.00 22.60 H new ATOM 0 HB2 ALA B 455 -8.582 2.718 48.003 1.00 22.60 H new ATOM 0 HB3 ALA B 455 -9.563 1.475 48.028 1.00 22.60 H new ATOM 1916 N VAL B 456 -6.817 -0.935 48.794 1.00 19.93 N ATOM 1917 CA VAL B 456 -6.868 -2.296 49.294 1.00 19.19 C ATOM 1918 C VAL B 456 -7.084 -2.259 50.796 1.00 20.66 C ATOM 1919 O VAL B 456 -6.257 -1.737 51.553 1.00 20.99 O ATOM 1920 CB VAL B 456 -5.612 -3.104 48.953 1.00 18.34 C ATOM 1921 CG1 VAL B 456 -5.676 -4.491 49.606 1.00 16.26 C ATOM 1922 CG2 VAL B 456 -5.427 -3.208 47.432 1.00 15.52 C ATOM 0 H VAL B 456 -6.148 -0.471 49.071 1.00 19.93 H new ATOM 0 HA VAL B 456 -7.607 -2.747 48.856 1.00 19.19 H new ATOM 0 HB VAL B 456 -4.838 -2.640 49.310 1.00 18.34 H new ATOM 0 HG11 VAL B 456 -4.876 -4.991 49.382 1.00 16.26 H new ATOM 0 HG12 VAL B 456 -5.737 -4.393 50.569 1.00 16.26 H new ATOM 0 HG13 VAL B 456 -6.456 -4.967 49.280 1.00 16.26 H new ATOM 0 HG21 VAL B 456 -4.628 -3.722 47.237 1.00 15.52 H new ATOM 0 HG22 VAL B 456 -6.198 -3.649 47.041 1.00 15.52 H new ATOM 0 HG23 VAL B 456 -5.338 -2.319 47.055 1.00 15.52 H new ATOM 1923 N ALA B 457 -8.209 -2.812 51.206 1.00 20.52 N ATOM 1924 CA ALA B 457 -8.654 -2.715 52.577 1.00 21.38 C ATOM 1925 C ALA B 457 -8.783 -4.120 53.139 1.00 21.00 C ATOM 1926 O ALA B 457 -8.749 -5.105 52.388 1.00 20.26 O ATOM 1927 CB ALA B 457 -9.997 -1.955 52.657 1.00 21.07 C ATOM 0 H ALA B 457 -8.738 -3.256 50.694 1.00 20.52 H new ATOM 0 HA ALA B 457 -8.010 -2.216 53.103 1.00 21.38 H new ATOM 0 HB1 ALA B 457 -10.282 -1.898 53.582 1.00 21.07 H new ATOM 0 HB2 ALA B 457 -9.885 -1.061 52.298 1.00 21.07 H new ATOM 0 HB3 ALA B 457 -10.668 -2.428 52.141 1.00 21.07 H new ATOM 1928 N GLY B 458 -8.885 -4.207 54.461 1.00 21.80 N ATOM 1929 CA GLY B 458 -9.127 -5.488 55.139 1.00 22.97 C ATOM 1930 C GLY B 458 -8.404 -5.471 56.469 1.00 23.98 C ATOM 1931 O GLY B 458 -7.610 -4.582 56.714 1.00 23.16 O ATOM 0 H GLY B 458 -8.817 -3.533 54.991 1.00 21.80 H new ATOM 0 HA2 GLY B 458 -10.078 -5.624 55.274 1.00 22.97 H new ATOM 0 HA3 GLY B 458 -8.810 -6.224 54.592 1.00 22.97 H new ATOM 1932 N SER B 459 -8.698 -6.425 57.343 1.00 25.69 N ATOM 1933 CA SER B 459 -8.173 -6.357 58.706 1.00 26.73 C ATOM 1934 C SER B 459 -6.740 -6.855 58.755 1.00 25.92 C ATOM 1935 O SER B 459 -6.186 -7.324 57.749 1.00 25.14 O ATOM 1936 CB SER B 459 -9.073 -7.135 59.689 1.00 28.34 C ATOM 1937 OG SER B 459 -8.884 -8.523 59.544 1.00 32.02 O ATOM 0 H SER B 459 -9.190 -7.110 57.175 1.00 25.69 H new ATOM 0 HA SER B 459 -8.175 -5.428 58.984 1.00 26.73 H new ATOM 0 HB2 SER B 459 -8.870 -6.870 60.600 1.00 28.34 H new ATOM 0 HB3 SER B 459 -10.003 -6.912 59.529 1.00 28.34 H new ATOM 0 HG SER B 459 -8.809 -8.712 58.729 1.00 32.02 H new ATOM 1938 N THR B 460 -6.128 -6.744 59.928 1.00 25.69 N ATOM 1939 CA THR B 460 -4.770 -7.227 60.087 1.00 25.31 C ATOM 1940 C THR B 460 -4.662 -8.711 59.692 1.00 25.37 C ATOM 1941 O THR B 460 -5.455 -9.540 60.117 1.00 26.31 O ATOM 1942 CB THR B 460 -4.202 -6.951 61.501 1.00 25.66 C ATOM 1943 OG1 THR B 460 -2.859 -7.428 61.536 1.00 25.29 O ATOM 1944 CG2 THR B 460 -5.005 -7.681 62.583 1.00 25.14 C ATOM 0 H THR B 460 -6.478 -6.397 60.633 1.00 25.69 H new ATOM 0 HA THR B 460 -4.212 -6.721 59.476 1.00 25.31 H new ATOM 0 HB THR B 460 -4.251 -5.998 61.677 1.00 25.66 H new ATOM 0 HG1 THR B 460 -2.428 -7.099 60.895 1.00 25.29 H new ATOM 0 HG21 THR B 460 -4.625 -7.488 63.454 1.00 25.14 H new ATOM 0 HG22 THR B 460 -5.927 -7.381 62.560 1.00 25.14 H new ATOM 0 HG23 THR B 460 -4.972 -8.637 62.421 1.00 25.14 H new ATOM 1945 N GLY B 461 -3.707 -9.021 58.825 1.00 25.34 N ATOM 1946 CA GLY B 461 -3.477 -10.395 58.370 1.00 24.42 C ATOM 1947 C GLY B 461 -4.318 -10.882 57.195 1.00 23.98 C ATOM 1948 O GLY B 461 -4.249 -12.060 56.842 1.00 24.04 O ATOM 0 H GLY B 461 -3.171 -8.443 58.481 1.00 25.34 H new ATOM 0 HA2 GLY B 461 -2.542 -10.480 58.128 1.00 24.42 H new ATOM 0 HA3 GLY B 461 -3.631 -10.991 59.119 1.00 24.42 H new ATOM 1949 N ALA B 462 -5.079 -9.988 56.561 1.00 23.30 N ATOM 1950 CA ALA B 462 -5.973 -10.386 55.463 1.00 23.51 C ATOM 1951 C ALA B 462 -5.223 -10.717 54.177 1.00 22.74 C ATOM 1952 O ALA B 462 -5.769 -11.372 53.287 1.00 22.99 O ATOM 1953 CB ALA B 462 -7.035 -9.318 55.201 1.00 23.12 C ATOM 0 H ALA B 462 -5.095 -9.149 56.748 1.00 23.30 H new ATOM 0 HA ALA B 462 -6.412 -11.201 55.753 1.00 23.51 H new ATOM 0 HB1 ALA B 462 -7.610 -9.605 54.474 1.00 23.12 H new ATOM 0 HB2 ALA B 462 -7.567 -9.187 56.001 1.00 23.12 H new ATOM 0 HB3 ALA B 462 -6.603 -8.484 54.961 1.00 23.12 H new ATOM 1954 N GLY B 463 -3.983 -10.237 54.081 1.00 20.75 N ATOM 1955 CA GLY B 463 -3.114 -10.522 52.953 1.00 20.16 C ATOM 1956 C GLY B 463 -2.801 -9.313 52.089 1.00 18.33 C ATOM 1957 O GLY B 463 -2.394 -9.472 50.948 1.00 18.50 O ATOM 0 H GLY B 463 -3.624 -9.732 54.678 1.00 20.75 H new ATOM 0 HA2 GLY B 463 -2.282 -10.895 53.284 1.00 20.16 H new ATOM 0 HA3 GLY B 463 -3.530 -11.203 52.401 1.00 20.16 H new ATOM 1958 N LYS B 464 -2.982 -8.112 52.636 1.00 17.30 N ATOM 1959 CA LYS B 464 -2.813 -6.866 51.868 1.00 15.85 C ATOM 1960 C LYS B 464 -1.397 -6.676 51.376 1.00 15.94 C ATOM 1961 O LYS B 464 -1.187 -6.476 50.175 1.00 15.99 O ATOM 1962 CB LYS B 464 -3.299 -5.637 52.672 1.00 15.58 C ATOM 1963 CG LYS B 464 -4.746 -5.740 53.118 1.00 15.75 C ATOM 1964 CD LYS B 464 -5.260 -4.524 53.919 1.00 15.90 C ATOM 1965 CE LYS B 464 -4.489 -4.309 55.223 1.00 20.20 C ATOM 1966 NZ LYS B 464 -4.763 -5.361 56.225 1.00 22.30 N ATOM 0 H LYS B 464 -3.205 -7.991 53.458 1.00 17.30 H new ATOM 0 HA LYS B 464 -3.373 -6.948 51.080 1.00 15.85 H new ATOM 0 HB2 LYS B 464 -2.734 -5.526 53.453 1.00 15.58 H new ATOM 0 HB3 LYS B 464 -3.191 -4.841 52.129 1.00 15.58 H new ATOM 0 HG2 LYS B 464 -5.306 -5.856 52.335 1.00 15.75 H new ATOM 0 HG3 LYS B 464 -4.849 -6.537 53.661 1.00 15.75 H new ATOM 0 HD2 LYS B 464 -5.190 -3.727 53.371 1.00 15.90 H new ATOM 0 HD3 LYS B 464 -6.201 -4.648 54.120 1.00 15.90 H new ATOM 0 HE2 LYS B 464 -3.538 -4.288 55.033 1.00 20.20 H new ATOM 0 HE3 LYS B 464 -4.723 -3.444 55.595 1.00 20.20 H new ATOM 0 HZ1 LYS B 464 -4.202 -5.272 56.910 1.00 22.30 H new ATOM 0 HZ2 LYS B 464 -5.601 -5.284 56.516 1.00 22.30 H new ATOM 0 HZ3 LYS B 464 -4.651 -6.162 55.853 1.00 22.30 H new ATOM 1967 N THR B 465 -0.422 -6.742 52.293 1.00 17.14 N ATOM 1968 CA THR B 465 0.993 -6.654 51.930 1.00 16.28 C ATOM 1969 C THR B 465 1.393 -7.814 51.017 1.00 16.50 C ATOM 1970 O THR B 465 2.119 -7.604 50.042 1.00 16.40 O ATOM 1971 CB THR B 465 1.926 -6.567 53.190 1.00 16.97 C ATOM 1972 OG1 THR B 465 1.628 -5.364 53.925 1.00 16.71 O ATOM 1973 CG2 THR B 465 3.431 -6.542 52.808 1.00 17.71 C ATOM 0 H THR B 465 -0.565 -6.838 53.136 1.00 17.14 H new ATOM 0 HA THR B 465 1.114 -5.827 51.438 1.00 16.28 H new ATOM 0 HB THR B 465 1.759 -7.358 53.725 1.00 16.97 H new ATOM 0 HG21 THR B 465 3.969 -6.488 53.614 1.00 17.71 H new ATOM 0 HG22 THR B 465 3.656 -7.352 52.323 1.00 17.71 H new ATOM 0 HG23 THR B 465 3.610 -5.771 52.248 1.00 17.71 H new ATOM 1974 N SER B 466 0.942 -9.033 51.341 1.00 15.97 N ATOM 1975 CA SER B 466 1.224 -10.185 50.501 1.00 16.09 C ATOM 1976 C SER B 466 0.791 -9.937 49.037 1.00 17.46 C ATOM 1977 O SER B 466 1.493 -10.320 48.103 1.00 18.15 O ATOM 1978 CB SER B 466 0.561 -11.439 51.091 1.00 16.59 C ATOM 1979 OG SER B 466 1.134 -11.678 52.369 1.00 17.02 O ATOM 0 H SER B 466 0.474 -9.205 52.041 1.00 15.97 H new ATOM 0 HA SER B 466 2.183 -10.330 50.485 1.00 16.09 H new ATOM 0 HB2 SER B 466 -0.398 -11.312 51.167 1.00 16.59 H new ATOM 0 HB3 SER B 466 0.700 -12.202 50.509 1.00 16.59 H new ATOM 0 HG SER B 466 0.703 -11.256 52.953 1.00 17.02 H new ATOM 1980 N LEU B 467 -0.352 -9.277 48.848 1.00 18.33 N ATOM 1981 CA LEU B 467 -0.821 -8.913 47.506 1.00 18.88 C ATOM 1982 C LEU B 467 0.160 -8.004 46.791 1.00 19.00 C ATOM 1983 O LEU B 467 0.450 -8.215 45.603 1.00 18.46 O ATOM 1984 CB LEU B 467 -2.199 -8.254 47.561 1.00 19.99 C ATOM 1985 CG LEU B 467 -2.882 -7.915 46.226 1.00 22.69 C ATOM 1986 CD1 LEU B 467 -3.621 -9.129 45.756 1.00 25.50 C ATOM 1987 CD2 LEU B 467 -3.854 -6.779 46.438 1.00 24.88 C ATOM 0 H LEU B 467 -0.874 -9.029 49.485 1.00 18.33 H new ATOM 0 HA LEU B 467 -0.889 -9.738 47.001 1.00 18.88 H new ATOM 0 HB2 LEU B 467 -2.791 -8.840 48.059 1.00 19.99 H new ATOM 0 HB3 LEU B 467 -2.117 -7.433 48.071 1.00 19.99 H new ATOM 0 HG LEU B 467 -2.223 -7.650 45.566 1.00 22.69 H new ATOM 0 HD11 LEU B 467 -4.060 -8.935 44.913 1.00 25.50 H new ATOM 0 HD12 LEU B 467 -2.997 -9.861 45.634 1.00 25.50 H new ATOM 0 HD13 LEU B 467 -4.286 -9.379 46.416 1.00 25.50 H new ATOM 0 HD21 LEU B 467 -4.287 -6.562 45.598 1.00 24.88 H new ATOM 0 HD22 LEU B 467 -4.524 -7.043 47.088 1.00 24.88 H new ATOM 0 HD23 LEU B 467 -3.376 -6.001 46.765 1.00 24.88 H new ATOM 1988 N LEU B 468 0.662 -6.986 47.498 1.00 18.42 N ATOM 1989 CA LEU B 468 1.720 -6.135 46.970 1.00 18.69 C ATOM 1990 C LEU B 468 2.973 -6.936 46.630 1.00 19.42 C ATOM 1991 O LEU B 468 3.618 -6.695 45.582 1.00 18.71 O ATOM 1992 CB LEU B 468 2.077 -5.009 47.943 1.00 18.75 C ATOM 1993 CG LEU B 468 0.922 -4.114 48.418 1.00 19.76 C ATOM 1994 CD1 LEU B 468 1.481 -2.952 49.237 1.00 15.84 C ATOM 1995 CD2 LEU B 468 0.079 -3.600 47.247 1.00 18.14 C ATOM 0 H LEU B 468 0.398 -6.775 48.289 1.00 18.42 H new ATOM 0 HA LEU B 468 1.374 -5.742 46.154 1.00 18.69 H new ATOM 0 HB2 LEU B 468 2.494 -5.405 48.724 1.00 18.75 H new ATOM 0 HB3 LEU B 468 2.744 -4.444 47.521 1.00 18.75 H new ATOM 0 HG LEU B 468 0.334 -4.647 48.975 1.00 19.76 H new ATOM 0 HD11 LEU B 468 0.752 -2.387 49.537 1.00 15.84 H new ATOM 0 HD12 LEU B 468 1.959 -3.299 50.007 1.00 15.84 H new ATOM 0 HD13 LEU B 468 2.088 -2.431 48.688 1.00 15.84 H new ATOM 0 HD21 LEU B 468 -0.638 -3.041 47.585 1.00 18.14 H new ATOM 0 HD22 LEU B 468 0.639 -3.081 46.648 1.00 18.14 H new ATOM 0 HD23 LEU B 468 -0.299 -4.352 46.765 1.00 18.14 H new ATOM 1996 N MET B 469 3.330 -7.855 47.526 1.00 19.63 N ATOM 1997 CA MET B 469 4.469 -8.782 47.310 1.00 21.77 C ATOM 1998 C MET B 469 4.330 -9.612 46.023 1.00 21.66 C ATOM 1999 O MET B 469 5.313 -9.891 45.362 1.00 20.28 O ATOM 2000 CB MET B 469 4.654 -9.727 48.510 1.00 22.11 C ATOM 2001 CG MET B 469 5.169 -9.042 49.785 1.00 21.81 C ATOM 2002 SD MET B 469 6.775 -8.290 49.468 1.00 25.59 S ATOM 2003 CE MET B 469 6.563 -6.726 50.318 1.00 27.81 C ATOM 0 H MET B 469 2.927 -7.967 48.277 1.00 19.63 H new ATOM 0 HA MET B 469 5.253 -8.219 47.216 1.00 21.77 H new ATOM 0 HB2 MET B 469 3.805 -10.153 48.706 1.00 22.11 H new ATOM 0 HB3 MET B 469 5.274 -10.430 48.261 1.00 22.11 H new ATOM 0 HG2 MET B 469 4.538 -8.366 50.076 1.00 21.81 H new ATOM 0 HG3 MET B 469 5.242 -9.690 50.503 1.00 21.81 H new ATOM 0 HE1 MET B 469 7.372 -6.198 50.231 1.00 27.81 H new ATOM 0 HE2 MET B 469 5.818 -6.243 49.927 1.00 27.81 H new ATOM 0 HE3 MET B 469 6.384 -6.890 51.257 1.00 27.81 H new ATOM 2004 N MET B 470 3.110 -10.002 45.676 1.00 23.40 N ATOM 2005 CA MET B 470 2.876 -10.733 44.429 1.00 26.08 C ATOM 2006 C MET B 470 3.134 -9.853 43.186 1.00 24.80 C ATOM 2007 O MET B 470 3.819 -10.271 42.246 1.00 23.52 O ATOM 2008 CB MET B 470 1.470 -11.294 44.402 1.00 25.50 C ATOM 2009 CG MET B 470 1.264 -12.459 45.345 1.00 28.34 C ATOM 2010 SD MET B 470 -0.196 -13.392 44.891 1.00 34.50 S ATOM 2011 CE MET B 470 0.534 -14.412 43.634 1.00 35.68 C ATOM 0 H MET B 470 2.404 -9.856 46.144 1.00 23.40 H new ATOM 0 HA MET B 470 3.509 -11.467 44.398 1.00 26.08 H new ATOM 0 HB2 MET B 470 0.844 -10.589 44.630 1.00 25.50 H new ATOM 0 HB3 MET B 470 1.261 -11.578 43.498 1.00 25.50 H new ATOM 0 HG2 MET B 470 2.042 -13.038 45.326 1.00 28.34 H new ATOM 0 HG3 MET B 470 1.175 -12.133 46.254 1.00 28.34 H new ATOM 0 HE1 MET B 470 -0.139 -14.647 42.976 1.00 35.68 H new ATOM 0 HE2 MET B 470 1.253 -13.927 43.200 1.00 35.68 H new ATOM 0 HE3 MET B 470 0.887 -15.220 44.038 1.00 35.68 H new ATOM 2012 N ILE B 471 2.598 -8.634 43.197 1.00 22.85 N ATOM 2013 CA ILE B 471 2.849 -7.673 42.120 1.00 22.43 C ATOM 2014 C ILE B 471 4.350 -7.426 41.897 1.00 22.98 C ATOM 2015 O ILE B 471 4.804 -7.283 40.758 1.00 23.35 O ATOM 2016 CB ILE B 471 2.082 -6.346 42.354 1.00 22.93 C ATOM 2017 CG1 ILE B 471 0.590 -6.635 42.454 1.00 20.74 C ATOM 2018 CG2 ILE B 471 2.359 -5.346 41.196 1.00 21.45 C ATOM 2019 CD1 ILE B 471 -0.243 -5.590 43.199 1.00 24.51 C ATOM 0 H ILE B 471 2.084 -8.341 43.821 1.00 22.85 H new ATOM 0 HA ILE B 471 2.507 -8.070 41.304 1.00 22.43 H new ATOM 0 HB ILE B 471 2.388 -5.944 43.182 1.00 22.93 H new ATOM 0 HG12 ILE B 471 0.235 -6.727 41.556 1.00 20.74 H new ATOM 0 HG13 ILE B 471 0.473 -7.491 42.894 1.00 20.74 H new ATOM 0 HG21 ILE B 471 1.873 -4.522 41.357 1.00 21.45 H new ATOM 0 HG22 ILE B 471 3.309 -5.157 41.152 1.00 21.45 H new ATOM 0 HG23 ILE B 471 2.068 -5.734 40.356 1.00 21.45 H new ATOM 0 HD11 ILE B 471 -1.173 -5.864 43.208 1.00 24.51 H new ATOM 0 HD12 ILE B 471 0.079 -5.509 44.111 1.00 24.51 H new ATOM 0 HD13 ILE B 471 -0.163 -4.733 42.752 1.00 24.51 H new ATOM 2020 N MET B 472 5.126 -7.399 42.979 1.00 23.10 N ATOM 2021 CA MET B 472 6.575 -7.226 42.866 1.00 24.40 C ATOM 2022 C MET B 472 7.348 -8.520 42.580 1.00 25.44 C ATOM 2023 O MET B 472 8.575 -8.501 42.515 1.00 26.42 O ATOM 2024 CB MET B 472 7.129 -6.521 44.106 1.00 23.48 C ATOM 2025 CG MET B 472 6.511 -5.143 44.321 1.00 23.82 C ATOM 2026 SD MET B 472 7.130 -4.322 45.791 1.00 23.94 S ATOM 2027 CE MET B 472 6.101 -5.061 47.088 1.00 17.61 C ATOM 0 H MET B 472 4.836 -7.479 43.785 1.00 23.10 H new ATOM 0 HA MET B 472 6.713 -6.668 42.085 1.00 24.40 H new ATOM 0 HB2 MET B 472 6.964 -7.071 44.888 1.00 23.48 H new ATOM 0 HB3 MET B 472 8.091 -6.431 44.020 1.00 23.48 H new ATOM 0 HG2 MET B 472 6.691 -4.588 43.546 1.00 23.82 H new ATOM 0 HG3 MET B 472 5.547 -5.233 44.388 1.00 23.82 H new ATOM 0 HE1 MET B 472 6.303 -4.643 47.939 1.00 17.61 H new ATOM 0 HE2 MET B 472 5.164 -4.924 46.876 1.00 17.61 H new ATOM 0 HE3 MET B 472 6.284 -6.012 47.144 1.00 17.61 H new ATOM 2028 N GLY B 473 6.648 -9.639 42.432 1.00 26.86 N ATOM 2029 CA GLY B 473 7.311 -10.918 42.144 1.00 28.50 C ATOM 2030 C GLY B 473 8.019 -11.582 43.322 1.00 29.34 C ATOM 2031 O GLY B 473 8.773 -12.535 43.137 1.00 29.47 O ATOM 0 H GLY B 473 5.791 -9.685 42.493 1.00 26.86 H new ATOM 0 HA2 GLY B 473 6.648 -11.535 41.798 1.00 28.50 H new ATOM 0 HA3 GLY B 473 7.960 -10.774 41.438 1.00 28.50 H new ATOM 2032 N GLU B 474 7.767 -11.108 44.537 1.00 29.37 N ATOM 2033 CA GLU B 474 8.343 -11.723 45.739 1.00 30.38 C ATOM 2034 C GLU B 474 7.565 -12.958 46.185 1.00 30.04 C ATOM 2035 O GLU B 474 8.118 -13.868 46.810 1.00 30.29 O ATOM 2036 CB GLU B 474 8.421 -10.707 46.882 1.00 32.10 C ATOM 2037 CG GLU B 474 9.568 -9.697 46.731 1.00 36.14 C ATOM 2038 CD GLU B 474 10.959 -10.345 46.860 1.00 44.16 C ATOM 2039 OE1 GLU B 474 11.140 -11.240 47.726 1.00 46.98 O ATOM 2040 OE2 GLU B 474 11.872 -9.960 46.090 1.00 47.03 O ATOM 0 H GLU B 474 7.263 -10.428 44.692 1.00 29.37 H new ATOM 0 HA GLU B 474 9.240 -12.011 45.507 1.00 30.38 H new ATOM 0 HB2 GLU B 474 7.581 -10.225 46.934 1.00 32.10 H new ATOM 0 HB3 GLU B 474 8.528 -11.183 47.721 1.00 32.10 H new ATOM 0 HG2 GLU B 474 9.498 -9.262 45.867 1.00 36.14 H new ATOM 0 HG3 GLU B 474 9.475 -9.006 47.405 1.00 36.14 H new ATOM 2041 N LEU B 475 6.274 -12.971 45.878 1.00 28.97 N ATOM 2042 CA LEU B 475 5.430 -14.120 46.104 1.00 28.78 C ATOM 2043 C LEU B 475 4.909 -14.523 44.734 1.00 30.55 C ATOM 2044 O LEU B 475 4.329 -13.703 44.033 1.00 30.00 O ATOM 2045 CB LEU B 475 4.265 -13.762 47.035 1.00 28.13 C ATOM 2046 CG LEU B 475 3.248 -14.853 47.424 1.00 28.83 C ATOM 2047 CD1 LEU B 475 3.926 -16.100 48.019 1.00 27.52 C ATOM 2048 CD2 LEU B 475 2.190 -14.311 48.387 1.00 26.17 C ATOM 0 H LEU B 475 5.864 -12.301 45.528 1.00 28.97 H new ATOM 0 HA LEU B 475 5.919 -14.842 46.530 1.00 28.78 H new ATOM 0 HB2 LEU B 475 4.645 -13.411 47.856 1.00 28.13 H new ATOM 0 HB3 LEU B 475 3.771 -13.038 46.619 1.00 28.13 H new ATOM 0 HG LEU B 475 2.808 -15.124 46.603 1.00 28.83 H new ATOM 0 HD11 LEU B 475 3.251 -16.757 48.248 1.00 27.52 H new ATOM 0 HD12 LEU B 475 4.537 -16.478 47.367 1.00 27.52 H new ATOM 0 HD13 LEU B 475 4.418 -15.851 48.817 1.00 27.52 H new ATOM 0 HD21 LEU B 475 1.566 -15.018 48.613 1.00 26.17 H new ATOM 0 HD22 LEU B 475 2.621 -13.990 49.194 1.00 26.17 H new ATOM 0 HD23 LEU B 475 1.711 -13.581 47.965 1.00 26.17 H new ATOM 2049 N GLU B 476 5.142 -15.770 44.336 1.00 32.99 N ATOM 2050 CA GLU B 476 4.649 -16.246 43.041 1.00 35.11 C ATOM 2051 C GLU B 476 3.391 -17.070 43.271 1.00 35.03 C ATOM 2052 O GLU B 476 3.301 -17.781 44.275 1.00 35.85 O ATOM 2053 CB GLU B 476 5.712 -17.081 42.322 1.00 35.45 C ATOM 2054 CG GLU B 476 7.103 -16.455 42.297 1.00 37.17 C ATOM 2055 CD GLU B 476 8.121 -17.311 41.553 1.00 38.22 C ATOM 2056 OE1 GLU B 476 9.300 -16.887 41.463 1.00 42.35 O ATOM 2057 OE2 GLU B 476 7.746 -18.400 41.057 1.00 40.64 O ATOM 0 H GLU B 476 5.578 -16.353 44.793 1.00 32.99 H new ATOM 0 HA GLU B 476 4.445 -15.484 42.476 1.00 35.11 H new ATOM 0 HB2 GLU B 476 5.769 -17.949 42.751 1.00 35.45 H new ATOM 0 HB3 GLU B 476 5.423 -17.234 41.409 1.00 35.45 H new ATOM 0 HG2 GLU B 476 7.053 -15.582 41.878 1.00 37.17 H new ATOM 0 HG3 GLU B 476 7.407 -16.316 43.207 1.00 37.17 H new ATOM 2058 N PRO B 477 2.402 -16.955 42.361 1.00 35.16 N ATOM 2059 CA PRO B 477 1.182 -17.748 42.459 1.00 34.73 C ATOM 2060 C PRO B 477 1.368 -19.245 42.175 1.00 34.65 C ATOM 2061 O PRO B 477 2.237 -19.640 41.393 1.00 34.98 O ATOM 2062 CB PRO B 477 0.259 -17.117 41.416 1.00 34.60 C ATOM 2063 CG PRO B 477 1.126 -16.413 40.481 1.00 34.91 C ATOM 2064 CD PRO B 477 2.376 -16.039 41.203 1.00 35.50 C ATOM 0 HA PRO B 477 0.838 -17.730 43.366 1.00 34.73 H new ATOM 0 HB2 PRO B 477 -0.264 -17.795 40.960 1.00 34.60 H new ATOM 0 HB3 PRO B 477 -0.369 -16.507 41.833 1.00 34.60 H new ATOM 0 HG2 PRO B 477 1.331 -16.976 39.718 1.00 34.91 H new ATOM 0 HG3 PRO B 477 0.683 -15.621 40.138 1.00 34.91 H new ATOM 0 HD2 PRO B 477 3.159 -16.153 40.642 1.00 35.50 H new ATOM 0 HD3 PRO B 477 2.361 -15.111 41.484 1.00 35.50 H new ATOM 2065 N SER B 478 0.576 -20.050 42.868 1.00 34.55 N ATOM 2066 CA SER B 478 0.459 -21.478 42.616 1.00 35.26 C ATOM 2067 C SER B 478 -0.510 -21.672 41.469 1.00 34.61 C ATOM 2068 O SER B 478 -0.320 -22.553 40.633 1.00 35.05 O ATOM 2069 CB SER B 478 -0.088 -22.187 43.847 1.00 34.21 C ATOM 2070 OG SER B 478 0.703 -21.879 44.972 1.00 40.32 O ATOM 0 H SER B 478 0.079 -19.775 43.514 1.00 34.55 H new ATOM 0 HA SER B 478 1.331 -21.846 42.403 1.00 35.26 H new ATOM 0 HB2 SER B 478 -1.006 -21.916 44.004 1.00 34.21 H new ATOM 0 HB3 SER B 478 -0.096 -23.146 43.700 1.00 34.21 H new ATOM 0 HG SER B 478 0.410 -22.292 45.642 1.00 40.32 H new ATOM 2071 N GLU B 479 -1.550 -20.839 41.452 1.00 33.24 N ATOM 2072 CA GLU B 479 -2.546 -20.816 40.389 1.00 32.80 C ATOM 2073 C GLU B 479 -2.748 -19.382 39.912 1.00 33.02 C ATOM 2074 O GLU B 479 -2.461 -18.419 40.642 1.00 32.48 O ATOM 2075 CB GLU B 479 -3.880 -21.374 40.886 1.00 33.30 C ATOM 0 H GLU B 479 -1.697 -20.261 42.072 1.00 33.24 H new ATOM 0 HA GLU B 479 -2.229 -21.368 39.657 1.00 32.80 H new ATOM 2076 N GLY B 480 -3.230 -19.252 38.681 1.00 32.03 N ATOM 2077 CA GLY B 480 -3.622 -17.966 38.131 1.00 32.50 C ATOM 2078 C GLY B 480 -2.506 -17.201 37.464 1.00 31.50 C ATOM 2079 O GLY B 480 -1.406 -17.712 37.285 1.00 31.78 O ATOM 0 H GLY B 480 -3.338 -19.912 38.141 1.00 32.03 H new ATOM 0 HA2 GLY B 480 -4.332 -18.107 37.486 1.00 32.50 H new ATOM 0 HA3 GLY B 480 -3.990 -17.421 38.844 1.00 32.50 H new ATOM 2080 N LYS B 481 -2.805 -15.959 37.105 1.00 31.32 N ATOM 2081 CA LYS B 481 -1.893 -15.126 36.346 1.00 30.33 C ATOM 2082 C LYS B 481 -1.911 -13.692 36.870 1.00 29.02 C ATOM 2083 O LYS B 481 -2.958 -13.171 37.240 1.00 27.79 O ATOM 2084 CB LYS B 481 -2.278 -15.174 34.862 1.00 31.46 C ATOM 2085 CG LYS B 481 -1.527 -14.207 33.953 1.00 34.18 C ATOM 0 H LYS B 481 -3.550 -15.576 37.298 1.00 31.32 H new ATOM 0 HA LYS B 481 -0.989 -15.464 36.448 1.00 30.33 H new ATOM 0 HB2 LYS B 481 -2.134 -16.076 34.536 1.00 31.46 H new ATOM 0 HB3 LYS B 481 -3.228 -14.993 34.785 1.00 31.46 H new ATOM 2086 N ILE B 482 -0.731 -13.085 36.912 1.00 28.43 N ATOM 2087 CA ILE B 482 -0.560 -11.669 37.228 1.00 29.74 C ATOM 2088 C ILE B 482 0.214 -11.063 36.075 1.00 30.08 C ATOM 2089 O ILE B 482 1.326 -11.494 35.779 1.00 30.97 O ATOM 2090 CB ILE B 482 0.229 -11.429 38.540 1.00 28.88 C ATOM 2091 CG1 ILE B 482 -0.473 -12.102 39.714 1.00 30.51 C ATOM 2092 CG2 ILE B 482 0.409 -9.905 38.804 1.00 31.72 C ATOM 2093 CD1 ILE B 482 0.426 -12.325 40.912 1.00 31.17 C ATOM 0 H ILE B 482 0.010 -13.492 36.754 1.00 28.43 H new ATOM 0 HA ILE B 482 -1.434 -11.268 37.354 1.00 29.74 H new ATOM 0 HB ILE B 482 1.110 -11.823 38.444 1.00 28.88 H new ATOM 0 HG12 ILE B 482 -1.229 -11.558 39.984 1.00 30.51 H new ATOM 0 HG13 ILE B 482 -0.828 -12.956 39.422 1.00 30.51 H new ATOM 0 HG21 ILE B 482 0.904 -9.775 39.628 1.00 31.72 H new ATOM 0 HG22 ILE B 482 0.897 -9.504 38.068 1.00 31.72 H new ATOM 0 HG23 ILE B 482 -0.462 -9.485 38.881 1.00 31.72 H new ATOM 0 HD11 ILE B 482 -0.079 -12.754 41.620 1.00 31.17 H new ATOM 0 HD12 ILE B 482 1.171 -12.892 40.657 1.00 31.17 H new ATOM 0 HD13 ILE B 482 0.763 -11.472 41.227 1.00 31.17 H new ATOM 2094 N LYS B 483 -0.386 -10.084 35.410 1.00 29.78 N ATOM 2095 CA LYS B 483 0.315 -9.390 34.342 1.00 30.28 C ATOM 2096 C LYS B 483 0.582 -7.948 34.766 1.00 29.56 C ATOM 2097 O LYS B 483 -0.340 -7.224 35.117 1.00 30.67 O ATOM 2098 CB LYS B 483 -0.498 -9.426 33.043 1.00 30.67 C ATOM 0 H LYS B 483 -1.187 -9.810 35.559 1.00 29.78 H new ATOM 0 HA LYS B 483 1.159 -9.837 34.176 1.00 30.28 H new ATOM 2099 N HIS B 484 1.851 -7.555 34.737 1.00 29.19 N ATOM 2100 CA HIS B 484 2.254 -6.166 34.929 1.00 28.39 C ATOM 2101 C HIS B 484 3.619 -5.929 34.287 1.00 28.59 C ATOM 2102 O HIS B 484 4.559 -6.717 34.478 1.00 27.57 O ATOM 2103 CB HIS B 484 2.313 -5.768 36.420 1.00 27.47 C ATOM 2104 CG HIS B 484 2.802 -4.370 36.619 1.00 23.63 C ATOM 2105 ND1 HIS B 484 2.191 -3.183 36.402 1.00 22.78 N flip ATOM 2106 CD2 HIS B 484 4.102 -4.073 36.963 1.00 21.21 C flip ATOM 2107 CE1 HIS B 484 3.116 -2.197 36.642 1.00 21.23 C flip ATOM 2108 NE2 HIS B 484 4.261 -2.760 36.987 1.00 21.66 N flip ATOM 0 H HIS B 484 2.509 -8.092 34.604 1.00 29.19 H new ATOM 0 HA HIS B 484 1.580 -5.612 34.504 1.00 28.39 H new ATOM 0 HB2 HIS B 484 1.430 -5.857 36.811 1.00 27.47 H new ATOM 0 HB3 HIS B 484 2.896 -6.382 36.893 1.00 27.47 H new ATOM 0 HD2 HIS B 484 4.765 -4.698 37.149 1.00 21.21 H new ATOM 0 HE1 HIS B 484 2.962 -1.282 36.573 1.00 21.23 H new ATOM 0 HE2 HIS B 484 4.985 -2.344 37.192 1.00 21.66 H new ATOM 2109 N SER B 485 3.737 -4.841 33.534 1.00 29.15 N ATOM 2110 CA SER B 485 5.042 -4.466 33.002 1.00 29.31 C ATOM 2111 C SER B 485 5.299 -2.991 33.227 1.00 28.42 C ATOM 2112 O SER B 485 4.600 -2.156 32.668 1.00 30.23 O ATOM 2113 CB SER B 485 5.137 -4.792 31.512 1.00 30.34 C ATOM 2114 OG SER B 485 6.398 -4.382 31.006 1.00 34.57 O ATOM 0 H SER B 485 3.089 -4.316 33.323 1.00 29.15 H new ATOM 0 HA SER B 485 5.717 -4.979 33.472 1.00 29.31 H new ATOM 0 HB2 SER B 485 5.018 -5.745 31.373 1.00 30.34 H new ATOM 0 HB3 SER B 485 4.425 -4.344 31.029 1.00 30.34 H new ATOM 0 HG SER B 485 6.445 -4.565 30.187 1.00 34.57 H new ATOM 2115 N GLY B 486 6.318 -2.663 34.017 1.00 26.41 N ATOM 2116 CA GLY B 486 6.578 -1.266 34.331 1.00 23.32 C ATOM 2117 C GLY B 486 7.330 -1.162 35.631 1.00 22.62 C ATOM 2118 O GLY B 486 7.441 -2.144 36.363 1.00 22.36 O ATOM 0 H GLY B 486 6.861 -3.225 34.375 1.00 26.41 H new ATOM 0 HA2 GLY B 486 7.092 -0.857 33.618 1.00 23.32 H new ATOM 0 HA3 GLY B 486 5.741 -0.779 34.393 1.00 23.32 H new ATOM 2119 N ARG B 487 7.855 0.034 35.902 1.00 20.69 N ATOM 2120 CA ARG B 487 8.602 0.316 37.128 1.00 20.40 C ATOM 2121 C ARG B 487 7.638 0.454 38.310 1.00 19.57 C ATOM 2122 O ARG B 487 6.662 1.194 38.245 1.00 19.79 O ATOM 2123 CB ARG B 487 9.460 1.592 36.970 1.00 19.35 C ATOM 2124 CG ARG B 487 10.272 1.954 38.229 1.00 18.66 C ATOM 2125 CD ARG B 487 11.009 3.244 38.044 1.00 24.36 C ATOM 2126 NE ARG B 487 12.196 3.049 37.215 1.00 22.38 N ATOM 2127 CZ ARG B 487 12.867 4.027 36.614 1.00 21.32 C ATOM 2128 NH1 ARG B 487 13.938 3.725 35.903 1.00 24.08 N ATOM 2129 NH2 ARG B 487 12.472 5.299 36.725 1.00 23.91 N ATOM 0 H ARG B 487 7.787 0.710 35.374 1.00 20.69 H new ATOM 0 HA ARG B 487 9.202 -0.426 37.301 1.00 20.40 H new ATOM 0 HB2 ARG B 487 10.070 1.472 36.225 1.00 19.35 H new ATOM 0 HB3 ARG B 487 8.880 2.336 36.744 1.00 19.35 H new ATOM 0 HG2 ARG B 487 9.677 2.025 38.992 1.00 18.66 H new ATOM 0 HG3 ARG B 487 10.902 1.244 38.426 1.00 18.66 H new ATOM 0 HD2 ARG B 487 10.425 3.899 37.631 1.00 24.36 H new ATOM 0 HD3 ARG B 487 11.268 3.600 38.908 1.00 24.36 H new ATOM 0 HE ARG B 487 12.481 2.245 37.108 1.00 22.38 H new ATOM 0 HH11 ARG B 487 14.192 2.906 35.834 1.00 24.08 H new ATOM 0 HH12 ARG B 487 14.382 4.347 35.509 1.00 24.08 H new ATOM 0 HH21 ARG B 487 11.775 5.494 37.190 1.00 23.91 H new ATOM 0 HH22 ARG B 487 12.915 5.923 36.331 1.00 23.91 H new ATOM 2130 N ILE B 488 7.928 -0.278 39.381 1.00 20.73 N ATOM 2131 CA ILE B 488 7.173 -0.192 40.634 1.00 19.36 C ATOM 2132 C ILE B 488 7.937 0.668 41.652 1.00 18.95 C ATOM 2133 O ILE B 488 9.145 0.503 41.844 1.00 18.37 O ATOM 2134 CB ILE B 488 6.909 -1.600 41.238 1.00 20.71 C ATOM 2135 CG1 ILE B 488 6.056 -2.439 40.280 1.00 21.14 C ATOM 2136 CG2 ILE B 488 6.182 -1.498 42.600 1.00 18.62 C ATOM 2137 CD1 ILE B 488 5.943 -3.927 40.650 1.00 18.92 C ATOM 0 H ILE B 488 8.574 -0.845 39.404 1.00 20.73 H new ATOM 0 HA ILE B 488 6.317 0.219 40.435 1.00 19.36 H new ATOM 0 HB ILE B 488 7.770 -2.026 41.372 1.00 20.71 H new ATOM 0 HG12 ILE B 488 5.164 -2.059 40.244 1.00 21.14 H new ATOM 0 HG13 ILE B 488 6.430 -2.368 39.388 1.00 21.14 H new ATOM 0 HG21 ILE B 488 6.030 -2.388 42.953 1.00 18.62 H new ATOM 0 HG22 ILE B 488 6.729 -0.993 43.222 1.00 18.62 H new ATOM 0 HG23 ILE B 488 5.331 -1.049 42.480 1.00 18.62 H new ATOM 0 HD11 ILE B 488 5.390 -4.382 39.996 1.00 18.92 H new ATOM 0 HD12 ILE B 488 6.827 -4.326 40.659 1.00 18.92 H new ATOM 0 HD13 ILE B 488 5.541 -4.013 41.529 1.00 18.92 H new ATOM 2138 N SER B 489 7.221 1.591 42.295 1.00 18.70 N ATOM 2139 CA SER B 489 7.740 2.291 43.470 1.00 17.52 C ATOM 2140 C SER B 489 6.966 1.809 44.694 1.00 16.62 C ATOM 2141 O SER B 489 5.740 1.883 44.726 1.00 16.60 O ATOM 2142 CB SER B 489 7.587 3.797 43.317 1.00 18.01 C ATOM 2143 OG SER B 489 8.137 4.456 44.448 1.00 17.23 O ATOM 0 H SER B 489 6.427 1.827 42.064 1.00 18.70 H new ATOM 0 HA SER B 489 8.686 2.099 43.570 1.00 17.52 H new ATOM 0 HB2 SER B 489 8.034 4.095 42.510 1.00 18.01 H new ATOM 0 HB3 SER B 489 6.649 4.027 43.223 1.00 18.01 H new ATOM 0 HG SER B 489 7.903 5.263 44.444 1.00 17.23 H new ATOM 2144 N PHE B 490 7.681 1.355 45.711 1.00 16.41 N ATOM 2145 CA PHE B 490 7.055 0.678 46.833 1.00 17.06 C ATOM 2146 C PHE B 490 7.339 1.444 48.106 1.00 16.46 C ATOM 2147 O PHE B 490 8.492 1.751 48.410 1.00 17.05 O ATOM 2148 CB PHE B 490 7.596 -0.760 46.930 1.00 17.91 C ATOM 2149 CG PHE B 490 7.153 -1.519 48.172 1.00 17.68 C ATOM 2150 CD1 PHE B 490 5.811 -1.557 48.553 1.00 18.59 C ATOM 2151 CD2 PHE B 490 8.086 -2.225 48.929 1.00 15.50 C ATOM 2152 CE1 PHE B 490 5.408 -2.291 49.686 1.00 17.82 C ATOM 2153 CE2 PHE B 490 7.708 -2.938 50.077 1.00 18.01 C ATOM 2154 CZ PHE B 490 6.348 -2.980 50.443 1.00 13.65 C ATOM 0 H PHE B 490 8.536 1.430 45.771 1.00 16.41 H new ATOM 0 HA PHE B 490 6.095 0.640 46.702 1.00 17.06 H new ATOM 0 HB2 PHE B 490 7.312 -1.254 46.145 1.00 17.91 H new ATOM 0 HB3 PHE B 490 8.565 -0.731 46.912 1.00 17.91 H new ATOM 0 HD1 PHE B 490 5.177 -1.094 48.055 1.00 18.59 H new ATOM 0 HD2 PHE B 490 8.979 -2.224 48.668 1.00 15.50 H new ATOM 0 HE1 PHE B 490 4.510 -2.315 49.928 1.00 17.82 H new ATOM 0 HE2 PHE B 490 8.347 -3.377 50.590 1.00 18.01 H new ATOM 0 HZ PHE B 490 6.080 -3.467 51.189 1.00 13.65 H new ATOM 2155 N CYS B 491 6.284 1.759 48.845 1.00 17.21 N ATOM 2156 CA CYS B 491 6.429 2.400 50.141 1.00 16.69 C ATOM 2157 C CYS B 491 6.004 1.374 51.187 1.00 16.74 C ATOM 2158 O CYS B 491 4.815 1.069 51.311 1.00 15.38 O ATOM 2159 CB CYS B 491 5.570 3.657 50.239 1.00 16.50 C ATOM 2160 SG CYS B 491 5.691 4.477 51.837 1.00 20.23 S ATOM 0 H CYS B 491 5.470 1.608 48.611 1.00 17.21 H new ATOM 0 HA CYS B 491 7.347 2.682 50.279 1.00 16.69 H new ATOM 0 HB2 CYS B 491 5.835 4.278 49.543 1.00 16.50 H new ATOM 0 HB3 CYS B 491 4.644 3.422 50.072 1.00 16.50 H new ATOM 0 HG CYS B 491 5.204 3.779 52.683 1.00 20.23 H new ATOM 2161 N SER B 492 6.984 0.887 51.944 1.00 17.02 N ATOM 2162 CA SER B 492 6.815 -0.267 52.834 1.00 19.40 C ATOM 2163 C SER B 492 6.171 0.150 54.140 1.00 19.44 C ATOM 2164 O SER B 492 6.326 1.288 54.590 1.00 18.51 O ATOM 2165 CB SER B 492 8.187 -0.902 53.111 1.00 19.56 C ATOM 2166 OG SER B 492 8.100 -1.879 54.131 1.00 26.24 O ATOM 0 H SER B 492 7.777 1.220 51.957 1.00 17.02 H new ATOM 0 HA SER B 492 6.235 -0.913 52.400 1.00 19.40 H new ATOM 0 HB2 SER B 492 8.529 -1.308 52.299 1.00 19.56 H new ATOM 0 HB3 SER B 492 8.819 -0.213 53.372 1.00 19.56 H new ATOM 0 HG SER B 492 8.291 -2.633 53.814 1.00 26.24 H new ATOM 2167 N GLN B 493 5.478 -0.784 54.774 1.00 20.69 N ATOM 2168 CA GLN B 493 4.944 -0.538 56.119 1.00 22.85 C ATOM 2169 C GLN B 493 6.040 -0.322 57.148 1.00 22.95 C ATOM 2170 O GLN B 493 5.774 0.129 58.243 1.00 25.47 O ATOM 2171 CB GLN B 493 4.123 -1.732 56.575 1.00 23.78 C ATOM 2172 CG GLN B 493 2.654 -1.531 56.482 1.00 21.59 C ATOM 2173 CD GLN B 493 1.967 -2.748 56.960 1.00 25.40 C ATOM 2174 OE1 GLN B 493 2.234 -3.858 56.463 1.00 21.32 O ATOM 2175 NE2 GLN B 493 1.111 -2.586 57.973 1.00 20.21 N ATOM 0 H GLN B 493 5.303 -1.562 54.452 1.00 20.69 H new ATOM 0 HA GLN B 493 4.404 0.266 56.058 1.00 22.85 H new ATOM 0 HB2 GLN B 493 4.368 -2.504 56.041 1.00 23.78 H new ATOM 0 HB3 GLN B 493 4.354 -1.938 57.494 1.00 23.78 H new ATOM 0 HG2 GLN B 493 2.387 -0.765 57.014 1.00 21.59 H new ATOM 0 HG3 GLN B 493 2.400 -1.342 55.565 1.00 21.59 H new ATOM 0 HE21 GLN B 493 0.957 -1.799 58.284 1.00 20.21 H new ATOM 0 HE22 GLN B 493 0.714 -3.268 58.314 1.00 20.21 H new ATOM 2176 N PHE B 494 7.269 -0.662 56.801 1.00 23.42 N ATOM 2177 CA PHE B 494 8.412 -0.466 57.684 1.00 25.37 C ATOM 2178 C PHE B 494 8.961 0.974 57.663 1.00 26.34 C ATOM 2179 O PHE B 494 9.777 1.346 58.511 1.00 26.56 O ATOM 2180 CB PHE B 494 9.534 -1.406 57.257 1.00 26.38 C ATOM 2181 CG PHE B 494 9.384 -2.827 57.758 1.00 27.44 C ATOM 2182 CD1 PHE B 494 8.945 -3.839 56.904 1.00 28.68 C ATOM 2183 CD2 PHE B 494 9.704 -3.148 59.080 1.00 31.42 C ATOM 2184 CE1 PHE B 494 8.821 -5.155 57.359 1.00 31.40 C ATOM 2185 CE2 PHE B 494 9.575 -4.464 59.552 1.00 31.61 C ATOM 2186 CZ PHE B 494 9.145 -5.465 58.693 1.00 30.65 C ATOM 0 H PHE B 494 7.468 -1.015 56.043 1.00 23.42 H new ATOM 0 HA PHE B 494 8.104 -0.650 58.585 1.00 25.37 H new ATOM 0 HB2 PHE B 494 9.579 -1.419 56.288 1.00 26.38 H new ATOM 0 HB3 PHE B 494 10.378 -1.050 57.575 1.00 26.38 H new ATOM 0 HD1 PHE B 494 8.732 -3.636 56.022 1.00 28.68 H new ATOM 0 HD2 PHE B 494 10.006 -2.482 59.654 1.00 31.42 H new ATOM 0 HE1 PHE B 494 8.526 -5.823 56.783 1.00 31.40 H new ATOM 0 HE2 PHE B 494 9.777 -4.664 60.437 1.00 31.61 H new ATOM 0 HZ PHE B 494 9.071 -6.340 58.999 1.00 30.65 H new ATOM 2187 N SER B 495 8.543 1.773 56.683 1.00 26.97 N ATOM 2188 CA SER B 495 9.056 3.152 56.539 1.00 28.70 C ATOM 2189 C SER B 495 10.578 3.234 56.713 1.00 29.52 C ATOM 2190 O SER B 495 11.075 3.897 57.615 1.00 30.32 O ATOM 2191 CB SER B 495 8.346 4.112 57.501 1.00 29.06 C ATOM 2192 OG SER B 495 6.962 4.203 57.207 1.00 27.77 O ATOM 0 H SER B 495 7.965 1.544 56.089 1.00 26.97 H new ATOM 0 HA SER B 495 8.859 3.427 55.630 1.00 28.70 H new ATOM 0 HB2 SER B 495 8.466 3.806 58.414 1.00 29.06 H new ATOM 0 HB3 SER B 495 8.750 4.992 57.441 1.00 29.06 H new ATOM 0 HG SER B 495 6.595 4.732 57.747 1.00 27.77 H new ATOM 2193 N TRP B 496 11.314 2.539 55.848 1.00 30.50 N ATOM 2194 CA TRP B 496 12.767 2.474 55.966 1.00 31.91 C ATOM 2195 C TRP B 496 13.407 3.859 55.859 1.00 31.84 C ATOM 2196 O TRP B 496 13.020 4.671 55.014 1.00 30.72 O ATOM 2197 CB TRP B 496 13.349 1.570 54.881 1.00 33.86 C ATOM 2198 CG TRP B 496 12.819 0.162 54.895 1.00 36.00 C ATOM 2199 CD1 TRP B 496 12.011 -0.424 53.956 1.00 36.69 C ATOM 2200 CD2 TRP B 496 13.072 -0.838 55.890 1.00 38.04 C ATOM 2201 NE1 TRP B 496 11.750 -1.733 54.305 1.00 37.21 N ATOM 2202 CE2 TRP B 496 12.387 -2.013 55.487 1.00 37.93 C ATOM 2203 CE3 TRP B 496 13.810 -0.859 57.084 1.00 38.78 C ATOM 2204 CZ2 TRP B 496 12.417 -3.195 56.239 1.00 38.04 C ATOM 2205 CZ3 TRP B 496 13.842 -2.044 57.834 1.00 37.39 C ATOM 2206 CH2 TRP B 496 13.149 -3.190 57.407 1.00 36.58 C ATOM 0 H TRP B 496 10.990 2.098 55.185 1.00 30.50 H new ATOM 0 HA TRP B 496 12.967 2.109 56.842 1.00 31.91 H new ATOM 0 HB2 TRP B 496 13.166 1.964 54.014 1.00 33.86 H new ATOM 0 HB3 TRP B 496 14.313 1.542 54.982 1.00 33.86 H new ATOM 0 HD1 TRP B 496 11.686 -0.001 53.194 1.00 36.69 H new ATOM 0 HE1 TRP B 496 11.267 -2.284 53.855 1.00 37.21 H new ATOM 0 HE3 TRP B 496 14.268 -0.103 57.372 1.00 38.78 H new ATOM 0 HZ2 TRP B 496 11.960 -3.955 55.960 1.00 38.04 H new ATOM 0 HZ3 TRP B 496 14.329 -2.072 58.626 1.00 37.39 H new ATOM 0 HH2 TRP B 496 13.185 -3.962 57.924 1.00 36.58 H new ATOM 2207 N ILE B 497 14.370 4.114 56.732 1.00 32.15 N ATOM 2208 CA ILE B 497 15.212 5.288 56.647 1.00 33.95 C ATOM 2209 C ILE B 497 16.650 4.798 56.461 1.00 35.63 C ATOM 2210 O ILE B 497 17.121 3.941 57.221 1.00 35.55 O ATOM 2211 CB ILE B 497 15.086 6.181 57.911 1.00 33.88 C ATOM 2212 CG1 ILE B 497 13.667 6.769 58.051 1.00 31.70 C ATOM 2213 CG2 ILE B 497 16.211 7.225 57.968 1.00 34.41 C ATOM 2214 CD1 ILE B 497 13.319 7.938 57.116 1.00 31.73 C ATOM 0 H ILE B 497 14.553 3.602 57.398 1.00 32.15 H new ATOM 0 HA ILE B 497 14.937 5.841 55.899 1.00 33.95 H new ATOM 0 HB ILE B 497 15.208 5.625 58.696 1.00 33.88 H new ATOM 0 HG12 ILE B 497 13.026 6.057 57.900 1.00 31.70 H new ATOM 0 HG13 ILE B 497 13.550 7.066 58.967 1.00 31.70 H new ATOM 0 HG21 ILE B 497 16.109 7.768 58.765 1.00 34.41 H new ATOM 0 HG22 ILE B 497 17.070 6.775 57.992 1.00 34.41 H new ATOM 0 HG23 ILE B 497 16.166 7.793 57.183 1.00 34.41 H new ATOM 0 HD11 ILE B 497 12.410 8.229 57.287 1.00 31.73 H new ATOM 0 HD12 ILE B 497 13.930 8.674 57.277 1.00 31.73 H new ATOM 0 HD13 ILE B 497 13.398 7.649 56.193 1.00 31.73 H new ATOM 2215 N MET B 498 17.318 5.317 55.430 1.00 36.78 N ATOM 2216 CA MET B 498 18.719 4.988 55.142 1.00 39.74 C ATOM 2217 C MET B 498 19.634 6.034 55.778 1.00 38.12 C ATOM 2218 O MET B 498 19.220 7.187 55.961 1.00 37.61 O ATOM 2219 CB MET B 498 18.969 4.951 53.627 1.00 40.13 C ATOM 2220 CG MET B 498 18.037 4.038 52.829 1.00 43.03 C ATOM 2221 SD MET B 498 17.555 4.762 51.229 1.00 47.15 S ATOM 2222 CE MET B 498 16.268 3.611 50.731 1.00 45.42 C ATOM 0 H MET B 498 16.970 5.873 54.874 1.00 36.78 H new ATOM 0 HA MET B 498 18.910 4.112 55.512 1.00 39.74 H new ATOM 0 HB2 MET B 498 18.888 5.853 53.279 1.00 40.13 H new ATOM 0 HB3 MET B 498 19.884 4.668 53.473 1.00 40.13 H new ATOM 0 HG2 MET B 498 18.476 3.186 52.676 1.00 43.03 H new ATOM 0 HG3 MET B 498 17.240 3.857 53.352 1.00 43.03 H new ATOM 0 HE1 MET B 498 15.909 3.879 49.871 1.00 45.42 H new ATOM 0 HE2 MET B 498 16.641 2.718 50.661 1.00 45.42 H new ATOM 0 HE3 MET B 498 15.558 3.613 51.392 1.00 45.42 H new ATOM 2223 N PRO B 499 20.879 5.641 56.122 1.00 37.47 N ATOM 2224 CA PRO B 499 21.854 6.620 56.596 1.00 36.81 C ATOM 2225 C PRO B 499 22.180 7.640 55.506 1.00 35.79 C ATOM 2226 O PRO B 499 22.530 7.276 54.388 1.00 36.01 O ATOM 2227 CB PRO B 499 23.084 5.761 56.938 1.00 37.32 C ATOM 2228 CG PRO B 499 22.537 4.371 57.131 1.00 37.27 C ATOM 2229 CD PRO B 499 21.447 4.281 56.104 1.00 37.59 C ATOM 0 HA PRO B 499 21.535 7.139 57.351 1.00 36.81 H new ATOM 0 HB2 PRO B 499 23.741 5.786 56.224 1.00 37.32 H new ATOM 0 HB3 PRO B 499 23.525 6.081 57.740 1.00 37.32 H new ATOM 0 HG2 PRO B 499 23.219 3.696 56.989 1.00 37.27 H new ATOM 0 HG3 PRO B 499 22.194 4.243 58.029 1.00 37.27 H new ATOM 0 HD2 PRO B 499 21.794 4.046 55.229 1.00 37.59 H new ATOM 0 HD3 PRO B 499 20.786 3.610 56.337 1.00 37.59 H new ATOM 2230 N GLY B 500 22.048 8.913 55.845 1.00 35.34 N ATOM 2231 CA GLY B 500 22.178 9.988 54.884 1.00 34.15 C ATOM 2232 C GLY B 500 21.223 11.104 55.274 1.00 33.44 C ATOM 2233 O GLY B 500 20.494 10.987 56.262 1.00 33.16 O ATOM 0 H GLY B 500 21.879 9.177 56.646 1.00 35.34 H new ATOM 0 HA2 GLY B 500 23.091 10.316 54.867 1.00 34.15 H new ATOM 0 HA3 GLY B 500 21.975 9.668 53.991 1.00 34.15 H new ATOM 2234 N THR B 501 21.237 12.192 54.512 1.00 31.32 N ATOM 2235 CA THR B 501 20.370 13.339 54.793 1.00 29.32 C ATOM 2236 C THR B 501 18.892 13.063 54.442 1.00 28.69 C ATOM 2237 O THR B 501 18.569 12.052 53.788 1.00 28.09 O ATOM 2238 CB THR B 501 20.835 14.587 54.028 1.00 28.82 C ATOM 2239 OG1 THR B 501 20.630 14.390 52.629 1.00 29.61 O ATOM 2240 CG2 THR B 501 22.314 14.868 54.276 1.00 28.30 C ATOM 0 H THR B 501 21.743 12.289 53.823 1.00 31.32 H new ATOM 0 HA THR B 501 20.435 13.494 55.748 1.00 29.32 H new ATOM 0 HB THR B 501 20.318 15.345 54.344 1.00 28.82 H new ATOM 0 HG1 THR B 501 20.883 15.073 52.210 1.00 29.61 H new ATOM 0 HG21 THR B 501 22.580 15.659 53.782 1.00 28.30 H new ATOM 0 HG22 THR B 501 22.461 15.014 55.224 1.00 28.30 H new ATOM 0 HG23 THR B 501 22.842 14.110 53.980 1.00 28.30 H new ATOM 2241 N ILE B 502 18.003 13.959 54.878 1.00 26.49 N ATOM 2242 CA ILE B 502 16.595 13.882 54.494 1.00 27.14 C ATOM 2243 C ILE B 502 16.455 13.904 52.961 1.00 26.55 C ATOM 2244 O ILE B 502 15.762 13.067 52.375 1.00 26.41 O ATOM 2245 CB ILE B 502 15.759 14.999 55.152 1.00 26.51 C ATOM 2246 CG1 ILE B 502 15.574 14.699 56.638 1.00 26.91 C ATOM 2247 CG2 ILE B 502 14.402 15.177 54.435 1.00 27.13 C ATOM 2248 CD1 ILE B 502 14.838 15.807 57.406 1.00 27.62 C ATOM 0 H ILE B 502 18.197 14.618 55.396 1.00 26.49 H new ATOM 0 HA ILE B 502 16.243 13.039 54.820 1.00 27.14 H new ATOM 0 HB ILE B 502 16.236 15.839 55.066 1.00 26.51 H new ATOM 0 HG12 ILE B 502 15.081 13.869 56.733 1.00 26.91 H new ATOM 0 HG13 ILE B 502 16.445 14.560 57.042 1.00 26.91 H new ATOM 0 HG21 ILE B 502 13.897 15.884 54.868 1.00 27.13 H new ATOM 0 HG22 ILE B 502 14.555 15.411 53.506 1.00 27.13 H new ATOM 0 HG23 ILE B 502 13.901 14.348 54.480 1.00 27.13 H new ATOM 0 HD11 ILE B 502 14.755 15.554 58.339 1.00 27.62 H new ATOM 0 HD12 ILE B 502 15.339 16.635 57.339 1.00 27.62 H new ATOM 0 HD13 ILE B 502 13.955 15.933 57.025 1.00 27.62 H new ATOM 2249 N LYS B 503 17.143 14.842 52.326 1.00 26.83 N ATOM 2250 CA LYS B 503 17.130 14.959 50.872 1.00 27.70 C ATOM 2251 C LYS B 503 17.622 13.697 50.146 1.00 26.42 C ATOM 2252 O LYS B 503 16.969 13.246 49.218 1.00 25.83 O ATOM 2253 CB LYS B 503 17.933 16.186 50.426 1.00 27.27 C ATOM 2254 CG LYS B 503 17.855 16.456 48.909 1.00 29.23 C ATOM 2255 CD LYS B 503 18.798 17.594 48.508 1.00 31.31 C ATOM 2256 CE LYS B 503 18.095 18.944 48.535 1.00 38.38 C ATOM 2257 NZ LYS B 503 19.079 20.076 48.443 1.00 44.27 N ATOM 0 H LYS B 503 17.630 15.429 52.723 1.00 26.83 H new ATOM 0 HA LYS B 503 16.200 15.069 50.618 1.00 27.70 H new ATOM 0 HB2 LYS B 503 17.609 16.966 50.903 1.00 27.27 H new ATOM 0 HB3 LYS B 503 18.862 16.065 50.678 1.00 27.27 H new ATOM 0 HG2 LYS B 503 18.088 15.651 48.421 1.00 29.23 H new ATOM 0 HG3 LYS B 503 16.945 16.683 48.663 1.00 29.23 H new ATOM 0 HD2 LYS B 503 19.558 17.612 49.111 1.00 31.31 H new ATOM 0 HD3 LYS B 503 19.146 17.428 47.618 1.00 31.31 H new ATOM 0 HE2 LYS B 503 17.467 18.998 47.798 1.00 38.38 H new ATOM 0 HE3 LYS B 503 17.580 19.026 49.353 1.00 38.38 H new ATOM 0 HZ1 LYS B 503 18.642 20.851 48.461 1.00 44.27 H new ATOM 0 HZ2 LYS B 503 19.642 20.037 49.131 1.00 44.27 H new ATOM 0 HZ3 LYS B 503 19.536 20.011 47.682 1.00 44.27 H new ATOM 2258 N GLU B 504 18.775 13.157 50.559 1.00 27.41 N ATOM 2259 CA GLU B 504 19.323 11.895 50.004 1.00 28.05 C ATOM 2260 C GLU B 504 18.361 10.702 50.167 1.00 27.49 C ATOM 2261 O GLU B 504 18.226 9.871 49.267 1.00 28.23 O ATOM 2262 CB GLU B 504 20.651 11.546 50.673 1.00 28.43 C ATOM 2263 CG GLU B 504 21.852 12.375 50.213 1.00 27.83 C ATOM 2264 CD GLU B 504 23.052 12.235 51.155 1.00 29.84 C ATOM 2265 OE1 GLU B 504 22.862 11.789 52.300 1.00 28.15 O ATOM 2266 OE2 GLU B 504 24.189 12.575 50.744 1.00 34.09 O ATOM 0 H GLU B 504 19.267 13.509 51.170 1.00 27.41 H new ATOM 0 HA GLU B 504 19.451 12.052 49.055 1.00 28.05 H new ATOM 0 HB2 GLU B 504 20.551 11.653 51.632 1.00 28.43 H new ATOM 0 HB3 GLU B 504 20.842 10.609 50.510 1.00 28.43 H new ATOM 0 HG2 GLU B 504 22.111 12.098 49.320 1.00 27.83 H new ATOM 0 HG3 GLU B 504 21.595 13.309 50.157 1.00 27.83 H new ATOM 2267 N ASN B 505 17.707 10.622 51.323 1.00 25.99 N ATOM 2268 CA ASN B 505 16.694 9.598 51.567 1.00 24.97 C ATOM 2269 C ASN B 505 15.537 9.687 50.585 1.00 24.13 C ATOM 2270 O ASN B 505 14.947 8.680 50.251 1.00 25.53 O ATOM 2271 CB ASN B 505 16.164 9.697 52.997 1.00 25.03 C ATOM 2272 CG ASN B 505 16.892 8.774 53.946 1.00 24.90 C ATOM 2273 OD1 ASN B 505 16.574 7.595 54.045 1.00 24.93 O ATOM 2274 ND2 ASN B 505 17.885 9.303 54.635 1.00 26.10 N ATOM 0 H ASN B 505 17.837 11.156 51.984 1.00 25.99 H new ATOM 0 HA ASN B 505 17.126 8.739 51.439 1.00 24.97 H new ATOM 0 HB2 ASN B 505 16.251 10.611 53.309 1.00 25.03 H new ATOM 0 HB3 ASN B 505 15.218 9.483 53.004 1.00 25.03 H new ATOM 0 HD21 ASN B 505 18.338 8.816 55.180 1.00 26.10 H new ATOM 0 HD22 ASN B 505 18.079 10.135 54.539 1.00 26.10 H new ATOM 2275 N ILE B 506 15.225 10.891 50.127 1.00 22.78 N ATOM 2276 CA ILE B 506 14.098 11.110 49.218 1.00 24.06 C ATOM 2277 C ILE B 506 14.469 10.958 47.736 1.00 25.75 C ATOM 2278 O ILE B 506 13.755 10.294 46.985 1.00 26.80 O ATOM 2279 CB ILE B 506 13.392 12.443 49.520 1.00 23.44 C ATOM 2280 CG1 ILE B 506 12.714 12.344 50.893 1.00 21.85 C ATOM 2281 CG2 ILE B 506 12.356 12.802 48.441 1.00 23.41 C ATOM 2282 CD1 ILE B 506 12.446 13.680 51.534 1.00 17.17 C ATOM 0 H ILE B 506 15.657 11.606 50.331 1.00 22.78 H new ATOM 0 HA ILE B 506 13.462 10.398 49.389 1.00 24.06 H new ATOM 0 HB ILE B 506 14.057 13.149 49.523 1.00 23.44 H new ATOM 0 HG12 ILE B 506 11.875 11.866 50.797 1.00 21.85 H new ATOM 0 HG13 ILE B 506 13.274 11.817 51.484 1.00 21.85 H new ATOM 0 HG21 ILE B 506 11.934 13.646 48.666 1.00 23.41 H new ATOM 0 HG22 ILE B 506 12.798 12.881 47.581 1.00 23.41 H new ATOM 0 HG23 ILE B 506 11.682 12.106 48.395 1.00 23.41 H new ATOM 0 HD11 ILE B 506 12.019 13.546 52.394 1.00 17.17 H new ATOM 0 HD12 ILE B 506 13.284 14.153 51.659 1.00 17.17 H new ATOM 0 HD13 ILE B 506 11.863 14.203 50.962 1.00 17.17 H new ATOM 2283 N ILE B 507 15.592 11.535 47.330 1.00 27.97 N ATOM 2284 CA ILE B 507 15.900 11.666 45.903 1.00 32.02 C ATOM 2285 C ILE B 507 16.808 10.596 45.320 1.00 35.56 C ATOM 2286 O ILE B 507 16.758 10.344 44.110 1.00 36.94 O ATOM 2287 CB ILE B 507 16.505 13.058 45.537 1.00 31.74 C ATOM 2288 CG1 ILE B 507 17.917 13.203 46.117 1.00 31.68 C ATOM 2289 CG2 ILE B 507 15.571 14.173 45.962 1.00 32.21 C ATOM 2290 CD1 ILE B 507 18.716 14.322 45.520 1.00 33.47 C ATOM 0 H ILE B 507 16.189 11.857 47.858 1.00 27.97 H new ATOM 0 HA ILE B 507 15.024 11.555 45.501 1.00 32.02 H new ATOM 0 HB ILE B 507 16.595 13.124 44.573 1.00 31.74 H new ATOM 0 HG12 ILE B 507 17.849 13.343 47.075 1.00 31.68 H new ATOM 0 HG13 ILE B 507 18.397 12.370 45.985 1.00 31.68 H new ATOM 0 HG21 ILE B 507 15.961 15.029 45.728 1.00 32.21 H new ATOM 0 HG22 ILE B 507 14.719 14.072 45.509 1.00 32.21 H new ATOM 0 HG23 ILE B 507 15.434 14.132 46.921 1.00 32.21 H new ATOM 0 HD11 ILE B 507 19.593 14.351 45.934 1.00 33.47 H new ATOM 0 HD12 ILE B 507 18.815 14.176 44.566 1.00 33.47 H new ATOM 0 HD13 ILE B 507 18.259 15.164 45.673 1.00 33.47 H new ATOM 2291 N GLY B 509 17.657 10.010 46.158 1.00 37.91 N ATOM 2292 CA GLY B 509 18.651 9.049 45.698 1.00 42.34 C ATOM 2293 C GLY B 509 19.609 9.614 44.659 1.00 44.99 C ATOM 2294 O GLY B 509 20.458 10.456 44.972 1.00 45.69 O ATOM 0 H GLY B 509 17.673 10.158 47.005 1.00 37.91 H new ATOM 0 HA2 GLY B 509 19.162 8.733 46.460 1.00 42.34 H new ATOM 0 HA3 GLY B 509 18.196 8.279 45.323 1.00 42.34 H new ATOM 2295 N VAL B 510 19.434 9.173 43.411 1.00 47.43 N ATOM 2296 CA VAL B 510 20.409 9.403 42.340 1.00 49.20 C ATOM 2297 C VAL B 510 20.195 10.679 41.511 1.00 50.11 C ATOM 2298 O VAL B 510 21.168 11.358 41.157 1.00 50.56 O ATOM 2299 CB VAL B 510 20.457 8.187 41.379 1.00 50.18 C ATOM 0 H VAL B 510 18.742 8.729 43.160 1.00 47.43 H new ATOM 0 HA VAL B 510 21.251 9.523 42.807 1.00 49.20 H new ATOM 2300 N SER B 511 18.936 10.995 41.203 1.00 50.27 N ATOM 2301 CA SER B 511 18.607 12.091 40.294 1.00 50.27 C ATOM 2302 C SER B 511 18.000 13.276 41.025 1.00 50.59 C ATOM 2303 O SER B 511 16.939 13.152 41.642 1.00 51.00 O ATOM 2304 CB SER B 511 17.642 11.606 39.210 1.00 50.21 C ATOM 0 H SER B 511 18.251 10.580 41.515 1.00 50.27 H new ATOM 0 HA SER B 511 19.437 12.386 39.887 1.00 50.27 H new ATOM 2305 N TYR B 512 18.662 14.430 40.947 1.00 50.28 N ATOM 2306 CA TYR B 512 18.099 15.654 41.517 1.00 49.98 C ATOM 2307 C TYR B 512 17.264 16.456 40.516 1.00 49.13 C ATOM 2308 O TYR B 512 17.760 16.921 39.486 1.00 49.70 O ATOM 2309 CB TYR B 512 19.170 16.537 42.180 1.00 51.16 C ATOM 2310 CG TYR B 512 18.590 17.656 43.025 1.00 51.63 C ATOM 2311 CD1 TYR B 512 17.635 17.390 44.008 1.00 52.08 C ATOM 2312 CD2 TYR B 512 18.995 18.979 42.843 1.00 52.55 C ATOM 2313 CE1 TYR B 512 17.097 18.407 44.783 1.00 53.31 C ATOM 2314 CE2 TYR B 512 18.459 20.010 43.616 1.00 53.41 C ATOM 2315 CZ TYR B 512 17.509 19.715 44.582 1.00 53.08 C ATOM 2316 OH TYR B 512 16.970 20.721 45.355 1.00 54.48 O ATOM 0 H TYR B 512 19.430 14.526 40.572 1.00 50.28 H new ATOM 0 HA TYR B 512 17.491 15.357 42.212 1.00 49.98 H new ATOM 0 HB2 TYR B 512 19.738 15.982 42.737 1.00 51.16 H new ATOM 0 HB3 TYR B 512 19.735 16.921 41.491 1.00 51.16 H new ATOM 0 HD1 TYR B 512 17.354 16.514 44.146 1.00 52.08 H new ATOM 0 HD2 TYR B 512 19.633 19.177 42.196 1.00 52.55 H new ATOM 0 HE1 TYR B 512 16.463 18.212 45.435 1.00 53.31 H new ATOM 0 HE2 TYR B 512 18.737 20.888 43.484 1.00 53.41 H new ATOM 0 HH TYR B 512 17.306 21.458 45.131 1.00 54.48 H new ATOM 2317 N ASP B 513 15.984 16.590 40.850 1.00 46.89 N ATOM 2318 CA ASP B 513 15.032 17.402 40.124 1.00 44.93 C ATOM 2319 C ASP B 513 14.469 18.329 41.194 1.00 43.76 C ATOM 2320 O ASP B 513 13.636 17.923 42.013 1.00 44.45 O ATOM 2321 CB ASP B 513 13.957 16.488 39.516 1.00 45.10 C ATOM 2322 CG ASP B 513 12.924 17.226 38.670 1.00 44.39 C ATOM 2323 OD1 ASP B 513 12.616 18.412 38.915 1.00 43.83 O ATOM 2324 OD2 ASP B 513 12.371 16.578 37.756 1.00 45.68 O ATOM 0 H ASP B 513 15.640 16.194 41.531 1.00 46.89 H new ATOM 0 HA ASP B 513 15.408 17.903 39.384 1.00 44.93 H new ATOM 0 HB2 ASP B 513 14.390 15.815 38.968 1.00 45.10 H new ATOM 0 HB3 ASP B 513 13.500 16.020 40.232 1.00 45.10 H new ATOM 2325 N GLU B 514 14.946 19.570 41.206 1.00 41.22 N ATOM 2326 CA GLU B 514 14.607 20.506 42.261 1.00 39.62 C ATOM 2327 C GLU B 514 13.110 20.792 42.309 1.00 38.92 C ATOM 2328 O GLU B 514 12.515 20.896 43.398 1.00 38.36 O ATOM 2329 CB GLU B 514 15.411 21.807 42.120 1.00 39.42 C ATOM 0 H GLU B 514 15.472 19.888 40.605 1.00 41.22 H new ATOM 0 HA GLU B 514 14.847 20.090 43.103 1.00 39.62 H new ATOM 2330 N TYR B 515 12.498 20.909 41.135 1.00 36.77 N ATOM 2331 CA TYR B 515 11.085 21.223 41.068 1.00 35.21 C ATOM 2332 C TYR B 515 10.235 20.071 41.599 1.00 33.40 C ATOM 2333 O TYR B 515 9.273 20.290 42.355 1.00 30.33 O ATOM 2334 CB TYR B 515 10.657 21.564 39.648 1.00 37.40 C ATOM 2335 CG TYR B 515 9.188 21.876 39.582 1.00 39.68 C ATOM 2336 CD1 TYR B 515 8.719 23.154 39.891 1.00 40.97 C ATOM 2337 CD2 TYR B 515 8.257 20.882 39.257 1.00 42.33 C ATOM 2338 CE1 TYR B 515 7.362 23.448 39.852 1.00 44.32 C ATOM 2339 CE2 TYR B 515 6.896 21.165 39.222 1.00 44.65 C ATOM 2340 CZ TYR B 515 6.461 22.451 39.519 1.00 42.71 C ATOM 2341 OH TYR B 515 5.117 22.745 39.482 1.00 45.77 O ATOM 0 H TYR B 515 12.884 20.810 40.373 1.00 36.77 H new ATOM 0 HA TYR B 515 10.942 22.001 41.629 1.00 35.21 H new ATOM 0 HB2 TYR B 515 11.166 22.325 39.328 1.00 37.40 H new ATOM 0 HB3 TYR B 515 10.859 20.820 39.059 1.00 37.40 H new ATOM 0 HD1 TYR B 515 9.325 23.819 40.127 1.00 40.97 H new ATOM 0 HD2 TYR B 515 8.552 20.022 39.062 1.00 42.33 H new ATOM 0 HE1 TYR B 515 7.062 24.306 40.048 1.00 44.32 H new ATOM 0 HE2 TYR B 515 6.283 20.501 39.002 1.00 44.65 H new ATOM 0 HH TYR B 515 4.685 22.057 39.267 1.00 45.77 H new ATOM 2342 N ARG B 516 10.598 18.863 41.174 1.00 31.60 N ATOM 2343 CA ARG B 516 9.913 17.634 41.567 1.00 31.41 C ATOM 2344 C ARG B 516 10.074 17.399 43.074 1.00 29.43 C ATOM 2345 O ARG B 516 9.122 17.003 43.753 1.00 30.29 O ATOM 2346 CB ARG B 516 10.493 16.448 40.787 1.00 31.36 C ATOM 2347 CG ARG B 516 9.548 15.262 40.610 1.00 35.43 C ATOM 2348 CD ARG B 516 10.335 13.948 40.551 1.00 37.73 C ATOM 2349 NE ARG B 516 9.771 12.928 39.664 1.00 43.11 N ATOM 2350 CZ ARG B 516 8.632 12.257 39.864 1.00 47.72 C ATOM 2351 NH1 ARG B 516 8.243 11.337 38.993 1.00 47.66 N ATOM 2352 NH2 ARG B 516 7.873 12.488 40.929 1.00 51.01 N ATOM 0 H ARG B 516 11.260 18.733 40.641 1.00 31.60 H new ATOM 0 HA ARG B 516 8.968 17.719 41.364 1.00 31.41 H new ATOM 0 HB2 ARG B 516 10.767 16.759 39.910 1.00 31.36 H new ATOM 0 HB3 ARG B 516 11.293 16.141 41.241 1.00 31.36 H new ATOM 0 HG2 ARG B 516 8.916 15.233 41.345 1.00 35.43 H new ATOM 0 HG3 ARG B 516 9.032 15.372 39.796 1.00 35.43 H new ATOM 0 HD2 ARG B 516 11.241 14.142 40.264 1.00 37.73 H new ATOM 0 HD3 ARG B 516 10.394 13.581 41.447 1.00 37.73 H new ATOM 0 HE ARG B 516 10.213 12.744 38.949 1.00 43.11 H new ATOM 0 HH11 ARG B 516 8.723 11.172 38.299 1.00 47.66 H new ATOM 0 HH12 ARG B 516 7.510 10.905 39.122 1.00 47.66 H new ATOM 0 HH21 ARG B 516 8.111 13.079 41.507 1.00 51.01 H new ATOM 0 HH22 ARG B 516 7.143 12.047 41.041 1.00 51.01 H new ATOM 2353 N TYR B 517 11.279 17.639 43.582 1.00 27.25 N ATOM 2354 CA TYR B 517 11.570 17.494 45.006 1.00 26.75 C ATOM 2355 C TYR B 517 10.722 18.431 45.860 1.00 25.94 C ATOM 2356 O TYR B 517 10.066 17.997 46.817 1.00 24.93 O ATOM 2357 CB TYR B 517 13.063 17.712 45.271 1.00 27.59 C ATOM 2358 CG TYR B 517 13.471 17.637 46.731 1.00 28.28 C ATOM 2359 CD1 TYR B 517 13.540 16.404 47.396 1.00 29.58 C ATOM 2360 CD2 TYR B 517 13.803 18.791 47.441 1.00 29.66 C ATOM 2361 CE1 TYR B 517 13.911 16.326 48.726 1.00 29.03 C ATOM 2362 CE2 TYR B 517 14.183 18.726 48.783 1.00 29.17 C ATOM 2363 CZ TYR B 517 14.237 17.485 49.416 1.00 28.18 C ATOM 2364 OH TYR B 517 14.615 17.387 50.734 1.00 26.86 O ATOM 0 H TYR B 517 11.952 17.891 43.110 1.00 27.25 H new ATOM 0 HA TYR B 517 11.338 16.588 45.262 1.00 26.75 H new ATOM 0 HB2 TYR B 517 13.567 17.049 44.774 1.00 27.59 H new ATOM 0 HB3 TYR B 517 13.316 18.581 44.922 1.00 27.59 H new ATOM 0 HD1 TYR B 517 13.332 15.624 46.934 1.00 29.58 H new ATOM 0 HD2 TYR B 517 13.771 19.616 47.014 1.00 29.66 H new ATOM 0 HE1 TYR B 517 13.942 15.502 49.155 1.00 29.03 H new ATOM 0 HE2 TYR B 517 14.398 19.502 49.249 1.00 29.17 H new ATOM 0 HH TYR B 517 14.851 18.143 51.015 1.00 26.86 H new ATOM 2365 N ARG B 518 10.744 19.720 45.521 1.00 25.48 N ATOM 2366 CA ARG B 518 9.984 20.708 46.258 1.00 25.34 C ATOM 2367 C ARG B 518 8.485 20.370 46.220 1.00 24.64 C ATOM 2368 O ARG B 518 7.781 20.508 47.221 1.00 24.82 O ATOM 2369 CB ARG B 518 10.257 22.125 45.705 1.00 26.31 C ATOM 0 H ARG B 518 11.197 20.037 44.863 1.00 25.48 H new ATOM 0 HA ARG B 518 10.269 20.693 47.185 1.00 25.34 H new ATOM 2370 N SER B 519 7.997 19.897 45.078 1.00 25.10 N ATOM 2371 CA SER B 519 6.578 19.542 44.981 1.00 26.32 C ATOM 2372 C SER B 519 6.213 18.309 45.847 1.00 24.72 C ATOM 2373 O SER B 519 5.150 18.267 46.460 1.00 23.23 O ATOM 2374 CB SER B 519 6.120 19.409 43.511 1.00 26.73 C ATOM 2375 OG SER B 519 6.130 18.065 43.065 1.00 33.03 O ATOM 0 H SER B 519 8.456 19.775 44.361 1.00 25.10 H new ATOM 0 HA SER B 519 6.074 20.280 45.358 1.00 26.32 H new ATOM 0 HB2 SER B 519 5.225 19.772 43.419 1.00 26.73 H new ATOM 0 HB3 SER B 519 6.701 19.940 42.944 1.00 26.73 H new ATOM 0 HG SER B 519 6.884 17.726 43.213 1.00 33.03 H new ATOM 2376 N VAL B 520 7.103 17.327 45.907 1.00 25.16 N ATOM 2377 CA VAL B 520 6.871 16.161 46.772 1.00 24.80 C ATOM 2378 C VAL B 520 6.939 16.563 48.258 1.00 24.42 C ATOM 2379 O VAL B 520 6.085 16.182 49.052 1.00 24.30 O ATOM 2380 CB VAL B 520 7.835 14.968 46.456 1.00 24.67 C ATOM 2381 CG1 VAL B 520 7.507 13.773 47.346 1.00 22.29 C ATOM 2382 CG2 VAL B 520 7.725 14.521 45.008 1.00 21.93 C ATOM 0 H VAL B 520 7.840 17.309 45.464 1.00 25.16 H new ATOM 0 HA VAL B 520 5.975 15.841 46.581 1.00 24.80 H new ATOM 0 HB VAL B 520 8.737 15.283 46.624 1.00 24.67 H new ATOM 0 HG11 VAL B 520 8.110 13.041 47.141 1.00 22.29 H new ATOM 0 HG12 VAL B 520 7.610 14.025 48.277 1.00 22.29 H new ATOM 0 HG13 VAL B 520 6.592 13.492 47.186 1.00 22.29 H new ATOM 0 HG21 VAL B 520 8.334 13.783 44.850 1.00 21.93 H new ATOM 0 HG22 VAL B 520 6.816 14.234 44.826 1.00 21.93 H new ATOM 0 HG23 VAL B 520 7.954 15.260 44.423 1.00 21.93 H new ATOM 2383 N ILE B 521 7.935 17.366 48.611 1.00 25.46 N ATOM 2384 CA ILE B 521 8.129 17.848 49.991 1.00 25.61 C ATOM 2385 C ILE B 521 6.872 18.534 50.509 1.00 24.72 C ATOM 2386 O ILE B 521 6.445 18.300 51.643 1.00 22.73 O ATOM 2387 CB ILE B 521 9.343 18.830 50.082 1.00 26.90 C ATOM 2388 CG1 ILE B 521 10.675 18.088 49.908 1.00 28.62 C ATOM 2389 CG2 ILE B 521 9.341 19.630 51.401 1.00 28.68 C ATOM 2390 CD1 ILE B 521 10.841 16.860 50.789 1.00 29.23 C ATOM 0 H ILE B 521 8.527 17.654 48.057 1.00 25.46 H new ATOM 0 HA ILE B 521 8.315 17.074 50.545 1.00 25.61 H new ATOM 0 HB ILE B 521 9.246 19.462 49.353 1.00 26.90 H new ATOM 0 HG12 ILE B 521 10.762 17.819 48.980 1.00 28.62 H new ATOM 0 HG13 ILE B 521 11.401 18.704 50.094 1.00 28.62 H new ATOM 0 HG21 ILE B 521 10.106 20.226 51.420 1.00 28.68 H new ATOM 0 HG22 ILE B 521 8.525 20.151 51.463 1.00 28.68 H new ATOM 0 HG23 ILE B 521 9.390 19.017 52.151 1.00 28.68 H new ATOM 0 HD11 ILE B 521 11.705 16.453 50.617 1.00 29.23 H new ATOM 0 HD12 ILE B 521 10.787 17.121 51.722 1.00 29.23 H new ATOM 0 HD13 ILE B 521 10.138 16.222 50.591 1.00 29.23 H new ATOM 2391 N LYS B 522 6.289 19.382 49.663 1.00 24.48 N ATOM 2392 CA LYS B 522 5.074 20.114 49.996 1.00 25.85 C ATOM 2393 C LYS B 522 3.892 19.181 50.168 1.00 24.63 C ATOM 2394 O LYS B 522 3.132 19.313 51.120 1.00 24.15 O ATOM 2395 CB LYS B 522 4.746 21.101 48.880 1.00 26.42 C ATOM 2396 CG LYS B 522 5.454 22.428 48.993 1.00 31.21 C ATOM 2397 CD LYS B 522 5.483 23.110 47.624 1.00 34.77 C ATOM 2398 CE LYS B 522 5.275 24.613 47.713 1.00 37.44 C ATOM 2399 NZ LYS B 522 5.846 25.265 48.919 1.00 39.02 N ATOM 0 H LYS B 522 6.591 19.548 48.875 1.00 24.48 H new ATOM 0 HA LYS B 522 5.233 20.579 50.832 1.00 25.85 H new ATOM 0 HB2 LYS B 522 4.974 20.697 48.028 1.00 26.42 H new ATOM 0 HB3 LYS B 522 3.789 21.257 48.872 1.00 26.42 H new ATOM 0 HG2 LYS B 522 5.000 22.994 49.637 1.00 31.21 H new ATOM 0 HG3 LYS B 522 6.358 22.296 49.319 1.00 31.21 H new ATOM 0 HD2 LYS B 522 6.334 22.930 47.195 1.00 34.77 H new ATOM 0 HD3 LYS B 522 4.794 22.725 47.060 1.00 34.77 H new ATOM 0 HE2 LYS B 522 5.665 25.025 46.926 1.00 37.44 H new ATOM 0 HE3 LYS B 522 4.323 24.795 47.686 1.00 37.44 H new ATOM 0 HZ1 LYS B 522 6.038 26.114 48.735 1.00 39.02 H new ATOM 0 HZ2 LYS B 522 5.254 25.233 49.583 1.00 39.02 H new ATOM 0 HZ3 LYS B 522 6.589 24.840 49.163 1.00 39.02 H new ATOM 2400 N ALA B 523 3.733 18.243 49.230 1.00 24.82 N ATOM 2401 CA ALA B 523 2.550 17.375 49.217 1.00 24.40 C ATOM 2402 C ALA B 523 2.578 16.388 50.375 1.00 24.48 C ATOM 2403 O ALA B 523 1.522 16.013 50.919 1.00 23.75 O ATOM 2404 CB ALA B 523 2.429 16.655 47.876 1.00 25.29 C ATOM 0 H ALA B 523 4.294 18.093 48.596 1.00 24.82 H new ATOM 0 HA ALA B 523 1.764 17.932 49.331 1.00 24.40 H new ATOM 0 HB1 ALA B 523 1.643 16.086 47.884 1.00 25.29 H new ATOM 0 HB2 ALA B 523 2.348 17.308 47.164 1.00 25.29 H new ATOM 0 HB3 ALA B 523 3.219 16.112 47.727 1.00 25.29 H new ATOM 2405 N CYS B 524 3.796 15.995 50.766 1.00 24.00 N ATOM 2406 CA CYS B 524 4.003 15.073 51.880 1.00 25.08 C ATOM 2407 C CYS B 524 4.076 15.811 53.210 1.00 25.51 C ATOM 2408 O CYS B 524 4.452 15.239 54.220 1.00 25.88 O ATOM 2409 CB CYS B 524 5.253 14.212 51.650 1.00 23.59 C ATOM 2410 SG CYS B 524 4.997 13.063 50.295 1.00 26.78 S ATOM 0 H CYS B 524 4.523 16.258 50.390 1.00 24.00 H new ATOM 0 HA CYS B 524 3.235 14.482 51.922 1.00 25.08 H new ATOM 0 HB2 CYS B 524 6.013 14.783 51.456 1.00 23.59 H new ATOM 0 HB3 CYS B 524 5.466 13.722 52.459 1.00 23.59 H new ATOM 0 HG CYS B 524 5.250 13.607 49.256 1.00 26.78 H new ATOM 2411 N GLN B 525 3.681 17.082 53.204 1.00 26.74 N ATOM 2412 CA GLN B 525 3.624 17.897 54.431 1.00 27.70 C ATOM 2413 C GLN B 525 4.942 17.914 55.227 1.00 26.85 C ATOM 2414 O GLN B 525 4.929 17.795 56.459 1.00 27.06 O ATOM 2415 CB GLN B 525 2.465 17.435 55.332 1.00 28.04 C ATOM 2416 CG GLN B 525 1.145 17.194 54.601 1.00 31.97 C ATOM 2417 CD GLN B 525 0.557 18.439 53.988 1.00 36.67 C ATOM 2418 OE1 GLN B 525 0.320 19.428 54.683 1.00 36.14 O ATOM 2419 NE2 GLN B 525 0.294 18.394 52.670 1.00 37.49 N ATOM 0 H GLN B 525 3.438 17.501 52.493 1.00 26.74 H new ATOM 0 HA GLN B 525 3.471 18.809 54.139 1.00 27.70 H new ATOM 0 HB2 GLN B 525 2.727 16.616 55.780 1.00 28.04 H new ATOM 0 HB3 GLN B 525 2.322 18.102 56.021 1.00 28.04 H new ATOM 0 HG2 GLN B 525 1.286 16.535 53.903 1.00 31.97 H new ATOM 0 HG3 GLN B 525 0.504 16.815 55.223 1.00 31.97 H new ATOM 0 HE21 GLN B 525 0.474 17.684 52.220 1.00 37.49 H new ATOM 0 HE22 GLN B 525 -0.055 19.075 52.278 1.00 37.49 H new ATOM 2420 N LEU B 526 6.063 18.082 54.527 1.00 25.90 N ATOM 2421 CA LEU B 526 7.382 18.039 55.155 1.00 26.16 C ATOM 2422 C LEU B 526 8.112 19.387 55.206 1.00 28.21 C ATOM 2423 O LEU B 526 9.188 19.494 55.793 1.00 28.14 O ATOM 2424 CB LEU B 526 8.272 17.016 54.438 1.00 25.17 C ATOM 2425 CG LEU B 526 8.025 15.525 54.715 1.00 23.17 C ATOM 2426 CD1 LEU B 526 8.971 14.690 53.833 1.00 21.61 C ATOM 2427 CD2 LEU B 526 8.247 15.227 56.203 1.00 21.72 C ATOM 0 H LEU B 526 6.080 18.223 53.679 1.00 25.90 H new ATOM 0 HA LEU B 526 7.218 17.782 56.076 1.00 26.16 H new ATOM 0 HB2 LEU B 526 8.180 17.160 53.483 1.00 25.17 H new ATOM 0 HB3 LEU B 526 9.194 17.212 54.667 1.00 25.17 H new ATOM 0 HG LEU B 526 7.109 15.292 54.499 1.00 23.17 H new ATOM 0 HD11 LEU B 526 8.822 13.746 54.001 1.00 21.61 H new ATOM 0 HD12 LEU B 526 8.797 14.883 52.898 1.00 21.61 H new ATOM 0 HD13 LEU B 526 9.891 14.914 54.043 1.00 21.61 H new ATOM 0 HD21 LEU B 526 8.090 14.285 56.372 1.00 21.72 H new ATOM 0 HD22 LEU B 526 9.159 15.450 56.445 1.00 21.72 H new ATOM 0 HD23 LEU B 526 7.633 15.757 56.735 1.00 21.72 H new ATOM 2428 N GLU B 527 7.537 20.395 54.568 1.00 30.16 N ATOM 2429 CA GLU B 527 8.166 21.705 54.471 1.00 32.56 C ATOM 2430 C GLU B 527 8.364 22.344 55.841 1.00 32.13 C ATOM 2431 O GLU B 527 9.466 22.779 56.162 1.00 32.07 O ATOM 2432 CB GLU B 527 7.333 22.622 53.582 1.00 34.42 C ATOM 2433 CG GLU B 527 7.953 22.903 52.225 1.00 39.64 C ATOM 2434 CD GLU B 527 7.316 24.094 51.517 1.00 44.80 C ATOM 2435 OE1 GLU B 527 7.775 24.427 50.405 1.00 49.67 O ATOM 2436 OE2 GLU B 527 6.365 24.701 52.056 1.00 47.52 O ATOM 0 H GLU B 527 6.772 20.341 54.179 1.00 30.16 H new ATOM 0 HA GLU B 527 9.043 21.580 54.076 1.00 32.56 H new ATOM 0 HB2 GLU B 527 6.459 22.222 53.451 1.00 34.42 H new ATOM 0 HB3 GLU B 527 7.193 23.464 54.043 1.00 34.42 H new ATOM 0 HG2 GLU B 527 8.902 23.069 52.336 1.00 39.64 H new ATOM 0 HG3 GLU B 527 7.866 22.115 51.665 1.00 39.64 H new ATOM 2437 N GLU B 528 7.299 22.393 56.640 1.00 31.70 N ATOM 2438 CA GLU B 528 7.390 22.916 57.999 1.00 32.91 C ATOM 2439 C GLU B 528 8.374 22.103 58.834 1.00 33.68 C ATOM 2440 O GLU B 528 9.225 22.686 59.509 1.00 34.13 O ATOM 2441 CB GLU B 528 6.012 22.978 58.668 1.00 32.87 C ATOM 0 H GLU B 528 6.513 22.127 56.412 1.00 31.70 H new ATOM 0 HA GLU B 528 7.727 23.824 57.943 1.00 32.91 H new ATOM 2442 N ASP B 529 8.280 20.766 58.762 1.00 33.34 N ATOM 2443 CA ASP B 529 9.227 19.869 59.452 1.00 34.45 C ATOM 2444 C ASP B 529 10.685 20.202 59.191 1.00 34.62 C ATOM 2445 O ASP B 529 11.450 20.399 60.134 1.00 34.94 O ATOM 2446 CB ASP B 529 8.988 18.395 59.100 1.00 33.88 C ATOM 2447 CG ASP B 529 7.714 17.852 59.702 1.00 36.56 C ATOM 2448 OD1 ASP B 529 7.618 17.710 60.942 1.00 36.13 O ATOM 2449 OD2 ASP B 529 6.803 17.545 58.920 1.00 41.93 O ATOM 0 H ASP B 529 7.670 20.356 58.315 1.00 33.34 H new ATOM 0 HA ASP B 529 9.050 20.014 60.395 1.00 34.45 H new ATOM 0 HB2 ASP B 529 8.953 18.298 58.135 1.00 33.88 H new ATOM 0 HB3 ASP B 529 9.739 17.866 59.411 1.00 33.88 H new ATOM 2450 N ILE B 530 11.072 20.273 57.923 1.00 35.63 N ATOM 2451 CA ILE B 530 12.478 20.550 57.590 1.00 37.50 C ATOM 2452 C ILE B 530 12.902 21.980 57.978 1.00 38.23 C ATOM 2453 O ILE B 530 14.077 22.224 58.254 1.00 38.20 O ATOM 2454 CB ILE B 530 12.833 20.234 56.104 1.00 37.15 C ATOM 2455 CG1 ILE B 530 12.135 21.197 55.149 1.00 39.83 C ATOM 2456 CG2 ILE B 530 12.482 18.779 55.754 1.00 36.78 C ATOM 2457 CD1 ILE B 530 12.981 21.596 53.955 1.00 41.18 C ATOM 0 H ILE B 530 10.552 20.167 57.246 1.00 35.63 H new ATOM 0 HA ILE B 530 12.996 19.936 58.133 1.00 37.50 H new ATOM 0 HB ILE B 530 13.790 20.352 56.001 1.00 37.15 H new ATOM 0 HG12 ILE B 530 11.315 20.787 54.831 1.00 39.83 H new ATOM 0 HG13 ILE B 530 11.882 21.996 55.637 1.00 39.83 H new ATOM 0 HG21 ILE B 530 12.710 18.605 54.828 1.00 36.78 H new ATOM 0 HG22 ILE B 530 12.982 18.178 56.328 1.00 36.78 H new ATOM 0 HG23 ILE B 530 11.532 18.635 55.885 1.00 36.78 H new ATOM 0 HD11 ILE B 530 12.479 22.206 53.392 1.00 41.18 H new ATOM 0 HD12 ILE B 530 13.790 22.033 54.263 1.00 41.18 H new ATOM 0 HD13 ILE B 530 13.215 20.805 53.445 1.00 41.18 H new ATOM 2458 N SER B 531 11.939 22.903 58.017 1.00 39.18 N ATOM 2459 CA SER B 531 12.174 24.294 58.462 1.00 40.37 C ATOM 2460 C SER B 531 12.482 24.441 59.963 1.00 40.84 C ATOM 2461 O SER B 531 12.631 25.563 60.467 1.00 40.65 O ATOM 2462 CB SER B 531 10.967 25.170 58.119 1.00 40.16 C ATOM 2463 OG SER B 531 10.823 25.315 56.719 1.00 43.24 O ATOM 0 H SER B 531 11.126 22.746 57.786 1.00 39.18 H new ATOM 0 HA SER B 531 12.967 24.583 57.984 1.00 40.37 H new ATOM 0 HB2 SER B 531 10.162 24.776 58.491 1.00 40.16 H new ATOM 0 HB3 SER B 531 11.071 26.043 58.528 1.00 40.16 H new ATOM 0 HG SER B 531 10.437 24.638 56.405 1.00 43.24 H new ATOM 2464 N LYS B 532 12.563 23.319 60.673 1.00 41.05 N ATOM 2465 CA LYS B 532 12.783 23.330 62.117 1.00 41.36 C ATOM 2466 C LYS B 532 14.209 22.915 62.458 1.00 41.55 C ATOM 2467 O LYS B 532 14.682 23.162 63.570 1.00 41.36 O ATOM 2468 CB LYS B 532 11.776 22.418 62.828 1.00 41.53 C ATOM 0 H LYS B 532 12.492 22.532 60.333 1.00 41.05 H new ATOM 0 HA LYS B 532 12.650 24.238 62.430 1.00 41.36 H new ATOM 2469 N PHE B 533 14.883 22.294 61.488 1.00 41.19 N ATOM 2470 CA PHE B 533 16.246 21.821 61.657 1.00 41.54 C ATOM 2471 C PHE B 533 17.226 22.881 61.193 1.00 42.25 C ATOM 2472 O PHE B 533 17.041 23.475 60.128 1.00 41.82 O ATOM 2473 CB PHE B 533 16.478 20.539 60.854 1.00 41.77 C ATOM 2474 CG PHE B 533 15.432 19.480 61.073 1.00 42.34 C ATOM 2475 CD1 PHE B 533 15.030 19.126 62.360 1.00 43.42 C ATOM 2476 CD2 PHE B 533 14.867 18.814 59.991 1.00 41.49 C ATOM 2477 CE1 PHE B 533 14.063 18.144 62.565 1.00 44.35 C ATOM 2478 CE2 PHE B 533 13.906 17.818 60.187 1.00 43.67 C ATOM 2479 CZ PHE B 533 13.506 17.484 61.478 1.00 43.42 C ATOM 0 H PHE B 533 14.554 22.137 60.709 1.00 41.19 H new ATOM 0 HA PHE B 533 16.386 21.635 62.599 1.00 41.54 H new ATOM 0 HB2 PHE B 533 16.507 20.761 59.910 1.00 41.77 H new ATOM 0 HB3 PHE B 533 17.347 20.175 61.087 1.00 41.77 H new ATOM 0 HD1 PHE B 533 15.413 19.552 63.093 1.00 43.42 H new ATOM 0 HD2 PHE B 533 15.132 19.034 59.127 1.00 41.49 H new ATOM 0 HE1 PHE B 533 13.791 17.931 63.429 1.00 44.35 H new ATOM 0 HE2 PHE B 533 13.534 17.379 59.456 1.00 43.67 H new ATOM 0 HZ PHE B 533 12.868 16.821 61.612 1.00 43.42 H new ATOM 2480 N ALA B 534 18.271 23.104 61.992 1.00 43.20 N ATOM 2481 CA ALA B 534 19.326 24.074 61.667 1.00 44.16 C ATOM 2482 C ALA B 534 19.820 23.946 60.218 1.00 44.43 C ATOM 2483 O ALA B 534 19.947 24.951 59.499 1.00 45.17 O ATOM 2484 CB ALA B 534 20.492 23.939 62.652 1.00 44.63 C ATOM 0 H ALA B 534 18.390 22.697 62.740 1.00 43.20 H new ATOM 0 HA ALA B 534 18.938 24.959 61.751 1.00 44.16 H new ATOM 0 HB1 ALA B 534 21.181 24.583 62.428 1.00 44.63 H new ATOM 0 HB2 ALA B 534 20.175 24.105 63.554 1.00 44.63 H new ATOM 0 HB3 ALA B 534 20.859 23.042 62.599 1.00 44.63 H new ATOM 2485 N GLU B 535 20.058 22.707 59.794 1.00 44.39 N ATOM 2486 CA GLU B 535 20.591 22.411 58.462 1.00 44.43 C ATOM 2487 C GLU B 535 19.492 21.967 57.477 1.00 42.97 C ATOM 2488 O GLU B 535 19.786 21.453 56.399 1.00 42.75 O ATOM 2489 CB GLU B 535 21.671 21.333 58.565 1.00 44.90 C ATOM 2490 CG GLU B 535 22.814 21.671 59.518 1.00 48.93 C ATOM 2491 CD GLU B 535 23.519 20.434 60.041 1.00 51.84 C ATOM 2492 OE1 GLU B 535 24.684 20.217 59.662 1.00 52.22 O ATOM 2493 OE2 GLU B 535 22.908 19.669 60.825 1.00 55.06 O ATOM 0 H GLU B 535 19.914 22.008 60.274 1.00 44.39 H new ATOM 0 HA GLU B 535 20.975 23.230 58.112 1.00 44.43 H new ATOM 0 HB2 GLU B 535 21.258 20.504 58.854 1.00 44.90 H new ATOM 0 HB3 GLU B 535 22.038 21.174 57.681 1.00 44.90 H new ATOM 0 HG2 GLU B 535 23.456 22.237 59.061 1.00 48.93 H new ATOM 0 HG3 GLU B 535 22.467 22.183 60.266 1.00 48.93 H new ATOM 2494 N LYS B 536 18.238 22.192 57.856 1.00 41.90 N ATOM 2495 CA LYS B 536 17.068 21.820 57.058 1.00 40.15 C ATOM 2496 C LYS B 536 17.175 20.369 56.554 1.00 39.62 C ATOM 2497 O LYS B 536 17.487 19.474 57.338 1.00 38.68 O ATOM 2498 CB LYS B 536 16.826 22.830 55.932 1.00 40.11 C ATOM 0 H LYS B 536 18.037 22.573 58.600 1.00 41.90 H new ATOM 0 HA LYS B 536 16.284 21.852 57.629 1.00 40.15 H new ATOM 2499 N ASP B 537 16.945 20.141 55.262 1.00 39.00 N ATOM 2500 CA ASP B 537 16.941 18.779 54.724 1.00 38.98 C ATOM 2501 C ASP B 537 18.336 18.197 54.505 1.00 39.02 C ATOM 2502 O ASP B 537 18.483 17.091 53.992 1.00 37.97 O ATOM 2503 CB ASP B 537 16.072 18.661 53.463 1.00 38.93 C ATOM 2504 CG ASP B 537 16.354 19.735 52.436 1.00 40.96 C ATOM 2505 OD1 ASP B 537 17.194 20.630 52.687 1.00 43.93 O ATOM 2506 OD2 ASP B 537 15.716 19.686 51.361 1.00 39.53 O ATOM 0 H ASP B 537 16.790 20.757 54.682 1.00 39.00 H new ATOM 0 HA ASP B 537 16.535 18.232 55.415 1.00 38.98 H new ATOM 0 HB2 ASP B 537 16.216 17.791 53.059 1.00 38.93 H new ATOM 0 HB3 ASP B 537 15.137 18.704 53.718 1.00 38.93 H new ATOM 2507 N ASN B 538 19.356 18.942 54.920 1.00 40.18 N ATOM 2508 CA ASN B 538 20.733 18.438 54.901 1.00 40.75 C ATOM 2509 C ASN B 538 21.173 17.809 56.214 1.00 41.46 C ATOM 2510 O ASN B 538 22.339 17.430 56.369 1.00 42.37 O ATOM 2511 CB ASN B 538 21.700 19.530 54.455 1.00 40.87 C ATOM 2512 CG ASN B 538 21.436 19.974 53.043 1.00 41.83 C ATOM 2513 OD1 ASN B 538 21.275 19.147 52.139 1.00 39.66 O ATOM 2514 ND2 ASN B 538 21.367 21.284 52.841 1.00 41.48 N ATOM 0 H ASN B 538 19.275 19.745 55.218 1.00 40.18 H new ATOM 0 HA ASN B 538 20.751 17.718 54.251 1.00 40.75 H new ATOM 0 HB2 ASN B 538 21.625 20.291 55.052 1.00 40.87 H new ATOM 0 HB3 ASN B 538 22.611 19.203 54.525 1.00 40.87 H new ATOM 0 HD21 ASN B 538 21.204 21.590 52.054 1.00 41.48 H new ATOM 0 HD22 ASN B 538 21.485 21.827 53.497 1.00 41.48 H new ATOM 2515 N ILE B 539 20.235 17.681 57.151 1.00 42.12 N ATOM 2516 CA ILE B 539 20.493 16.972 58.410 1.00 43.09 C ATOM 2517 C ILE B 539 20.713 15.486 58.128 1.00 43.57 C ATOM 2518 O ILE B 539 19.950 14.865 57.381 1.00 42.83 O ATOM 2519 CB ILE B 539 19.383 17.222 59.488 1.00 43.43 C ATOM 2520 CG1 ILE B 539 19.744 16.579 60.841 1.00 45.65 C ATOM 2521 CG2 ILE B 539 18.005 16.736 59.004 1.00 42.92 C ATOM 2522 CD1 ILE B 539 21.093 17.022 61.441 1.00 47.70 C ATOM 0 H ILE B 539 19.439 17.998 57.079 1.00 42.12 H new ATOM 0 HA ILE B 539 21.305 17.334 58.799 1.00 43.09 H new ATOM 0 HB ILE B 539 19.332 18.181 59.621 1.00 43.43 H new ATOM 0 HG12 ILE B 539 19.041 16.783 61.477 1.00 45.65 H new ATOM 0 HG13 ILE B 539 19.756 15.615 60.731 1.00 45.65 H new ATOM 0 HG21 ILE B 539 17.342 16.905 59.692 1.00 42.92 H new ATOM 0 HG22 ILE B 539 17.759 17.212 58.195 1.00 42.92 H new ATOM 0 HG23 ILE B 539 18.044 15.785 58.819 1.00 42.92 H new ATOM 0 HD11 ILE B 539 21.235 16.569 62.287 1.00 47.70 H new ATOM 0 HD12 ILE B 539 21.810 16.795 60.828 1.00 47.70 H new ATOM 0 HD13 ILE B 539 21.084 17.981 61.586 1.00 47.70 H new ATOM 2523 N VAL B 540 21.784 14.942 58.703 1.00 43.89 N ATOM 2524 CA VAL B 540 22.156 13.558 58.483 1.00 44.30 C ATOM 2525 C VAL B 540 21.396 12.667 59.438 1.00 45.30 C ATOM 2526 O VAL B 540 21.309 12.941 60.633 1.00 45.40 O ATOM 2527 CB VAL B 540 23.689 13.334 58.584 1.00 44.37 C ATOM 2528 CG1 VAL B 540 24.035 11.845 58.644 1.00 42.58 C ATOM 2529 CG2 VAL B 540 24.369 13.959 57.395 1.00 44.03 C ATOM 0 H VAL B 540 22.312 15.369 59.231 1.00 43.89 H new ATOM 0 HA VAL B 540 21.912 13.322 57.574 1.00 44.30 H new ATOM 0 HB VAL B 540 24.000 13.750 59.403 1.00 44.37 H new ATOM 0 HG11 VAL B 540 24.997 11.738 58.706 1.00 42.58 H new ATOM 0 HG12 VAL B 540 23.615 11.446 59.422 1.00 42.58 H new ATOM 0 HG13 VAL B 540 23.713 11.405 57.842 1.00 42.58 H new ATOM 0 HG21 VAL B 540 25.327 13.819 57.459 1.00 44.03 H new ATOM 0 HG22 VAL B 540 24.036 13.551 56.580 1.00 44.03 H new ATOM 0 HG23 VAL B 540 24.183 14.911 57.379 1.00 44.03 H new ATOM 2530 N LEU B 541 20.830 11.606 58.879 1.00 46.14 N ATOM 2531 CA LEU B 541 20.090 10.627 59.649 1.00 47.24 C ATOM 2532 C LEU B 541 20.908 9.351 59.741 1.00 48.05 C ATOM 2533 O LEU B 541 21.705 9.045 58.853 1.00 48.16 O ATOM 2534 CB LEU B 541 18.731 10.335 58.996 1.00 46.08 C ATOM 2535 CG LEU B 541 17.842 11.531 58.647 1.00 45.65 C ATOM 2536 CD1 LEU B 541 16.691 11.092 57.758 1.00 44.12 C ATOM 2537 CD2 LEU B 541 17.327 12.239 59.896 1.00 43.59 C ATOM 0 H LEU B 541 20.866 11.435 58.037 1.00 46.14 H new ATOM 0 HA LEU B 541 19.927 10.979 60.538 1.00 47.24 H new ATOM 0 HB2 LEU B 541 18.892 9.834 58.181 1.00 46.08 H new ATOM 0 HB3 LEU B 541 18.232 9.755 59.591 1.00 46.08 H new ATOM 0 HG LEU B 541 18.385 12.171 58.160 1.00 45.65 H new ATOM 0 HD11 LEU B 541 16.136 11.858 57.545 1.00 44.12 H new ATOM 0 HD12 LEU B 541 17.042 10.710 56.939 1.00 44.12 H new ATOM 0 HD13 LEU B 541 16.159 10.427 58.222 1.00 44.12 H new ATOM 0 HD21 LEU B 541 16.769 12.989 59.636 1.00 43.59 H new ATOM 0 HD22 LEU B 541 16.806 11.618 60.428 1.00 43.59 H new ATOM 0 HD23 LEU B 541 18.078 12.561 60.419 1.00 43.59 H new ATOM 2538 N GLY B 542 20.726 8.630 60.838 1.00 48.87 N ATOM 2539 CA GLY B 542 21.246 7.284 60.951 1.00 50.01 C ATOM 2540 C GLY B 542 20.215 6.381 60.321 1.00 50.85 C ATOM 2541 O GLY B 542 19.183 6.856 59.830 1.00 50.60 O ATOM 0 H GLY B 542 20.300 8.908 61.532 1.00 48.87 H new ATOM 0 HA2 GLY B 542 22.100 7.203 60.498 1.00 50.01 H new ATOM 0 HA3 GLY B 542 21.394 7.046 61.880 1.00 50.01 H new ATOM 2542 N GLU B 543 20.489 5.080 60.324 1.00 51.51 N ATOM 2543 CA GLU B 543 19.519 4.103 59.839 1.00 52.08 C ATOM 2544 C GLU B 543 18.363 4.017 60.834 1.00 50.99 C ATOM 2545 O GLU B 543 18.575 4.078 62.047 1.00 51.23 O ATOM 2546 CB GLU B 543 20.186 2.738 59.647 1.00 52.09 C ATOM 2547 CG GLU B 543 19.424 1.798 58.717 1.00 54.78 C ATOM 2548 CD GLU B 543 20.268 0.629 58.226 1.00 53.97 C ATOM 2549 OE1 GLU B 543 20.175 0.299 57.022 1.00 58.03 O ATOM 2550 OE2 GLU B 543 21.022 0.042 59.033 1.00 56.44 O ATOM 0 H GLU B 543 21.229 4.743 60.602 1.00 51.51 H new ATOM 0 HA GLU B 543 19.174 4.383 58.977 1.00 52.08 H new ATOM 0 HB2 GLU B 543 21.080 2.872 59.294 1.00 52.09 H new ATOM 0 HB3 GLU B 543 20.284 2.312 60.513 1.00 52.09 H new ATOM 0 HG2 GLU B 543 18.644 1.455 59.181 1.00 54.78 H new ATOM 0 HG3 GLU B 543 19.101 2.300 57.953 1.00 54.78 H new ATOM 2551 N GLY B 544 17.145 3.886 60.317 1.00 50.13 N ATOM 2552 CA GLY B 544 15.934 3.947 61.135 1.00 49.03 C ATOM 2553 C GLY B 544 15.478 5.366 61.431 1.00 48.28 C ATOM 2554 O GLY B 544 14.300 5.602 61.700 1.00 48.78 O ATOM 0 H GLY B 544 16.996 3.759 59.480 1.00 50.13 H new ATOM 0 HA2 GLY B 544 15.220 3.473 60.680 1.00 49.03 H new ATOM 0 HA3 GLY B 544 16.093 3.484 61.972 1.00 49.03 H new ATOM 2555 N GLY B 545 16.407 6.317 61.377 1.00 47.55 N ATOM 2556 CA GLY B 545 16.100 7.710 61.677 1.00 46.72 C ATOM 2557 C GLY B 545 15.629 7.825 63.108 1.00 46.41 C ATOM 2558 O GLY B 545 14.491 8.242 63.367 1.00 46.17 O ATOM 0 H GLY B 545 17.228 6.173 61.166 1.00 47.55 H new ATOM 0 HA2 GLY B 545 16.886 8.261 61.540 1.00 46.72 H new ATOM 0 HA3 GLY B 545 15.415 8.038 61.073 1.00 46.72 H new ATOM 2559 N ILE B 546 16.509 7.429 64.031 1.00 45.81 N ATOM 2560 CA ILE B 546 16.212 7.378 65.472 1.00 45.01 C ATOM 2561 C ILE B 546 15.795 8.751 65.980 1.00 44.13 C ATOM 2562 O ILE B 546 14.961 8.862 66.882 1.00 44.78 O ATOM 2563 CB ILE B 546 17.440 6.901 66.293 1.00 45.19 C ATOM 0 H ILE B 546 17.308 7.178 63.837 1.00 45.81 H new ATOM 0 HA ILE B 546 15.487 6.744 65.589 1.00 45.01 H new ATOM 2564 N THR B 547 16.362 9.786 65.366 1.00 42.17 N ATOM 2565 CA THR B 547 16.119 11.159 65.776 1.00 40.91 C ATOM 2566 C THR B 547 14.910 11.825 65.087 1.00 37.88 C ATOM 2567 O THR B 547 14.679 13.024 65.270 1.00 39.21 O ATOM 2568 CB THR B 547 17.408 12.031 65.635 1.00 41.63 C ATOM 2569 OG1 THR B 547 17.846 12.067 64.272 1.00 44.06 O ATOM 2570 CG2 THR B 547 18.531 11.466 66.504 1.00 43.50 C ATOM 0 H THR B 547 16.899 9.708 64.699 1.00 42.17 H new ATOM 0 HA THR B 547 15.880 11.107 66.715 1.00 40.91 H new ATOM 0 HB THR B 547 17.193 12.931 65.927 1.00 41.63 H new ATOM 0 HG1 THR B 547 18.538 12.540 64.212 1.00 44.06 H new ATOM 0 HG21 THR B 547 19.324 12.016 66.407 1.00 43.50 H new ATOM 0 HG22 THR B 547 18.252 11.464 67.433 1.00 43.50 H new ATOM 0 HG23 THR B 547 18.731 10.559 66.225 1.00 43.50 H new ATOM 2571 N LEU B 548 14.146 11.061 64.311 1.00 33.19 N ATOM 2572 CA LEU B 548 12.907 11.571 63.694 1.00 30.01 C ATOM 2573 C LEU B 548 11.672 11.152 64.485 1.00 28.20 C ATOM 2574 O LEU B 548 11.672 10.112 65.135 1.00 27.31 O ATOM 2575 CB LEU B 548 12.759 11.054 62.259 1.00 28.87 C ATOM 2576 CG LEU B 548 13.867 11.407 61.259 1.00 30.97 C ATOM 2577 CD1 LEU B 548 13.772 10.492 60.037 1.00 29.08 C ATOM 2578 CD2 LEU B 548 13.815 12.885 60.866 1.00 26.31 C ATOM 0 H LEU B 548 14.322 10.240 64.124 1.00 33.19 H new ATOM 0 HA LEU B 548 12.974 12.539 63.694 1.00 30.01 H new ATOM 0 HB2 LEU B 548 12.686 10.087 62.296 1.00 28.87 H new ATOM 0 HB3 LEU B 548 11.920 11.389 61.906 1.00 28.87 H new ATOM 0 HG LEU B 548 14.727 11.263 61.683 1.00 30.97 H new ATOM 0 HD11 LEU B 548 14.474 10.719 59.407 1.00 29.08 H new ATOM 0 HD12 LEU B 548 13.874 9.568 60.315 1.00 29.08 H new ATOM 0 HD13 LEU B 548 12.908 10.608 59.612 1.00 29.08 H new ATOM 0 HD21 LEU B 548 14.526 13.077 60.235 1.00 26.31 H new ATOM 0 HD22 LEU B 548 12.958 13.081 60.457 1.00 26.31 H new ATOM 0 HD23 LEU B 548 13.929 13.435 61.657 1.00 26.31 H new ATOM 2579 N SER B 549 10.610 11.941 64.406 1.00 25.33 N ATOM 2580 CA SER B 549 9.324 11.489 64.919 1.00 22.97 C ATOM 2581 C SER B 549 8.794 10.335 64.055 1.00 22.84 C ATOM 2582 O SER B 549 9.260 10.126 62.927 1.00 20.98 O ATOM 2583 CB SER B 549 8.334 12.648 65.022 1.00 22.69 C ATOM 2584 OG SER B 549 7.818 13.047 63.775 1.00 20.36 O ATOM 0 H SER B 549 10.610 12.730 64.065 1.00 25.33 H new ATOM 0 HA SER B 549 9.441 11.151 65.821 1.00 22.97 H new ATOM 0 HB2 SER B 549 7.600 12.389 65.601 1.00 22.69 H new ATOM 0 HB3 SER B 549 8.773 13.405 65.441 1.00 22.69 H new ATOM 0 HG SER B 549 7.280 13.683 63.885 1.00 20.36 H new ATOM 2585 N GLY B 550 7.870 9.551 64.612 1.00 22.44 N ATOM 2586 CA GLY B 550 7.203 8.467 63.881 1.00 21.41 C ATOM 2587 C GLY B 550 6.576 8.952 62.585 1.00 21.51 C ATOM 2588 O GLY B 550 6.766 8.343 61.530 1.00 20.37 O ATOM 0 H GLY B 550 7.610 9.632 65.428 1.00 22.44 H new ATOM 0 HA2 GLY B 550 7.846 7.767 63.686 1.00 21.41 H new ATOM 0 HA3 GLY B 550 6.517 8.074 64.443 1.00 21.41 H new ATOM 2589 N GLY B 551 5.866 10.073 62.667 1.00 21.81 N ATOM 2590 CA GLY B 551 5.236 10.691 61.513 1.00 21.73 C ATOM 2591 C GLY B 551 6.161 11.302 60.468 1.00 21.37 C ATOM 2592 O GLY B 551 5.809 11.317 59.288 1.00 21.86 O ATOM 0 H GLY B 551 5.737 10.498 63.403 1.00 21.81 H new ATOM 0 HA2 GLY B 551 4.686 10.023 61.075 1.00 21.73 H new ATOM 0 HA3 GLY B 551 4.639 11.386 61.831 1.00 21.73 H new ATOM 2593 N GLN B 552 7.298 11.860 60.893 1.00 21.05 N ATOM 2594 CA GLN B 552 8.339 12.355 59.969 1.00 20.87 C ATOM 2595 C GLN B 552 8.916 11.216 59.159 1.00 20.75 C ATOM 2596 O GLN B 552 9.019 11.318 57.950 1.00 20.77 O ATOM 2597 CB GLN B 552 9.489 13.087 60.696 1.00 20.22 C ATOM 2598 CG GLN B 552 9.090 14.488 61.212 1.00 21.01 C ATOM 2599 CD GLN B 552 10.058 15.089 62.220 1.00 21.94 C ATOM 2600 OE1 GLN B 552 10.903 14.402 62.780 1.00 20.83 O ATOM 2601 NE2 GLN B 552 9.939 16.396 62.441 1.00 23.26 N ATOM 0 H GLN B 552 7.492 11.964 61.724 1.00 21.05 H new ATOM 0 HA GLN B 552 7.901 12.994 59.386 1.00 20.87 H new ATOM 0 HB2 GLN B 552 9.787 12.546 61.444 1.00 20.22 H new ATOM 0 HB3 GLN B 552 10.242 13.174 60.091 1.00 20.22 H new ATOM 0 HG2 GLN B 552 9.015 15.090 60.455 1.00 21.01 H new ATOM 0 HG3 GLN B 552 8.211 14.432 61.618 1.00 21.01 H new ATOM 0 HE21 GLN B 552 9.334 16.848 62.030 1.00 23.26 H new ATOM 0 HE22 GLN B 552 10.467 16.788 62.995 1.00 23.26 H new ATOM 2602 N ARG B 553 9.319 10.149 59.848 1.00 19.86 N ATOM 2603 CA ARG B 553 9.810 8.933 59.215 1.00 20.69 C ATOM 2604 C ARG B 553 8.800 8.389 58.173 1.00 18.99 C ATOM 2605 O ARG B 553 9.184 8.076 57.052 1.00 18.61 O ATOM 2606 CB ARG B 553 10.179 7.892 60.287 1.00 20.06 C ATOM 2607 CG ARG B 553 10.388 6.502 59.750 1.00 24.28 C ATOM 2608 CD ARG B 553 11.108 5.591 60.765 1.00 24.58 C ATOM 2609 NE ARG B 553 11.130 4.195 60.304 1.00 30.23 N ATOM 2610 CZ ARG B 553 11.704 3.198 60.971 1.00 31.82 C ATOM 2611 NH1 ARG B 553 12.294 3.443 62.142 1.00 31.29 N ATOM 2612 NH2 ARG B 553 11.665 1.954 60.484 1.00 29.56 N ATOM 0 H ARG B 553 9.314 10.114 60.707 1.00 19.86 H new ATOM 0 HA ARG B 553 10.618 9.140 58.720 1.00 20.69 H new ATOM 0 HB2 ARG B 553 10.989 8.179 60.737 1.00 20.06 H new ATOM 0 HB3 ARG B 553 9.476 7.868 60.955 1.00 20.06 H new ATOM 0 HG2 ARG B 553 9.530 6.113 59.520 1.00 24.28 H new ATOM 0 HG3 ARG B 553 10.908 6.547 58.932 1.00 24.28 H new ATOM 0 HD2 ARG B 553 12.016 5.905 60.898 1.00 24.58 H new ATOM 0 HD3 ARG B 553 10.661 5.644 61.624 1.00 24.58 H new ATOM 0 HE ARG B 553 10.748 4.012 59.556 1.00 30.23 H new ATOM 0 HH11 ARG B 553 12.301 4.242 62.461 1.00 31.29 H new ATOM 0 HH12 ARG B 553 12.667 2.802 62.578 1.00 31.29 H new ATOM 0 HH21 ARG B 553 11.268 1.797 59.738 1.00 29.56 H new ATOM 0 HH22 ARG B 553 12.037 1.311 60.917 1.00 29.56 H new ATOM 2613 N ALA B 554 7.520 8.323 58.529 1.00 17.35 N ATOM 2614 CA ALA B 554 6.469 7.890 57.606 1.00 17.94 C ATOM 2615 C ALA B 554 6.386 8.775 56.374 1.00 17.31 C ATOM 2616 O ALA B 554 6.277 8.294 55.262 1.00 17.76 O ATOM 2617 CB ALA B 554 5.096 7.864 58.315 1.00 18.75 C ATOM 0 H ALA B 554 7.234 8.528 59.314 1.00 17.35 H new ATOM 0 HA ALA B 554 6.703 6.994 57.317 1.00 17.94 H new ATOM 0 HB1 ALA B 554 4.414 7.575 57.689 1.00 18.75 H new ATOM 0 HB2 ALA B 554 5.130 7.247 59.063 1.00 18.75 H new ATOM 0 HB3 ALA B 554 4.882 8.753 58.639 1.00 18.75 H new ATOM 2618 N ARG B 555 6.422 10.080 56.577 1.00 17.52 N ATOM 2619 CA ARG B 555 6.332 11.012 55.466 1.00 17.69 C ATOM 2620 C ARG B 555 7.554 10.985 54.550 1.00 16.54 C ATOM 2621 O ARG B 555 7.428 11.206 53.339 1.00 15.38 O ATOM 2622 CB ARG B 555 6.058 12.433 55.994 1.00 17.18 C ATOM 2623 CG ARG B 555 4.591 12.610 56.409 1.00 19.18 C ATOM 2624 CD ARG B 555 4.361 13.942 57.152 1.00 20.66 C ATOM 2625 NE ARG B 555 4.994 13.951 58.468 1.00 26.92 N ATOM 2626 CZ ARG B 555 5.183 15.051 59.184 1.00 26.91 C ATOM 2627 NH1 ARG B 555 5.755 14.985 60.374 1.00 28.76 N ATOM 2628 NH2 ARG B 555 4.791 16.223 58.704 1.00 28.05 N ATOM 0 H ARG B 555 6.498 10.448 57.350 1.00 17.52 H new ATOM 0 HA ARG B 555 5.588 10.726 54.914 1.00 17.69 H new ATOM 0 HB2 ARG B 555 6.634 12.613 56.754 1.00 17.18 H new ATOM 0 HB3 ARG B 555 6.281 13.082 55.309 1.00 17.18 H new ATOM 0 HG2 ARG B 555 4.026 12.578 55.621 1.00 19.18 H new ATOM 0 HG3 ARG B 555 4.325 11.872 56.979 1.00 19.18 H new ATOM 0 HD2 ARG B 555 4.712 14.673 56.620 1.00 20.66 H new ATOM 0 HD3 ARG B 555 3.408 14.096 57.251 1.00 20.66 H new ATOM 0 HE ARG B 555 5.259 13.202 58.797 1.00 26.92 H new ATOM 0 HH11 ARG B 555 6.007 14.225 60.688 1.00 28.76 H new ATOM 0 HH12 ARG B 555 5.875 15.702 60.834 1.00 28.76 H new ATOM 0 HH21 ARG B 555 4.416 16.268 57.931 1.00 28.05 H new ATOM 0 HH22 ARG B 555 4.912 16.939 59.165 1.00 28.05 H new ATOM 2629 N ILE B 556 8.732 10.769 55.133 1.00 16.58 N ATOM 2630 CA ILE B 556 9.974 10.748 54.352 1.00 16.55 C ATOM 2631 C ILE B 556 10.019 9.515 53.464 1.00 17.40 C ATOM 2632 O ILE B 556 10.435 9.576 52.294 1.00 17.76 O ATOM 2633 CB ILE B 556 11.214 10.840 55.255 1.00 17.46 C ATOM 2634 CG1 ILE B 556 11.333 12.272 55.808 1.00 17.71 C ATOM 2635 CG2 ILE B 556 12.505 10.443 54.457 1.00 17.10 C ATOM 2636 CD1 ILE B 556 12.241 12.376 57.018 1.00 20.02 C ATOM 0 H ILE B 556 8.836 10.633 55.976 1.00 16.58 H new ATOM 0 HA ILE B 556 9.985 11.533 53.782 1.00 16.55 H new ATOM 0 HB ILE B 556 11.120 10.220 55.995 1.00 17.46 H new ATOM 0 HG12 ILE B 556 11.669 12.855 55.109 1.00 17.71 H new ATOM 0 HG13 ILE B 556 10.450 12.594 56.046 1.00 17.71 H new ATOM 0 HG21 ILE B 556 13.278 10.506 55.040 1.00 17.10 H new ATOM 0 HG22 ILE B 556 12.418 9.533 54.133 1.00 17.10 H new ATOM 0 HG23 ILE B 556 12.618 11.044 53.704 1.00 17.10 H new ATOM 0 HD11 ILE B 556 12.275 13.298 57.319 1.00 20.02 H new ATOM 0 HD12 ILE B 556 11.896 11.816 57.731 1.00 20.02 H new ATOM 0 HD13 ILE B 556 13.134 12.081 56.779 1.00 20.02 H new ATOM 2637 N SER B 557 9.604 8.387 54.041 1.00 16.85 N ATOM 2638 CA SER B 557 9.437 7.147 53.304 1.00 17.30 C ATOM 2639 C SER B 557 8.454 7.293 52.153 1.00 16.51 C ATOM 2640 O SER B 557 8.720 6.790 51.051 1.00 15.78 O ATOM 2641 CB ASER B 557 8.936 6.053 54.241 0.65 17.63 C ATOM 2642 CB BSER B 557 8.984 6.036 54.245 0.35 17.21 C ATOM 2643 OG ASER B 557 8.847 4.839 53.537 0.65 19.28 O ATOM 2644 OG BSER B 557 9.911 5.908 55.303 0.35 16.51 O ATOM 0 H SER B 557 9.412 8.325 54.877 1.00 16.85 H new ATOM 0 HA SER B 557 10.303 6.913 52.936 1.00 17.30 H new ATOM 0 HB2ASER B 557 9.539 5.958 54.995 0.65 17.21 H new ATOM 0 HB2BSER B 557 8.103 6.236 54.597 0.35 17.21 H new ATOM 0 HB3ASER B 557 8.068 6.294 54.601 0.65 17.21 H new ATOM 0 HB3BSER B 557 8.913 5.198 53.761 0.35 17.21 H new ATOM 0 HG ASER B 557 8.100 4.790 53.156 0.65 16.51 H new ATOM 0 HG BSER B 557 9.773 6.511 55.871 0.35 16.51 H new ATOM 2645 N LEU B 558 7.323 7.957 52.419 1.00 16.54 N ATOM 2646 CA LEU B 558 6.318 8.203 51.404 1.00 17.99 C ATOM 2647 C LEU B 558 6.863 9.109 50.298 1.00 18.79 C ATOM 2648 O LEU B 558 6.678 8.815 49.108 1.00 17.19 O ATOM 2649 CB LEU B 558 5.027 8.785 52.001 1.00 18.37 C ATOM 2650 CG LEU B 558 3.890 9.105 51.003 1.00 17.87 C ATOM 2651 CD1 LEU B 558 3.405 7.870 50.257 1.00 18.00 C ATOM 2652 CD2 LEU B 558 2.722 9.771 51.738 1.00 18.91 C ATOM 0 H LEU B 558 7.126 8.273 53.194 1.00 16.54 H new ATOM 0 HA LEU B 558 6.093 7.345 51.012 1.00 17.99 H new ATOM 0 HB2 LEU B 558 4.687 8.158 52.658 1.00 18.37 H new ATOM 0 HB3 LEU B 558 5.252 9.600 52.476 1.00 18.37 H new ATOM 0 HG LEU B 558 4.251 9.714 50.340 1.00 17.87 H new ATOM 0 HD11 LEU B 558 2.695 8.119 49.645 1.00 18.00 H new ATOM 0 HD12 LEU B 558 4.141 7.484 49.757 1.00 18.00 H new ATOM 0 HD13 LEU B 558 3.070 7.219 50.893 1.00 18.00 H new ATOM 0 HD21 LEU B 558 2.013 9.969 51.107 1.00 18.91 H new ATOM 0 HD22 LEU B 558 2.387 9.172 52.423 1.00 18.91 H new ATOM 0 HD23 LEU B 558 3.026 10.595 52.150 1.00 18.91 H new ATOM 2653 N ALA B 559 7.523 10.206 50.694 1.00 18.85 N ATOM 2654 CA ALA B 559 8.132 11.130 49.723 1.00 18.46 C ATOM 2655 C ALA B 559 9.159 10.428 48.816 1.00 18.22 C ATOM 2656 O ALA B 559 9.199 10.664 47.611 1.00 16.66 O ATOM 2657 CB ALA B 559 8.762 12.301 50.428 1.00 18.06 C ATOM 0 H ALA B 559 7.629 10.433 51.517 1.00 18.85 H new ATOM 0 HA ALA B 559 7.419 11.454 49.151 1.00 18.46 H new ATOM 0 HB1 ALA B 559 9.158 12.898 49.774 1.00 18.06 H new ATOM 0 HB2 ALA B 559 8.085 12.778 50.933 1.00 18.06 H new ATOM 0 HB3 ALA B 559 9.451 11.983 51.033 1.00 18.06 H new ATOM 2658 N ARG B 560 9.986 9.567 49.398 1.00 17.76 N ATOM 2659 CA ARG B 560 10.866 8.730 48.587 1.00 18.48 C ATOM 2660 C ARG B 560 10.085 7.959 47.509 1.00 18.16 C ATOM 2661 O ARG B 560 10.493 7.946 46.350 1.00 19.57 O ATOM 2662 CB ARG B 560 11.666 7.765 49.464 1.00 17.45 C ATOM 2663 CG ARG B 560 12.712 6.931 48.679 1.00 20.36 C ATOM 2664 CD ARG B 560 13.271 5.783 49.521 1.00 20.79 C ATOM 2665 NE ARG B 560 13.806 6.269 50.790 1.00 20.98 N ATOM 2666 CZ ARG B 560 13.413 5.865 51.995 1.00 21.80 C ATOM 2667 NH1 ARG B 560 13.994 6.370 53.072 1.00 21.46 N ATOM 2668 NH2 ARG B 560 12.470 4.946 52.128 1.00 19.23 N ATOM 0 H ARG B 560 10.054 9.452 50.248 1.00 17.76 H new ATOM 0 HA ARG B 560 11.487 9.321 48.134 1.00 18.48 H new ATOM 0 HB2 ARG B 560 12.120 8.270 50.156 1.00 17.45 H new ATOM 0 HB3 ARG B 560 11.052 7.161 49.911 1.00 17.45 H new ATOM 0 HG2 ARG B 560 12.303 6.573 47.875 1.00 20.36 H new ATOM 0 HG3 ARG B 560 13.439 7.508 48.395 1.00 20.36 H new ATOM 0 HD2 ARG B 560 12.572 5.133 49.690 1.00 20.79 H new ATOM 0 HD3 ARG B 560 13.969 5.326 49.026 1.00 20.79 H new ATOM 0 HE ARG B 560 14.425 6.865 50.755 1.00 20.98 H new ATOM 0 HH11 ARG B 560 14.620 6.954 52.989 1.00 21.46 H new ATOM 0 HH12 ARG B 560 13.746 6.114 53.855 1.00 21.46 H new ATOM 0 HH21 ARG B 560 12.103 4.602 51.430 1.00 19.23 H new ATOM 0 HH22 ARG B 560 12.224 4.693 52.912 1.00 19.23 H new ATOM 2669 N ALA B 561 8.972 7.318 47.881 1.00 18.81 N ATOM 2670 CA ALA B 561 8.208 6.485 46.932 1.00 20.44 C ATOM 2671 C ALA B 561 7.562 7.318 45.821 1.00 20.89 C ATOM 2672 O ALA B 561 7.477 6.887 44.662 1.00 21.16 O ATOM 2673 CB ALA B 561 7.137 5.689 47.646 1.00 20.37 C ATOM 0 H ALA B 561 8.641 7.350 48.674 1.00 18.81 H new ATOM 0 HA ALA B 561 8.846 5.878 46.526 1.00 20.44 H new ATOM 0 HB1 ALA B 561 6.650 5.151 47.002 1.00 20.37 H new ATOM 0 HB2 ALA B 561 7.550 5.109 48.305 1.00 20.37 H new ATOM 0 HB3 ALA B 561 6.524 6.296 48.089 1.00 20.37 H new ATOM 2674 N VAL B 562 7.089 8.488 46.218 1.00 19.65 N ATOM 2675 CA VAL B 562 6.354 9.411 45.372 1.00 21.37 C ATOM 2676 C VAL B 562 7.308 10.206 44.464 1.00 21.50 C ATOM 2677 O VAL B 562 6.967 10.527 43.309 1.00 20.56 O ATOM 2678 CB VAL B 562 5.447 10.313 46.265 1.00 21.10 C ATOM 2679 CG1 VAL B 562 4.981 11.568 45.548 1.00 21.92 C ATOM 2680 CG2 VAL B 562 4.251 9.499 46.774 1.00 21.70 C ATOM 0 H VAL B 562 7.192 8.778 47.021 1.00 19.65 H new ATOM 0 HA VAL B 562 5.773 8.921 44.769 1.00 21.37 H new ATOM 0 HB VAL B 562 5.981 10.612 47.018 1.00 21.10 H new ATOM 0 HG11 VAL B 562 4.423 12.093 46.143 1.00 21.92 H new ATOM 0 HG12 VAL B 562 5.751 12.093 45.281 1.00 21.92 H new ATOM 0 HG13 VAL B 562 4.471 11.321 44.761 1.00 21.92 H new ATOM 0 HG21 VAL B 562 3.689 10.062 47.329 1.00 21.70 H new ATOM 0 HG22 VAL B 562 3.737 9.173 46.019 1.00 21.70 H new ATOM 0 HG23 VAL B 562 4.570 8.747 47.296 1.00 21.70 H new ATOM 2681 N TYR B 563 8.506 10.497 44.973 1.00 21.77 N ATOM 2682 CA TYR B 563 9.523 11.181 44.178 1.00 22.16 C ATOM 2683 C TYR B 563 9.957 10.369 42.953 1.00 22.92 C ATOM 2684 O TYR B 563 10.158 10.931 41.871 1.00 23.40 O ATOM 2685 CB TYR B 563 10.757 11.535 45.011 1.00 22.73 C ATOM 2686 CG TYR B 563 11.826 12.275 44.218 1.00 23.34 C ATOM 2687 CD1 TYR B 563 11.740 13.653 44.025 1.00 24.11 C ATOM 2688 CD2 TYR B 563 12.906 11.590 43.644 1.00 24.35 C ATOM 2689 CE1 TYR B 563 12.708 14.329 43.307 1.00 23.26 C ATOM 2690 CE2 TYR B 563 13.870 12.261 42.918 1.00 24.95 C ATOM 2691 CZ TYR B 563 13.753 13.633 42.758 1.00 23.91 C ATOM 2692 OH TYR B 563 14.687 14.314 42.041 1.00 28.15 O ATOM 0 H TYR B 563 8.748 10.307 45.776 1.00 21.77 H new ATOM 0 HA TYR B 563 9.103 11.999 43.869 1.00 22.16 H new ATOM 0 HB2 TYR B 563 10.485 12.082 45.764 1.00 22.73 H new ATOM 0 HB3 TYR B 563 11.138 10.721 45.375 1.00 22.73 H new ATOM 0 HD1 TYR B 563 11.022 14.123 44.384 1.00 24.11 H new ATOM 0 HD2 TYR B 563 12.974 10.669 43.754 1.00 24.35 H new ATOM 0 HE1 TYR B 563 12.651 15.251 43.197 1.00 23.26 H new ATOM 0 HE2 TYR B 563 14.586 11.800 42.543 1.00 24.95 H new ATOM 0 HH TYR B 563 15.440 13.958 42.151 1.00 28.15 H new ATOM 2693 N LYS B 564 10.114 9.059 43.141 1.00 22.35 N ATOM 2694 CA LYS B 564 10.515 8.133 42.092 1.00 23.03 C ATOM 2695 C LYS B 564 9.557 8.211 40.894 1.00 22.12 C ATOM 2696 O LYS B 564 8.338 8.288 41.061 1.00 21.33 O ATOM 2697 CB LYS B 564 10.586 6.727 42.702 1.00 23.38 C ATOM 2698 CG LYS B 564 11.083 5.599 41.815 1.00 26.27 C ATOM 2699 CD LYS B 564 11.255 4.335 42.662 1.00 26.26 C ATOM 2700 CE LYS B 564 11.297 3.073 41.806 1.00 30.53 C ATOM 2701 NZ LYS B 564 11.821 1.932 42.608 1.00 28.78 N ATOM 0 H LYS B 564 9.986 8.679 43.902 1.00 22.35 H new ATOM 0 HA LYS B 564 11.390 8.368 41.745 1.00 23.03 H new ATOM 0 HB2 LYS B 564 11.160 6.769 43.482 1.00 23.38 H new ATOM 0 HB3 LYS B 564 9.699 6.492 43.015 1.00 23.38 H new ATOM 0 HG2 LYS B 564 10.453 5.437 41.095 1.00 26.27 H new ATOM 0 HG3 LYS B 564 11.927 5.844 41.404 1.00 26.27 H new ATOM 0 HD2 LYS B 564 12.074 4.402 43.178 1.00 26.26 H new ATOM 0 HD3 LYS B 564 10.524 4.270 43.296 1.00 26.26 H new ATOM 0 HE2 LYS B 564 10.408 2.866 41.477 1.00 30.53 H new ATOM 0 HE3 LYS B 564 11.860 3.218 41.030 1.00 30.53 H new ATOM 0 HZ1 LYS B 564 12.591 1.653 42.260 1.00 28.78 H new ATOM 0 HZ2 LYS B 564 11.953 2.195 43.448 1.00 28.78 H new ATOM 0 HZ3 LYS B 564 11.232 1.265 42.596 1.00 28.78 H new ATOM 2702 N ASP B 565 10.117 8.255 39.685 1.00 22.84 N ATOM 2703 CA ASP B 565 9.318 8.208 38.443 1.00 23.34 C ATOM 2704 C ASP B 565 9.001 6.749 38.139 1.00 22.90 C ATOM 2705 O ASP B 565 9.805 6.041 37.548 1.00 23.57 O ATOM 2706 CB ASP B 565 10.096 8.848 37.267 1.00 23.23 C ATOM 2707 CG ASP B 565 9.502 8.526 35.884 1.00 26.07 C ATOM 2708 OD1 ASP B 565 10.298 8.407 34.928 1.00 31.64 O ATOM 2709 OD2 ASP B 565 8.271 8.388 35.724 1.00 28.92 O ATOM 0 H ASP B 565 10.965 8.313 39.555 1.00 22.84 H new ATOM 0 HA ASP B 565 8.497 8.712 38.559 1.00 23.34 H new ATOM 0 HB2 ASP B 565 10.113 9.810 37.387 1.00 23.23 H new ATOM 0 HB3 ASP B 565 11.016 8.542 37.294 1.00 23.23 H new ATOM 2710 N ALA B 566 7.812 6.312 38.519 1.00 23.92 N ATOM 2711 CA ALA B 566 7.424 4.916 38.348 1.00 22.15 C ATOM 2712 C ALA B 566 6.132 4.799 37.557 1.00 22.09 C ATOM 2713 O ALA B 566 5.409 5.781 37.403 1.00 21.61 O ATOM 2714 CB ALA B 566 7.258 4.249 39.704 1.00 21.67 C ATOM 0 H ALA B 566 7.210 6.808 38.880 1.00 23.92 H new ATOM 0 HA ALA B 566 8.128 4.469 37.852 1.00 22.15 H new ATOM 0 HB1 ALA B 566 7.000 3.322 39.580 1.00 21.67 H new ATOM 0 HB2 ALA B 566 8.097 4.288 40.189 1.00 21.67 H new ATOM 0 HB3 ALA B 566 6.571 4.710 40.210 1.00 21.67 H new ATOM 2715 N ASP B 567 5.827 3.579 37.110 1.00 19.51 N ATOM 2716 CA ASP B 567 4.580 3.293 36.407 1.00 20.83 C ATOM 2717 C ASP B 567 3.473 2.790 37.317 1.00 20.45 C ATOM 2718 O ASP B 567 2.296 2.819 36.947 1.00 21.18 O ATOM 2719 CB ASP B 567 4.858 2.243 35.310 1.00 20.92 C ATOM 2720 CG ASP B 567 5.880 2.727 34.323 1.00 21.91 C ATOM 2721 OD1 ASP B 567 5.674 3.849 33.820 1.00 24.96 O ATOM 2722 OD2 ASP B 567 6.899 2.034 34.097 1.00 23.65 O ATOM 0 H ASP B 567 6.339 2.895 37.207 1.00 19.51 H new ATOM 0 HA ASP B 567 4.267 4.129 36.028 1.00 20.83 H new ATOM 0 HB2 ASP B 567 5.168 1.421 35.720 1.00 20.92 H new ATOM 0 HB3 ASP B 567 4.033 2.034 34.845 1.00 20.92 H new ATOM 2723 N LEU B 568 3.854 2.297 38.497 1.00 19.61 N ATOM 2724 CA LEU B 568 2.899 1.758 39.466 1.00 18.90 C ATOM 2725 C LEU B 568 3.457 2.107 40.851 1.00 18.56 C ATOM 2726 O LEU B 568 4.639 1.877 41.132 1.00 18.82 O ATOM 2727 CB LEU B 568 2.724 0.232 39.297 1.00 17.57 C ATOM 2728 CG LEU B 568 1.799 -0.506 40.292 1.00 19.38 C ATOM 2729 CD1 LEU B 568 0.382 0.005 40.228 1.00 11.95 C ATOM 2730 CD2 LEU B 568 1.795 -2.018 40.052 1.00 18.34 C ATOM 0 H LEU B 568 4.673 2.266 38.757 1.00 19.61 H new ATOM 0 HA LEU B 568 2.017 2.140 39.337 1.00 18.90 H new ATOM 0 HB2 LEU B 568 2.388 0.069 38.402 1.00 17.57 H new ATOM 0 HB3 LEU B 568 3.603 -0.176 39.349 1.00 17.57 H new ATOM 0 HG LEU B 568 2.159 -0.327 41.175 1.00 19.38 H new ATOM 0 HD11 LEU B 568 -0.166 -0.480 40.864 1.00 11.95 H new ATOM 0 HD12 LEU B 568 0.369 0.950 40.445 1.00 11.95 H new ATOM 0 HD13 LEU B 568 0.031 -0.126 39.333 1.00 11.95 H new ATOM 0 HD21 LEU B 568 1.206 -2.446 40.693 1.00 18.34 H new ATOM 0 HD22 LEU B 568 1.482 -2.202 39.152 1.00 18.34 H new ATOM 0 HD23 LEU B 568 2.694 -2.365 40.159 1.00 18.34 H new ATOM 2731 N TYR B 569 2.615 2.709 41.673 1.00 17.59 N ATOM 2732 CA TYR B 569 2.996 3.080 43.038 1.00 18.14 C ATOM 2733 C TYR B 569 2.231 2.189 44.003 1.00 17.42 C ATOM 2734 O TYR B 569 0.981 2.109 43.967 1.00 16.75 O ATOM 2735 CB TYR B 569 2.704 4.563 43.318 1.00 17.70 C ATOM 2736 CG TYR B 569 3.550 5.510 42.488 1.00 18.38 C ATOM 2737 CD1 TYR B 569 3.174 5.850 41.187 1.00 19.77 C ATOM 2738 CD2 TYR B 569 4.730 6.043 42.986 1.00 17.47 C ATOM 2739 CE1 TYR B 569 3.963 6.700 40.403 1.00 17.88 C ATOM 2740 CE2 TYR B 569 5.520 6.915 42.211 1.00 18.11 C ATOM 2741 CZ TYR B 569 5.116 7.242 40.925 1.00 18.48 C ATOM 2742 OH TYR B 569 5.906 8.086 40.156 1.00 20.21 O ATOM 0 H TYR B 569 1.807 2.917 41.463 1.00 17.59 H new ATOM 0 HA TYR B 569 3.951 2.954 43.153 1.00 18.14 H new ATOM 0 HB2 TYR B 569 1.766 4.740 43.143 1.00 17.70 H new ATOM 0 HB3 TYR B 569 2.856 4.744 44.259 1.00 17.70 H new ATOM 0 HD1 TYR B 569 2.385 5.506 40.835 1.00 19.77 H new ATOM 0 HD2 TYR B 569 5.004 5.821 43.846 1.00 17.47 H new ATOM 0 HE1 TYR B 569 3.709 6.898 39.531 1.00 17.88 H new ATOM 0 HE2 TYR B 569 6.307 7.269 42.559 1.00 18.11 H new ATOM 0 HH TYR B 569 6.698 8.059 40.434 1.00 20.21 H new ATOM 2743 N LEU B 570 3.005 1.512 44.852 1.00 17.60 N ATOM 2744 CA LEU B 570 2.464 0.632 45.882 1.00 17.06 C ATOM 2745 C LEU B 570 2.717 1.241 47.252 1.00 16.32 C ATOM 2746 O LEU B 570 3.843 1.270 47.747 1.00 16.91 O ATOM 2747 CB LEU B 570 3.072 -0.770 45.769 1.00 16.41 C ATOM 2748 CG LEU B 570 2.954 -1.431 44.384 1.00 14.49 C ATOM 2749 CD1 LEU B 570 3.554 -2.832 44.449 1.00 18.54 C ATOM 2750 CD2 LEU B 570 1.521 -1.547 43.914 1.00 18.26 C ATOM 0 H LEU B 570 3.864 1.552 44.844 1.00 17.60 H new ATOM 0 HA LEU B 570 1.506 0.541 45.758 1.00 17.06 H new ATOM 0 HB2 LEU B 570 4.011 -0.719 46.007 1.00 16.41 H new ATOM 0 HB3 LEU B 570 2.644 -1.345 46.423 1.00 16.41 H new ATOM 0 HG LEU B 570 3.430 -0.867 43.754 1.00 14.49 H new ATOM 0 HD11 LEU B 570 3.483 -3.255 43.579 1.00 18.54 H new ATOM 0 HD12 LEU B 570 4.488 -2.773 44.704 1.00 18.54 H new ATOM 0 HD13 LEU B 570 3.073 -3.360 45.105 1.00 18.54 H new ATOM 0 HD21 LEU B 570 1.500 -1.968 43.040 1.00 18.26 H new ATOM 0 HD22 LEU B 570 1.016 -2.085 44.544 1.00 18.26 H new ATOM 0 HD23 LEU B 570 1.127 -0.663 43.856 1.00 18.26 H new ATOM 2751 N LEU B 571 1.657 1.751 47.851 1.00 15.99 N ATOM 2752 CA LEU B 571 1.773 2.517 49.093 1.00 15.99 C ATOM 2753 C LEU B 571 1.122 1.709 50.210 1.00 17.12 C ATOM 2754 O LEU B 571 -0.115 1.615 50.299 1.00 14.33 O ATOM 2755 CB LEU B 571 1.102 3.881 48.945 1.00 15.98 C ATOM 2756 CG LEU B 571 1.381 4.646 47.641 1.00 17.08 C ATOM 2757 CD1 LEU B 571 0.428 5.862 47.571 1.00 14.45 C ATOM 2758 CD2 LEU B 571 2.833 5.117 47.567 1.00 15.21 C ATOM 0 H LEU B 571 0.853 1.668 47.558 1.00 15.99 H new ATOM 0 HA LEU B 571 2.707 2.675 49.303 1.00 15.99 H new ATOM 0 HB2 LEU B 571 0.143 3.758 49.025 1.00 15.98 H new ATOM 0 HB3 LEU B 571 1.380 4.438 49.689 1.00 15.98 H new ATOM 0 HG LEU B 571 1.229 4.052 46.890 1.00 17.08 H new ATOM 0 HD11 LEU B 571 0.592 6.355 46.752 1.00 14.45 H new ATOM 0 HD12 LEU B 571 -0.492 5.554 47.583 1.00 14.45 H new ATOM 0 HD13 LEU B 571 0.585 6.441 48.334 1.00 14.45 H new ATOM 0 HD21 LEU B 571 2.976 5.595 46.735 1.00 15.21 H new ATOM 0 HD22 LEU B 571 3.021 5.706 48.314 1.00 15.21 H new ATOM 0 HD23 LEU B 571 3.425 4.349 47.605 1.00 15.21 H new ATOM 2759 N ASP B 572 1.958 1.088 51.039 1.00 16.98 N ATOM 2760 CA ASP B 572 1.439 0.135 52.024 1.00 17.60 C ATOM 2761 C ASP B 572 1.243 0.843 53.359 1.00 18.71 C ATOM 2762 O ASP B 572 2.197 1.067 54.111 1.00 18.85 O ATOM 2763 CB ASP B 572 2.386 -1.062 52.143 1.00 17.35 C ATOM 2764 CG ASP B 572 1.756 -2.259 52.826 1.00 18.49 C ATOM 2765 OD1 ASP B 572 0.629 -2.147 53.360 1.00 21.48 O ATOM 2766 OD2 ASP B 572 2.405 -3.333 52.839 1.00 16.37 O ATOM 0 H ASP B 572 2.811 1.199 51.051 1.00 16.98 H new ATOM 0 HA ASP B 572 0.577 -0.205 51.736 1.00 17.60 H new ATOM 0 HB2 ASP B 572 2.682 -1.322 51.256 1.00 17.35 H new ATOM 0 HB3 ASP B 572 3.176 -0.794 52.638 1.00 17.35 H new ATOM 2767 N SER B 573 0.005 1.241 53.620 1.00 20.50 N ATOM 2768 CA SER B 573 -0.386 1.878 54.879 1.00 23.01 C ATOM 2769 C SER B 573 0.583 2.951 55.400 1.00 23.56 C ATOM 2770 O SER B 573 1.085 2.848 56.520 1.00 25.66 O ATOM 2771 CB SER B 573 -0.648 0.825 55.951 1.00 23.45 C ATOM 2772 OG SER B 573 -1.446 1.381 56.998 1.00 29.25 O ATOM 0 H SER B 573 -0.645 1.149 53.064 1.00 20.50 H new ATOM 0 HA SER B 573 -1.203 2.359 54.674 1.00 23.01 H new ATOM 0 HB2 SER B 573 -1.100 0.061 55.561 1.00 23.45 H new ATOM 0 HB3 SER B 573 0.193 0.503 56.311 1.00 23.45 H new ATOM 0 HG SER B 573 -2.193 0.998 57.014 1.00 29.25 H new ATOM 2773 N PRO B 574 0.828 4.001 54.600 1.00 24.77 N ATOM 2774 CA PRO B 574 1.807 5.007 55.022 1.00 26.15 C ATOM 2775 C PRO B 574 1.338 5.985 56.119 1.00 26.84 C ATOM 2776 O PRO B 574 2.151 6.756 56.622 1.00 27.25 O ATOM 2777 CB PRO B 574 2.146 5.740 53.722 1.00 25.30 C ATOM 2778 CG PRO B 574 0.952 5.533 52.849 1.00 26.10 C ATOM 2779 CD PRO B 574 0.212 4.321 53.299 1.00 23.46 C ATOM 0 HA PRO B 574 2.563 4.577 55.451 1.00 26.15 H new ATOM 0 HB2 PRO B 574 2.307 6.683 53.881 1.00 25.30 H new ATOM 0 HB3 PRO B 574 2.948 5.380 53.313 1.00 25.30 H new ATOM 0 HG2 PRO B 574 0.373 6.310 52.887 1.00 26.10 H new ATOM 0 HG3 PRO B 574 1.229 5.430 51.925 1.00 26.10 H new ATOM 0 HD2 PRO B 574 -0.738 4.496 53.387 1.00 23.46 H new ATOM 0 HD3 PRO B 574 0.309 3.590 52.669 1.00 23.46 H new ATOM 2780 N PHE B 575 0.062 5.937 56.514 1.00 28.09 N ATOM 2781 CA PHE B 575 -0.487 6.961 57.417 1.00 27.68 C ATOM 2782 C PHE B 575 -0.700 6.515 58.875 1.00 28.73 C ATOM 2783 O PHE B 575 -1.307 7.257 59.670 1.00 28.48 O ATOM 2784 CB PHE B 575 -1.829 7.502 56.885 1.00 27.68 C ATOM 2785 CG PHE B 575 -1.817 7.896 55.431 1.00 25.70 C ATOM 2786 CD1 PHE B 575 -0.832 8.731 54.913 1.00 27.75 C ATOM 2787 CD2 PHE B 575 -2.822 7.434 54.575 1.00 26.46 C ATOM 2788 CE1 PHE B 575 -0.828 9.083 53.549 1.00 24.58 C ATOM 2789 CE2 PHE B 575 -2.835 7.801 53.221 1.00 23.49 C ATOM 2790 CZ PHE B 575 -1.826 8.628 52.711 1.00 27.16 C ATOM 0 H PHE B 575 -0.498 5.329 56.275 1.00 28.09 H new ATOM 0 HA PHE B 575 0.199 7.646 57.430 1.00 27.68 H new ATOM 0 HB2 PHE B 575 -2.512 6.826 57.019 1.00 27.68 H new ATOM 0 HB3 PHE B 575 -2.086 8.273 57.414 1.00 27.68 H new ATOM 0 HD1 PHE B 575 -0.168 9.061 55.474 1.00 27.75 H new ATOM 0 HD2 PHE B 575 -3.489 6.877 54.907 1.00 26.46 H new ATOM 0 HE1 PHE B 575 -0.151 9.624 53.212 1.00 24.58 H new ATOM 0 HE2 PHE B 575 -3.513 7.495 52.662 1.00 23.49 H new ATOM 0 HZ PHE B 575 -1.828 8.869 51.813 1.00 27.16 H new ATOM 2791 N GLY B 576 -0.241 5.306 59.211 1.00 28.80 N ATOM 2792 CA GLY B 576 -0.469 4.697 60.534 1.00 28.62 C ATOM 2793 C GLY B 576 -0.077 5.530 61.748 1.00 28.41 C ATOM 2794 O GLY B 576 -0.782 5.523 62.770 1.00 29.33 O ATOM 0 H GLY B 576 0.215 4.810 58.676 1.00 28.80 H new ATOM 0 HA2 GLY B 576 -1.411 4.478 60.608 1.00 28.62 H new ATOM 0 HA3 GLY B 576 0.020 3.860 60.570 1.00 28.62 H new ATOM 2795 N TYR B 577 1.050 6.230 61.659 1.00 26.33 N ATOM 2796 CA TYR B 577 1.477 7.084 62.767 1.00 25.75 C ATOM 2797 C TYR B 577 1.194 8.576 62.566 1.00 25.18 C ATOM 2798 O TYR B 577 1.776 9.411 63.280 1.00 25.58 O ATOM 2799 CB TYR B 577 2.964 6.910 63.079 1.00 25.94 C ATOM 2800 CG TYR B 577 3.400 5.574 63.669 1.00 27.42 C ATOM 2801 CD1 TYR B 577 4.568 4.977 63.214 1.00 27.91 C ATOM 2802 CD2 TYR B 577 2.678 4.931 64.698 1.00 26.97 C ATOM 2803 CE1 TYR B 577 5.022 3.774 63.728 1.00 28.83 C ATOM 2804 CE2 TYR B 577 3.129 3.689 65.226 1.00 28.14 C ATOM 2805 CZ TYR B 577 4.311 3.128 64.721 1.00 28.34 C ATOM 2806 OH TYR B 577 4.836 1.937 65.191 1.00 28.93 O ATOM 0 H TYR B 577 1.575 6.227 60.978 1.00 26.33 H new ATOM 0 HA TYR B 577 0.936 6.783 63.514 1.00 25.75 H new ATOM 0 HB2 TYR B 577 3.462 7.053 62.259 1.00 25.94 H new ATOM 0 HB3 TYR B 577 3.226 7.611 63.696 1.00 25.94 H new ATOM 0 HD1 TYR B 577 5.059 5.397 62.545 1.00 27.91 H new ATOM 0 HD2 TYR B 577 1.903 5.322 65.033 1.00 26.97 H new ATOM 0 HE1 TYR B 577 5.809 3.399 63.403 1.00 28.83 H new ATOM 0 HE2 TYR B 577 2.648 3.257 65.894 1.00 28.14 H new ATOM 0 HH TYR B 577 4.334 1.626 65.789 1.00 28.93 H new ATOM 2807 N LEU B 578 0.321 8.922 61.615 1.00 22.95 N ATOM 2808 CA LEU B 578 -0.083 10.323 61.441 1.00 23.19 C ATOM 2809 C LEU B 578 -1.429 10.581 62.095 1.00 24.36 C ATOM 2810 O LEU B 578 -2.288 9.701 62.126 1.00 23.91 O ATOM 2811 CB LEU B 578 -0.164 10.706 59.957 1.00 22.37 C ATOM 2812 CG LEU B 578 1.105 10.615 59.098 1.00 24.15 C ATOM 2813 CD1 LEU B 578 0.802 10.893 57.607 1.00 25.55 C ATOM 2814 CD2 LEU B 578 2.230 11.514 59.614 1.00 24.02 C ATOM 0 H LEU B 578 -0.045 8.370 61.067 1.00 22.95 H new ATOM 0 HA LEU B 578 0.595 10.869 61.868 1.00 23.19 H new ATOM 0 HB2 LEU B 578 -0.838 10.143 59.545 1.00 22.37 H new ATOM 0 HB3 LEU B 578 -0.487 11.619 59.907 1.00 22.37 H new ATOM 0 HG LEU B 578 1.422 9.701 59.172 1.00 24.15 H new ATOM 0 HD11 LEU B 578 1.622 10.828 57.092 1.00 25.55 H new ATOM 0 HD12 LEU B 578 0.163 10.241 57.279 1.00 25.55 H new ATOM 0 HD13 LEU B 578 0.431 11.784 57.513 1.00 25.55 H new ATOM 0 HD21 LEU B 578 3.007 11.422 59.041 1.00 24.02 H new ATOM 0 HD22 LEU B 578 1.934 12.438 59.610 1.00 24.02 H new ATOM 0 HD23 LEU B 578 2.464 11.253 60.519 1.00 24.02 H new ATOM 2815 N ASP B 579 -1.606 11.799 62.603 1.00 23.66 N ATOM 2816 CA ASP B 579 -2.877 12.244 63.144 1.00 24.44 C ATOM 2817 C ASP B 579 -3.902 12.402 62.001 1.00 24.17 C ATOM 2818 O ASP B 579 -3.521 12.487 60.835 1.00 23.05 O ATOM 2819 CB ASP B 579 -2.676 13.560 63.890 1.00 23.76 C ATOM 2820 CG ASP B 579 -2.121 14.665 62.988 1.00 25.75 C ATOM 2821 OD1 ASP B 579 -2.941 15.457 62.472 1.00 28.59 O ATOM 2822 OD2 ASP B 579 -0.880 14.738 62.790 1.00 25.96 O ATOM 0 H ASP B 579 -0.984 12.391 62.641 1.00 23.66 H new ATOM 0 HA ASP B 579 -3.220 11.586 63.768 1.00 24.44 H new ATOM 0 HB2 ASP B 579 -3.523 13.848 64.266 1.00 23.76 H new ATOM 0 HB3 ASP B 579 -2.069 13.418 64.633 1.00 23.76 H new ATOM 2823 N VAL B 580 -5.191 12.425 62.322 1.00 25.05 N ATOM 2824 CA VAL B 580 -6.226 12.485 61.270 1.00 26.60 C ATOM 2825 C VAL B 580 -6.034 13.672 60.330 1.00 26.79 C ATOM 2826 O VAL B 580 -6.224 13.538 59.122 1.00 26.75 O ATOM 2827 CB VAL B 580 -7.694 12.476 61.824 1.00 27.87 C ATOM 2828 CG1 VAL B 580 -8.011 11.166 62.502 1.00 30.96 C ATOM 2829 CG2 VAL B 580 -7.939 13.641 62.773 1.00 29.62 C ATOM 0 H VAL B 580 -5.493 12.407 63.127 1.00 25.05 H new ATOM 0 HA VAL B 580 -6.104 11.665 60.766 1.00 26.60 H new ATOM 0 HB VAL B 580 -8.289 12.579 61.065 1.00 27.87 H new ATOM 0 HG11 VAL B 580 -8.922 11.186 62.835 1.00 30.96 H new ATOM 0 HG12 VAL B 580 -7.916 10.440 61.865 1.00 30.96 H new ATOM 0 HG13 VAL B 580 -7.400 11.028 63.242 1.00 30.96 H new ATOM 0 HG21 VAL B 580 -8.853 13.608 63.097 1.00 29.62 H new ATOM 0 HG22 VAL B 580 -7.327 13.581 63.524 1.00 29.62 H new ATOM 0 HG23 VAL B 580 -7.793 14.477 62.303 1.00 29.62 H new ATOM 2830 N LEU B 581 -5.625 14.819 60.874 1.00 26.80 N ATOM 2831 CA LEU B 581 -5.529 16.053 60.086 1.00 27.74 C ATOM 2832 C LEU B 581 -4.411 15.992 59.035 1.00 25.93 C ATOM 2833 O LEU B 581 -4.639 16.264 57.863 1.00 23.86 O ATOM 2834 CB LEU B 581 -5.349 17.267 61.004 1.00 28.50 C ATOM 2835 CG LEU B 581 -6.540 18.071 61.562 1.00 34.19 C ATOM 2836 CD1 LEU B 581 -7.876 17.321 61.617 1.00 35.31 C ATOM 2837 CD2 LEU B 581 -6.189 18.661 62.942 1.00 30.66 C ATOM 0 H LEU B 581 -5.398 14.905 61.699 1.00 26.80 H new ATOM 0 HA LEU B 581 -6.364 16.148 59.602 1.00 27.74 H new ATOM 0 HB2 LEU B 581 -4.838 16.962 61.770 1.00 28.50 H new ATOM 0 HB3 LEU B 581 -4.790 17.897 60.523 1.00 28.50 H new ATOM 0 HG LEU B 581 -6.686 18.782 60.918 1.00 34.19 H new ATOM 0 HD11 LEU B 581 -8.560 17.905 61.980 1.00 35.31 H new ATOM 0 HD12 LEU B 581 -8.129 17.044 60.722 1.00 35.31 H new ATOM 0 HD13 LEU B 581 -7.785 16.539 62.184 1.00 35.31 H new ATOM 0 HD21 LEU B 581 -6.946 19.164 63.281 1.00 30.66 H new ATOM 0 HD22 LEU B 581 -5.977 17.942 63.557 1.00 30.66 H new ATOM 0 HD23 LEU B 581 -5.423 19.249 62.857 1.00 30.66 H new ATOM 2838 N THR B 582 -3.207 15.629 59.468 1.00 24.69 N ATOM 2839 CA THR B 582 -2.065 15.443 58.574 1.00 23.03 C ATOM 2840 C THR B 582 -2.346 14.346 57.535 1.00 23.44 C ATOM 2841 O THR B 582 -1.919 14.463 56.380 1.00 23.43 O ATOM 2842 CB THR B 582 -0.798 15.067 59.375 1.00 23.52 C ATOM 2843 OG1 THR B 582 -0.638 15.993 60.449 1.00 24.43 O ATOM 2844 CG2 THR B 582 0.455 15.089 58.495 1.00 22.75 C ATOM 0 H THR B 582 -3.027 15.482 60.296 1.00 24.69 H new ATOM 0 HA THR B 582 -1.919 16.284 58.114 1.00 23.03 H new ATOM 0 HB THR B 582 -0.908 14.165 59.714 1.00 23.52 H new ATOM 0 HG1 THR B 582 -0.567 15.573 61.173 1.00 24.43 H new ATOM 0 HG21 THR B 582 1.229 14.849 59.028 1.00 22.75 H new ATOM 0 HG22 THR B 582 0.353 14.453 57.770 1.00 22.75 H new ATOM 0 HG23 THR B 582 0.578 15.979 58.129 1.00 22.75 H new ATOM 2845 N GLU B 583 -3.043 13.288 57.953 1.00 22.71 N ATOM 2846 CA GLU B 583 -3.341 12.146 57.075 1.00 24.21 C ATOM 2847 C GLU B 583 -4.229 12.633 55.944 1.00 24.65 C ATOM 2848 O GLU B 583 -3.958 12.353 54.784 1.00 22.27 O ATOM 2849 CB GLU B 583 -4.049 11.020 57.841 1.00 23.28 C ATOM 2850 CG GLU B 583 -4.541 9.882 56.945 1.00 26.13 C ATOM 2851 CD GLU B 583 -5.330 8.813 57.705 1.00 29.43 C ATOM 2852 OE1 GLU B 583 -5.102 7.612 57.429 1.00 35.20 O ATOM 2853 OE2 GLU B 583 -6.173 9.165 58.578 1.00 34.34 O ATOM 0 H GLU B 583 -3.357 13.209 58.750 1.00 22.71 H new ATOM 0 HA GLU B 583 -2.509 11.787 56.729 1.00 24.21 H new ATOM 0 HB2 GLU B 583 -3.441 10.659 58.504 1.00 23.28 H new ATOM 0 HB3 GLU B 583 -4.805 11.392 58.322 1.00 23.28 H new ATOM 0 HG2 GLU B 583 -5.100 10.250 56.243 1.00 26.13 H new ATOM 0 HG3 GLU B 583 -3.779 9.466 56.512 1.00 26.13 H new ATOM 2854 N LYS B 584 -5.284 13.373 56.313 1.00 23.55 N ATOM 2855 CA LYS B 584 -6.174 14.013 55.362 1.00 25.03 C ATOM 2856 C LYS B 584 -5.446 14.911 54.367 1.00 23.72 C ATOM 2857 O LYS B 584 -5.657 14.790 53.161 1.00 23.33 O ATOM 2858 CB LYS B 584 -7.269 14.777 56.108 1.00 25.85 C ATOM 2859 CG LYS B 584 -8.377 15.340 55.209 1.00 30.96 C ATOM 2860 CD LYS B 584 -9.257 16.289 56.020 1.00 36.82 C ATOM 2861 CE LYS B 584 -10.032 17.258 55.137 1.00 42.06 C ATOM 2862 NZ LYS B 584 -10.450 18.463 55.942 1.00 44.32 N ATOM 0 H LYS B 584 -5.497 13.513 57.134 1.00 23.55 H new ATOM 0 HA LYS B 584 -6.580 13.311 54.830 1.00 25.03 H new ATOM 0 HB2 LYS B 584 -7.670 14.186 56.765 1.00 25.85 H new ATOM 0 HB3 LYS B 584 -6.861 15.509 56.597 1.00 25.85 H new ATOM 0 HG2 LYS B 584 -7.988 15.809 54.455 1.00 30.96 H new ATOM 0 HG3 LYS B 584 -8.912 14.617 54.847 1.00 30.96 H new ATOM 0 HD2 LYS B 584 -9.881 15.772 56.553 1.00 36.82 H new ATOM 0 HD3 LYS B 584 -8.703 16.791 56.638 1.00 36.82 H new ATOM 0 HE2 LYS B 584 -9.483 17.535 54.387 1.00 42.06 H new ATOM 0 HE3 LYS B 584 -10.814 16.818 54.769 1.00 42.06 H new ATOM 0 HZ1 LYS B 584 -10.902 19.026 55.421 1.00 44.32 H new ATOM 0 HZ2 LYS B 584 -10.968 18.204 56.618 1.00 44.32 H new ATOM 0 HZ3 LYS B 584 -9.727 18.872 56.262 1.00 44.32 H new ATOM 2863 N GLU B 585 -4.577 15.792 54.866 1.00 23.49 N ATOM 2864 CA GLU B 585 -3.803 16.696 54.008 1.00 24.09 C ATOM 2865 C GLU B 585 -2.938 15.967 52.982 1.00 23.07 C ATOM 2866 O GLU B 585 -2.878 16.364 51.812 1.00 20.66 O ATOM 2867 CB GLU B 585 -2.907 17.617 54.854 1.00 25.10 C ATOM 2868 CG GLU B 585 -3.672 18.560 55.769 1.00 30.11 C ATOM 2869 CD GLU B 585 -4.777 19.291 55.041 1.00 39.00 C ATOM 2870 OE1 GLU B 585 -4.519 19.792 53.922 1.00 43.18 O ATOM 2871 OE2 GLU B 585 -5.907 19.358 55.581 1.00 42.33 O ATOM 0 H GLU B 585 -4.419 15.883 55.707 1.00 23.49 H new ATOM 0 HA GLU B 585 -4.459 17.218 53.520 1.00 24.09 H new ATOM 0 HB2 GLU B 585 -2.314 17.070 55.393 1.00 25.10 H new ATOM 0 HB3 GLU B 585 -2.347 18.142 54.260 1.00 25.10 H new ATOM 0 HG2 GLU B 585 -4.051 18.056 56.506 1.00 30.11 H new ATOM 0 HG3 GLU B 585 -3.058 19.205 56.152 1.00 30.11 H new ATOM 2872 N ILE B 586 -2.260 14.910 53.426 1.00 21.88 N ATOM 2873 CA ILE B 586 -1.357 14.183 52.537 1.00 22.47 C ATOM 2874 C ILE B 586 -2.138 13.292 51.578 1.00 21.34 C ATOM 2875 O ILE B 586 -1.784 13.193 50.412 1.00 20.72 O ATOM 2876 CB ILE B 586 -0.344 13.307 53.273 1.00 23.36 C ATOM 2877 CG1 ILE B 586 0.472 14.122 54.256 1.00 26.12 C ATOM 2878 CG2 ILE B 586 0.589 12.647 52.248 1.00 24.16 C ATOM 2879 CD1 ILE B 586 1.649 13.363 54.810 1.00 31.00 C ATOM 0 H ILE B 586 -2.307 14.601 54.227 1.00 21.88 H new ATOM 0 HA ILE B 586 -0.870 14.871 52.057 1.00 22.47 H new ATOM 0 HB ILE B 586 -0.825 12.628 53.772 1.00 23.36 H new ATOM 0 HG12 ILE B 586 0.789 14.927 53.817 1.00 26.12 H new ATOM 0 HG13 ILE B 586 -0.099 14.404 54.988 1.00 26.12 H new ATOM 0 HG21 ILE B 586 1.235 12.089 52.710 1.00 24.16 H new ATOM 0 HG22 ILE B 586 0.067 12.101 51.640 1.00 24.16 H new ATOM 0 HG23 ILE B 586 1.056 13.333 51.746 1.00 24.16 H new ATOM 0 HD11 ILE B 586 2.135 13.928 55.431 1.00 31.00 H new ATOM 0 HD12 ILE B 586 1.335 12.570 55.272 1.00 31.00 H new ATOM 0 HD13 ILE B 586 2.236 13.101 54.084 1.00 31.00 H new ATOM 2880 N PHE B 587 -3.180 12.633 52.067 1.00 21.49 N ATOM 2881 CA PHE B 587 -4.023 11.864 51.169 1.00 22.07 C ATOM 2882 C PHE B 587 -4.553 12.772 50.037 1.00 23.81 C ATOM 2883 O PHE B 587 -4.497 12.411 48.863 1.00 22.36 O ATOM 2884 CB PHE B 587 -5.175 11.190 51.917 1.00 22.34 C ATOM 2885 CG PHE B 587 -6.086 10.426 51.022 1.00 23.88 C ATOM 2886 CD1 PHE B 587 -7.377 10.878 50.780 1.00 23.75 C ATOM 2887 CD2 PHE B 587 -5.642 9.259 50.390 1.00 24.30 C ATOM 2888 CE1 PHE B 587 -8.217 10.190 49.921 1.00 25.71 C ATOM 2889 CE2 PHE B 587 -6.485 8.557 49.533 1.00 26.08 C ATOM 2890 CZ PHE B 587 -7.772 9.028 49.297 1.00 25.27 C ATOM 0 H PHE B 587 -3.411 12.618 52.895 1.00 21.49 H new ATOM 0 HA PHE B 587 -3.485 11.158 50.778 1.00 22.07 H new ATOM 0 HB2 PHE B 587 -4.811 10.590 52.587 1.00 22.34 H new ATOM 0 HB3 PHE B 587 -5.686 11.866 52.389 1.00 22.34 H new ATOM 0 HD1 PHE B 587 -7.680 11.651 51.199 1.00 23.75 H new ATOM 0 HD2 PHE B 587 -4.778 8.950 50.544 1.00 24.30 H new ATOM 0 HE1 PHE B 587 -9.078 10.504 49.761 1.00 25.71 H new ATOM 0 HE2 PHE B 587 -6.189 7.778 49.121 1.00 26.08 H new ATOM 0 HZ PHE B 587 -8.337 8.565 48.721 1.00 25.27 H new ATOM 2891 N GLU B 588 -5.043 13.957 50.402 1.00 23.85 N ATOM 2892 CA GLU B 588 -5.594 14.878 49.421 1.00 26.20 C ATOM 2893 C GLU B 588 -4.525 15.488 48.521 1.00 25.58 C ATOM 2894 O GLU B 588 -4.638 15.426 47.306 1.00 26.28 O ATOM 2895 CB GLU B 588 -6.452 15.939 50.114 1.00 26.38 C ATOM 2896 CG GLU B 588 -7.739 15.355 50.689 1.00 28.74 C ATOM 2897 CD GLU B 588 -8.663 16.388 51.326 1.00 31.23 C ATOM 2898 OE1 GLU B 588 -8.171 17.430 51.830 1.00 35.20 O ATOM 2899 OE2 GLU B 588 -9.895 16.146 51.300 1.00 38.65 O ATOM 0 H GLU B 588 -5.064 14.242 51.213 1.00 23.85 H new ATOM 0 HA GLU B 588 -6.168 14.370 48.827 1.00 26.20 H new ATOM 0 HB2 GLU B 588 -5.940 16.352 50.827 1.00 26.38 H new ATOM 0 HB3 GLU B 588 -6.672 16.639 49.480 1.00 26.38 H new ATOM 0 HG2 GLU B 588 -8.220 14.898 49.981 1.00 28.74 H new ATOM 0 HG3 GLU B 588 -7.510 14.686 51.354 1.00 28.74 H new ATOM 2900 N SER B 589 -3.471 16.053 49.097 1.00 26.27 N ATOM 2901 CA SER B 589 -2.497 16.774 48.284 1.00 26.88 C ATOM 2902 C SER B 589 -1.533 15.855 47.538 1.00 26.55 C ATOM 2903 O SER B 589 -1.133 16.148 46.403 1.00 26.29 O ATOM 2904 CB SER B 589 -1.750 17.805 49.134 1.00 26.79 C ATOM 2905 OG SER B 589 -2.675 18.793 49.563 1.00 29.94 O ATOM 0 H SER B 589 -3.302 16.033 49.940 1.00 26.27 H new ATOM 0 HA SER B 589 -2.996 17.241 47.595 1.00 26.88 H new ATOM 0 HB2 SER B 589 -1.337 17.375 49.899 1.00 26.79 H new ATOM 0 HB3 SER B 589 -1.036 18.213 48.619 1.00 26.79 H new ATOM 0 HG SER B 589 -2.277 19.365 50.032 1.00 29.94 H new ATOM 2906 N CYS B 590 -1.164 14.740 48.164 1.00 26.59 N ATOM 2907 CA CYS B 590 -0.239 13.804 47.536 1.00 25.12 C ATOM 2908 C CYS B 590 -0.962 12.750 46.710 1.00 24.86 C ATOM 2909 O CYS B 590 -0.862 12.738 45.486 1.00 24.25 O ATOM 2910 CB CYS B 590 0.655 13.134 48.580 1.00 25.83 C ATOM 2911 SG CYS B 590 2.102 12.332 47.867 1.00 28.31 S ATOM 0 H CYS B 590 -1.436 14.509 48.947 1.00 26.59 H new ATOM 0 HA CYS B 590 0.316 14.321 46.932 1.00 25.12 H new ATOM 0 HB2 CYS B 590 0.946 13.799 49.223 1.00 25.83 H new ATOM 0 HB3 CYS B 590 0.135 12.476 49.068 1.00 25.83 H new ATOM 0 HG CYS B 590 3.053 12.520 48.574 1.00 28.31 H new ATOM 2912 N VAL B 591 -1.684 11.856 47.379 1.00 24.14 N ATOM 2913 CA VAL B 591 -2.287 10.704 46.706 1.00 24.97 C ATOM 2914 C VAL B 591 -3.349 11.113 45.678 1.00 25.74 C ATOM 2915 O VAL B 591 -3.372 10.601 44.547 1.00 23.49 O ATOM 2916 CB VAL B 591 -2.869 9.656 47.724 1.00 24.00 C ATOM 2917 CG1 VAL B 591 -3.425 8.452 47.003 1.00 23.56 C ATOM 2918 CG2 VAL B 591 -1.803 9.215 48.699 1.00 23.82 C ATOM 0 H VAL B 591 -1.838 11.896 48.224 1.00 24.14 H new ATOM 0 HA VAL B 591 -1.565 10.274 46.221 1.00 24.97 H new ATOM 0 HB VAL B 591 -3.589 10.086 48.212 1.00 24.00 H new ATOM 0 HG11 VAL B 591 -3.777 7.821 47.650 1.00 23.56 H new ATOM 0 HG12 VAL B 591 -4.136 8.732 46.405 1.00 23.56 H new ATOM 0 HG13 VAL B 591 -2.720 8.028 46.490 1.00 23.56 H new ATOM 0 HG21 VAL B 591 -2.178 8.570 49.319 1.00 23.82 H new ATOM 0 HG22 VAL B 591 -1.069 8.807 48.214 1.00 23.82 H new ATOM 0 HG23 VAL B 591 -1.477 9.984 49.192 1.00 23.82 H new ATOM 2919 N CYS B 592 -4.215 12.042 46.069 1.00 26.54 N ATOM 2920 CA CYS B 592 -5.297 12.464 45.180 1.00 28.66 C ATOM 2921 C CYS B 592 -4.906 13.490 44.110 1.00 28.64 C ATOM 2922 O CYS B 592 -5.392 13.409 42.987 1.00 30.73 O ATOM 2923 CB CYS B 592 -6.519 12.902 45.980 1.00 28.05 C ATOM 2924 SG CYS B 592 -7.295 11.494 46.822 1.00 29.66 S ATOM 0 H CYS B 592 -4.197 12.437 46.833 1.00 26.54 H new ATOM 0 HA CYS B 592 -5.526 11.674 44.666 1.00 28.66 H new ATOM 0 HB2 CYS B 592 -6.258 13.569 46.634 1.00 28.05 H new ATOM 0 HB3 CYS B 592 -7.162 13.322 45.388 1.00 28.05 H new ATOM 0 HG CYS B 592 -7.317 11.697 48.004 1.00 29.66 H new ATOM 2925 N LYS B 593 -4.011 14.419 44.444 1.00 28.70 N ATOM 2926 CA LYS B 593 -3.700 15.576 43.582 1.00 27.75 C ATOM 2927 C LYS B 593 -2.372 15.443 42.839 1.00 27.35 C ATOM 2928 O LYS B 593 -2.346 15.390 41.612 1.00 26.93 O ATOM 2929 CB LYS B 593 -3.686 16.877 44.405 1.00 28.02 C ATOM 2930 CG LYS B 593 -5.044 17.500 44.628 1.00 30.72 C ATOM 0 H LYS B 593 -3.563 14.401 45.178 1.00 28.70 H new ATOM 0 HA LYS B 593 -4.404 15.603 42.915 1.00 27.75 H new ATOM 0 HB2 LYS B 593 -3.282 16.695 45.268 1.00 28.02 H new ATOM 0 HB3 LYS B 593 -3.118 17.523 43.956 1.00 28.02 H new ATOM 2931 N LEU B 594 -1.273 15.386 43.584 1.00 25.30 N ATOM 2932 CA LEU B 594 0.042 15.259 42.978 1.00 26.58 C ATOM 2933 C LEU B 594 0.116 14.004 42.095 1.00 27.68 C ATOM 2934 O LEU B 594 0.637 14.061 40.979 1.00 27.38 O ATOM 2935 CB LEU B 594 1.158 15.244 44.040 1.00 24.80 C ATOM 2936 CG LEU B 594 2.577 15.267 43.485 1.00 26.79 C ATOM 2937 CD1 LEU B 594 2.834 16.587 42.744 1.00 27.79 C ATOM 2938 CD2 LEU B 594 3.616 15.051 44.580 1.00 26.97 C ATOM 0 H LEU B 594 -1.270 15.419 44.443 1.00 25.30 H new ATOM 0 HA LEU B 594 0.181 16.038 42.418 1.00 26.58 H new ATOM 0 HB2 LEU B 594 1.041 16.010 44.623 1.00 24.80 H new ATOM 0 HB3 LEU B 594 1.053 14.451 44.589 1.00 24.80 H new ATOM 0 HG LEU B 594 2.663 14.532 42.858 1.00 26.79 H new ATOM 0 HD11 LEU B 594 3.739 16.592 42.395 1.00 27.79 H new ATOM 0 HD12 LEU B 594 2.205 16.675 42.011 1.00 27.79 H new ATOM 0 HD13 LEU B 594 2.721 17.330 43.357 1.00 27.79 H new ATOM 0 HD21 LEU B 594 4.505 15.072 44.192 1.00 26.97 H new ATOM 0 HD22 LEU B 594 3.537 15.754 45.244 1.00 26.97 H new ATOM 0 HD23 LEU B 594 3.468 14.190 45.002 1.00 26.97 H new ATOM 2939 N MET B 595 -0.427 12.892 42.595 1.00 26.80 N ATOM 2940 CA MET B 595 -0.385 11.610 41.880 1.00 28.03 C ATOM 2941 C MET B 595 -1.665 11.295 41.106 1.00 27.49 C ATOM 2942 O MET B 595 -1.930 10.130 40.785 1.00 26.48 O ATOM 2943 CB MET B 595 -0.112 10.465 42.877 1.00 27.14 C ATOM 2944 CG MET B 595 1.026 10.747 43.845 1.00 28.30 C ATOM 2945 SD MET B 595 1.149 9.440 45.069 1.00 28.38 S ATOM 2946 CE MET B 595 1.744 8.080 44.058 1.00 25.91 C ATOM 0 H MET B 595 -0.829 12.858 43.355 1.00 26.80 H new ATOM 0 HA MET B 595 0.330 11.688 41.229 1.00 28.03 H new ATOM 0 HB2 MET B 595 -0.920 10.290 43.384 1.00 27.14 H new ATOM 0 HB3 MET B 595 0.091 9.657 42.380 1.00 27.14 H new ATOM 0 HG2 MET B 595 1.861 10.821 43.358 1.00 28.30 H new ATOM 0 HG3 MET B 595 0.879 11.598 44.286 1.00 28.30 H new ATOM 0 HE1 MET B 595 1.706 7.256 44.569 1.00 25.91 H new ATOM 0 HE2 MET B 595 1.187 7.996 43.268 1.00 25.91 H new ATOM 0 HE3 MET B 595 2.660 8.252 43.790 1.00 25.91 H new ATOM 2947 N ALA B 596 -2.445 12.325 40.782 1.00 27.66 N ATOM 2948 CA ALA B 596 -3.741 12.135 40.120 1.00 28.59 C ATOM 2949 C ALA B 596 -3.685 11.269 38.853 1.00 28.86 C ATOM 2950 O ALA B 596 -4.651 10.571 38.547 1.00 29.03 O ATOM 2951 CB ALA B 596 -4.406 13.494 39.791 1.00 28.62 C ATOM 0 H ALA B 596 -2.243 13.147 40.937 1.00 27.66 H new ATOM 0 HA ALA B 596 -4.279 11.648 40.764 1.00 28.59 H new ATOM 0 HB1 ALA B 596 -5.259 13.340 39.355 1.00 28.62 H new ATOM 0 HB2 ALA B 596 -4.548 13.992 40.611 1.00 28.62 H new ATOM 0 HB3 ALA B 596 -3.829 14.002 39.200 1.00 28.62 H new ATOM 2952 N ASN B 597 -2.585 11.343 38.108 1.00 28.20 N ATOM 2953 CA ASN B 597 -2.480 10.612 36.832 1.00 29.28 C ATOM 2954 C ASN B 597 -1.664 9.329 36.902 1.00 28.20 C ATOM 2955 O ASN B 597 -1.425 8.689 35.875 1.00 28.41 O ATOM 2956 CB ASN B 597 -1.893 11.528 35.736 1.00 30.66 C ATOM 2957 CG ASN B 597 -2.713 12.785 35.522 1.00 32.79 C ATOM 2958 OD1 ASN B 597 -2.184 13.899 35.596 1.00 41.04 O ATOM 2959 ND2 ASN B 597 -4.018 12.620 35.298 1.00 35.81 N ATOM 0 H ASN B 597 -1.890 11.805 38.315 1.00 28.20 H new ATOM 0 HA ASN B 597 -3.388 10.348 36.615 1.00 29.28 H new ATOM 0 HB2 ASN B 597 -0.987 11.775 35.978 1.00 30.66 H new ATOM 0 HB3 ASN B 597 -1.840 11.035 34.902 1.00 30.66 H new ATOM 0 HD21 ASN B 597 -4.527 13.306 35.199 1.00 35.81 H new ATOM 0 HD22 ASN B 597 -4.350 11.828 35.253 1.00 35.81 H new ATOM 2960 N LYS B 598 -1.237 8.951 38.107 1.00 26.38 N ATOM 2961 CA LYS B 598 -0.373 7.793 38.277 1.00 26.40 C ATOM 2962 C LYS B 598 -1.190 6.579 38.696 1.00 24.74 C ATOM 2963 O LYS B 598 -2.182 6.706 39.401 1.00 26.18 O ATOM 2964 CB LYS B 598 0.752 8.095 39.285 1.00 27.08 C ATOM 2965 CG LYS B 598 1.582 9.358 38.957 1.00 29.97 C ATOM 2966 CD LYS B 598 2.399 9.202 37.655 1.00 35.46 C ATOM 2967 CE LYS B 598 3.911 9.249 37.915 1.00 42.44 C ATOM 2968 NZ LYS B 598 4.786 8.456 36.946 1.00 40.27 N ATOM 0 H LYS B 598 -1.439 9.356 38.838 1.00 26.38 H new ATOM 0 HA LYS B 598 0.046 7.589 37.426 1.00 26.40 H new ATOM 0 HB2 LYS B 598 0.362 8.198 40.167 1.00 27.08 H new ATOM 0 HB3 LYS B 598 1.348 7.331 39.326 1.00 27.08 H new ATOM 0 HG2 LYS B 598 0.988 10.120 38.874 1.00 29.97 H new ATOM 0 HG3 LYS B 598 2.184 9.547 39.694 1.00 29.97 H new ATOM 0 HD2 LYS B 598 2.171 8.360 37.230 1.00 35.46 H new ATOM 0 HD3 LYS B 598 2.156 9.908 37.035 1.00 35.46 H new ATOM 0 HE2 LYS B 598 4.195 10.176 37.894 1.00 42.44 H new ATOM 0 HE3 LYS B 598 4.076 8.922 38.813 1.00 42.44 H new ATOM 0 HZ1 LYS B 598 5.581 8.849 36.874 1.00 40.27 H new ATOM 0 HZ2 LYS B 598 4.892 7.627 37.252 1.00 40.27 H new ATOM 0 HZ3 LYS B 598 4.395 8.429 36.147 1.00 40.27 H new ATOM 2969 N THR B 599 -0.785 5.406 38.233 1.00 23.31 N ATOM 2970 CA THR B 599 -1.414 4.157 38.636 1.00 21.99 C ATOM 2971 C THR B 599 -0.926 3.871 40.058 1.00 19.93 C ATOM 2972 O THR B 599 0.273 3.842 40.304 1.00 18.60 O ATOM 2973 CB THR B 599 -1.069 3.027 37.635 1.00 22.76 C ATOM 2974 OG1 THR B 599 -1.342 3.493 36.304 1.00 24.21 O ATOM 2975 CG2 THR B 599 -1.920 1.770 37.901 1.00 22.19 C ATOM 0 H THR B 599 -0.137 5.311 37.676 1.00 23.31 H new ATOM 0 HA THR B 599 -2.382 4.215 38.630 1.00 21.99 H new ATOM 0 HB THR B 599 -0.133 2.796 37.739 1.00 22.76 H new ATOM 0 HG1 THR B 599 -0.675 3.348 35.814 1.00 24.21 H new ATOM 0 HG21 THR B 599 -1.685 1.079 37.262 1.00 22.19 H new ATOM 0 HG22 THR B 599 -1.751 1.449 38.801 1.00 22.19 H new ATOM 0 HG23 THR B 599 -2.860 1.990 37.808 1.00 22.19 H new ATOM 2976 N ARG B 600 -1.876 3.699 40.975 1.00 18.89 N ATOM 2977 CA ARG B 600 -1.628 3.739 42.421 1.00 20.63 C ATOM 2978 C ARG B 600 -2.411 2.624 43.127 1.00 19.32 C ATOM 2979 O ARG B 600 -3.592 2.450 42.880 1.00 21.21 O ATOM 2980 CB ARG B 600 -2.098 5.093 43.010 1.00 19.94 C ATOM 2981 CG ARG B 600 -1.311 6.329 42.644 1.00 24.59 C ATOM 2982 CD ARG B 600 -2.206 7.576 42.733 1.00 22.62 C ATOM 2983 NE ARG B 600 -3.234 7.504 41.694 1.00 26.79 N ATOM 2984 CZ ARG B 600 -4.356 8.201 41.653 1.00 24.43 C ATOM 2985 NH1 ARG B 600 -4.675 9.071 42.601 1.00 26.77 N ATOM 2986 NH2 ARG B 600 -5.180 8.011 40.644 1.00 28.54 N ATOM 0 H ARG B 600 -2.699 3.553 40.773 1.00 18.89 H new ATOM 0 HA ARG B 600 -0.675 3.623 42.562 1.00 20.63 H new ATOM 0 HB2 ARG B 600 -3.018 5.234 42.737 1.00 19.94 H new ATOM 0 HB3 ARG B 600 -2.097 5.014 43.977 1.00 19.94 H new ATOM 0 HG2 ARG B 600 -0.552 6.425 43.240 1.00 24.59 H new ATOM 0 HG3 ARG B 600 -0.957 6.241 41.745 1.00 24.59 H new ATOM 0 HD2 ARG B 600 -2.619 7.629 43.609 1.00 22.62 H new ATOM 0 HD3 ARG B 600 -1.673 8.379 42.621 1.00 22.62 H new ATOM 0 HE ARG B 600 -3.094 6.955 41.047 1.00 26.79 H new ATOM 0 HH11 ARG B 600 -4.145 9.195 43.267 1.00 26.77 H new ATOM 0 HH12 ARG B 600 -5.412 9.512 42.550 1.00 26.77 H new ATOM 0 HH21 ARG B 600 -4.983 7.443 40.029 1.00 28.54 H new ATOM 0 HH22 ARG B 600 -5.915 8.455 40.600 1.00 28.54 H new ATOM 2987 N ILE B 601 -1.753 1.858 43.992 1.00 19.43 N ATOM 2988 CA ILE B 601 -2.478 0.996 44.921 1.00 18.26 C ATOM 2989 C ILE B 601 -2.171 1.492 46.320 1.00 18.84 C ATOM 2990 O ILE B 601 -1.010 1.496 46.728 1.00 18.87 O ATOM 2991 CB ILE B 601 -2.078 -0.498 44.797 1.00 19.14 C ATOM 2992 CG1 ILE B 601 -2.366 -1.024 43.394 1.00 18.22 C ATOM 2993 CG2 ILE B 601 -2.790 -1.339 45.868 1.00 18.96 C ATOM 2994 CD1 ILE B 601 -1.802 -2.433 43.123 1.00 19.95 C ATOM 0 H ILE B 601 -0.896 1.822 44.058 1.00 19.43 H new ATOM 0 HA ILE B 601 -3.425 1.041 44.716 1.00 18.26 H new ATOM 0 HB ILE B 601 -1.123 -0.572 44.947 1.00 19.14 H new ATOM 0 HG12 ILE B 601 -3.326 -1.038 43.255 1.00 18.22 H new ATOM 0 HG13 ILE B 601 -1.994 -0.407 42.745 1.00 18.22 H new ATOM 0 HG21 ILE B 601 -2.529 -2.269 45.776 1.00 18.96 H new ATOM 0 HG22 ILE B 601 -2.541 -1.019 46.749 1.00 18.96 H new ATOM 0 HG23 ILE B 601 -3.750 -1.261 45.756 1.00 18.96 H new ATOM 0 HD11 ILE B 601 -2.022 -2.701 42.217 1.00 19.95 H new ATOM 0 HD12 ILE B 601 -0.838 -2.422 43.232 1.00 19.95 H new ATOM 0 HD13 ILE B 601 -2.191 -3.063 43.750 1.00 19.95 H new ATOM 2995 N LEU B 602 -3.210 1.902 47.047 1.00 19.21 N ATOM 2996 CA LEU B 602 -3.054 2.375 48.422 1.00 18.62 C ATOM 2997 C LEU B 602 -3.673 1.382 49.391 1.00 18.89 C ATOM 2998 O LEU B 602 -4.863 1.130 49.342 1.00 18.08 O ATOM 2999 CB LEU B 602 -3.655 3.789 48.587 1.00 17.85 C ATOM 3000 CG LEU B 602 -3.665 4.351 50.020 1.00 21.12 C ATOM 3001 CD1 LEU B 602 -2.243 4.565 50.628 1.00 17.18 C ATOM 3002 CD2 LEU B 602 -4.488 5.607 50.129 1.00 18.57 C ATOM 0 H LEU B 602 -4.020 1.914 46.759 1.00 19.21 H new ATOM 0 HA LEU B 602 -2.108 2.440 48.627 1.00 18.62 H new ATOM 0 HB2 LEU B 602 -3.158 4.401 48.021 1.00 17.85 H new ATOM 0 HB3 LEU B 602 -4.567 3.775 48.257 1.00 17.85 H new ATOM 0 HG LEU B 602 -4.087 3.660 50.554 1.00 21.12 H new ATOM 0 HD11 LEU B 602 -2.325 4.919 51.527 1.00 17.18 H new ATOM 0 HD12 LEU B 602 -1.772 3.717 50.656 1.00 17.18 H new ATOM 0 HD13 LEU B 602 -1.747 5.192 50.078 1.00 17.18 H new ATOM 0 HD21 LEU B 602 -4.469 5.928 51.044 1.00 18.57 H new ATOM 0 HD22 LEU B 602 -4.122 6.286 49.541 1.00 18.57 H new ATOM 0 HD23 LEU B 602 -5.404 5.417 49.873 1.00 18.57 H new ATOM 3003 N VAL B 603 -2.853 0.805 50.261 1.00 18.53 N ATOM 3004 CA VAL B 603 -3.369 -0.062 51.318 1.00 19.57 C ATOM 3005 C VAL B 603 -3.916 0.841 52.429 1.00 20.53 C ATOM 3006 O VAL B 603 -3.162 1.527 53.091 1.00 20.81 O ATOM 3007 CB VAL B 603 -2.298 -1.048 51.811 1.00 19.09 C ATOM 3008 CG1 VAL B 603 -2.789 -1.821 53.045 1.00 20.33 C ATOM 3009 CG2 VAL B 603 -1.969 -2.043 50.701 1.00 16.89 C ATOM 0 H VAL B 603 -1.998 0.901 50.259 1.00 18.53 H new ATOM 0 HA VAL B 603 -4.087 -0.622 50.984 1.00 19.57 H new ATOM 0 HB VAL B 603 -1.507 -0.541 52.053 1.00 19.09 H new ATOM 0 HG11 VAL B 603 -2.098 -2.436 53.338 1.00 20.33 H new ATOM 0 HG12 VAL B 603 -2.990 -1.196 53.760 1.00 20.33 H new ATOM 0 HG13 VAL B 603 -3.590 -2.319 52.818 1.00 20.33 H new ATOM 0 HG21 VAL B 603 -1.293 -2.665 51.013 1.00 16.89 H new ATOM 0 HG22 VAL B 603 -2.770 -2.533 50.457 1.00 16.89 H new ATOM 0 HG23 VAL B 603 -1.635 -1.565 49.926 1.00 16.89 H new ATOM 3010 N THR B 604 -5.238 0.865 52.566 1.00 23.71 N ATOM 3011 CA THR B 604 -5.948 1.715 53.526 1.00 25.18 C ATOM 3012 C THR B 604 -7.351 1.124 53.770 1.00 26.62 C ATOM 3013 O THR B 604 -7.944 0.525 52.873 1.00 27.32 O ATOM 3014 CB THR B 604 -6.087 3.158 52.980 1.00 24.83 C ATOM 3015 OG1 THR B 604 -6.660 4.011 53.984 1.00 25.50 O ATOM 3016 CG2 THR B 604 -6.967 3.176 51.723 1.00 24.44 C ATOM 0 H THR B 604 -5.763 0.376 52.092 1.00 23.71 H new ATOM 0 HA THR B 604 -5.445 1.746 54.355 1.00 25.18 H new ATOM 0 HB THR B 604 -5.204 3.484 52.748 1.00 24.83 H new ATOM 0 HG1 THR B 604 -6.065 4.239 54.531 1.00 25.50 H new ATOM 0 HG21 THR B 604 -7.044 4.085 51.394 1.00 24.44 H new ATOM 0 HG22 THR B 604 -6.565 2.618 51.039 1.00 24.44 H new ATOM 0 HG23 THR B 604 -7.849 2.836 51.940 1.00 24.44 H new ATOM 3017 N SER B 605 -7.879 1.289 54.978 1.00 28.35 N ATOM 3018 CA SER B 605 -9.256 0.852 55.258 1.00 29.07 C ATOM 3019 C SER B 605 -10.165 2.032 55.618 1.00 30.63 C ATOM 3020 O SER B 605 -11.367 1.859 55.879 1.00 33.06 O ATOM 3021 CB SER B 605 -9.256 -0.258 56.317 1.00 28.97 C ATOM 3022 OG SER B 605 -8.489 -1.367 55.854 1.00 28.19 O ATOM 0 H SER B 605 -7.469 1.646 55.645 1.00 28.35 H new ATOM 0 HA SER B 605 -9.633 0.474 54.448 1.00 29.07 H new ATOM 0 HB2 SER B 605 -8.886 0.077 57.149 1.00 28.97 H new ATOM 0 HB3 SER B 605 -10.166 -0.538 56.504 1.00 28.97 H new ATOM 0 HG SER B 605 -8.548 -1.998 56.405 1.00 28.19 H new ATOM 3023 N LYS B 606 -9.577 3.227 55.596 1.00 30.47 N ATOM 3024 CA LYS B 606 -10.259 4.486 55.889 1.00 30.32 C ATOM 3025 C LYS B 606 -11.361 4.716 54.865 1.00 30.40 C ATOM 3026 O LYS B 606 -11.078 4.798 53.656 1.00 30.28 O ATOM 3027 CB LYS B 606 -9.238 5.625 55.830 1.00 30.63 C ATOM 3028 CG LYS B 606 -9.676 6.951 56.445 1.00 31.55 C ATOM 3029 CD LYS B 606 -9.216 7.062 57.881 1.00 35.88 C ATOM 0 H LYS B 606 -8.745 3.330 55.404 1.00 30.47 H new ATOM 0 HA LYS B 606 -10.656 4.453 56.773 1.00 30.32 H new ATOM 0 HB2 LYS B 606 -8.429 5.333 56.278 1.00 30.63 H new ATOM 0 HB3 LYS B 606 -9.007 5.781 54.901 1.00 30.63 H new ATOM 0 HG2 LYS B 606 -9.312 7.687 55.928 1.00 31.55 H new ATOM 0 HG3 LYS B 606 -10.642 7.026 56.405 1.00 31.55 H new ATOM 3030 N MET B 607 -12.607 4.801 55.340 1.00 29.01 N ATOM 3031 CA MET B 607 -13.772 5.016 54.472 1.00 29.92 C ATOM 3032 C MET B 607 -13.640 6.282 53.630 1.00 29.03 C ATOM 3033 O MET B 607 -14.071 6.307 52.475 1.00 28.88 O ATOM 3034 CB MET B 607 -15.089 5.040 55.269 1.00 30.65 C ATOM 3035 CG MET B 607 -15.627 3.657 55.673 1.00 31.88 C ATOM 0 H MET B 607 -12.801 4.736 56.175 1.00 29.01 H new ATOM 0 HA MET B 607 -13.798 4.258 53.868 1.00 29.92 H new ATOM 0 HB2 MET B 607 -14.956 5.568 56.072 1.00 30.65 H new ATOM 0 HB3 MET B 607 -15.764 5.493 54.740 1.00 30.65 H new ATOM 3036 N GLU B 608 -13.035 7.328 54.193 1.00 28.32 N ATOM 3037 CA GLU B 608 -12.802 8.561 53.433 1.00 28.17 C ATOM 3038 C GLU B 608 -11.917 8.316 52.210 1.00 27.72 C ATOM 3039 O GLU B 608 -12.112 8.945 51.155 1.00 27.86 O ATOM 3040 CB GLU B 608 -12.180 9.648 54.322 1.00 29.69 C ATOM 0 H GLU B 608 -12.754 7.347 55.005 1.00 28.32 H new ATOM 0 HA GLU B 608 -13.668 8.868 53.121 1.00 28.17 H new ATOM 3041 N HIS B 609 -10.952 7.401 52.346 1.00 25.06 N ATOM 3042 CA HIS B 609 -10.048 7.070 51.242 1.00 24.28 C ATOM 3043 C HIS B 609 -10.743 6.168 50.223 1.00 25.03 C ATOM 3044 O HIS B 609 -10.587 6.364 49.018 1.00 24.39 O ATOM 3045 CB HIS B 609 -8.779 6.364 51.733 1.00 23.44 C ATOM 3046 CG HIS B 609 -8.000 7.135 52.754 1.00 23.62 C ATOM 3047 ND1 HIS B 609 -6.990 6.563 53.496 1.00 25.70 N ATOM 3048 CD2 HIS B 609 -8.098 8.420 53.176 1.00 22.71 C ATOM 3049 CE1 HIS B 609 -6.490 7.468 54.321 1.00 27.84 C ATOM 3050 NE2 HIS B 609 -7.143 8.603 54.145 1.00 25.46 N ATOM 0 H HIS B 609 -10.805 6.961 53.070 1.00 25.06 H new ATOM 0 HA HIS B 609 -9.799 7.911 50.827 1.00 24.28 H new ATOM 0 HB2 HIS B 609 -9.025 5.505 52.110 1.00 23.44 H new ATOM 0 HB3 HIS B 609 -8.206 6.185 50.971 1.00 23.44 H new ATOM 0 HD1 HIS B 609 -6.726 5.747 53.433 1.00 25.70 H new ATOM 0 HD2 HIS B 609 -8.700 9.058 52.867 1.00 22.71 H new ATOM 0 HE1 HIS B 609 -5.796 7.329 54.924 1.00 27.84 H new ATOM 3051 N LEU B 610 -11.491 5.176 50.714 1.00 25.04 N ATOM 3052 CA LEU B 610 -12.227 4.268 49.844 1.00 26.93 C ATOM 3053 C LEU B 610 -13.150 5.053 48.927 1.00 27.56 C ATOM 3054 O LEU B 610 -13.240 4.754 47.751 1.00 26.99 O ATOM 3055 CB LEU B 610 -13.006 3.225 50.656 1.00 27.06 C ATOM 3056 CG LEU B 610 -12.182 2.419 51.679 1.00 28.67 C ATOM 3057 CD1 LEU B 610 -12.998 1.285 52.308 1.00 28.78 C ATOM 3058 CD2 LEU B 610 -10.905 1.897 51.057 1.00 26.34 C ATOM 0 H LEU B 610 -11.583 5.015 51.554 1.00 25.04 H new ATOM 0 HA LEU B 610 -11.588 3.786 49.296 1.00 26.93 H new ATOM 0 HB2 LEU B 610 -13.723 3.677 51.128 1.00 27.06 H new ATOM 0 HB3 LEU B 610 -13.421 2.603 50.038 1.00 27.06 H new ATOM 0 HG LEU B 610 -11.941 3.026 52.396 1.00 28.67 H new ATOM 0 HD11 LEU B 610 -12.446 0.803 52.944 1.00 28.78 H new ATOM 0 HD12 LEU B 610 -13.769 1.656 52.765 1.00 28.78 H new ATOM 0 HD13 LEU B 610 -13.296 0.677 51.614 1.00 28.78 H new ATOM 0 HD21 LEU B 610 -10.405 1.394 51.719 1.00 26.34 H new ATOM 0 HD22 LEU B 610 -11.122 1.319 50.309 1.00 26.34 H new ATOM 0 HD23 LEU B 610 -10.369 2.642 50.745 1.00 26.34 H new ATOM 3059 N LYS B 611 -13.780 6.091 49.482 1.00 29.33 N ATOM 3060 CA LYS B 611 -14.663 7.005 48.763 1.00 30.83 C ATOM 3061 C LYS B 611 -13.998 7.652 47.527 1.00 30.47 C ATOM 3062 O LYS B 611 -14.651 7.838 46.492 1.00 30.25 O ATOM 3063 CB LYS B 611 -15.167 8.078 49.735 1.00 31.92 C ATOM 3064 CG LYS B 611 -16.400 8.847 49.292 1.00 36.99 C ATOM 3065 CD LYS B 611 -16.349 10.323 49.774 1.00 41.01 C ATOM 3066 CE LYS B 611 -16.408 10.469 51.310 1.00 43.03 C ATOM 3067 NZ LYS B 611 -16.268 11.917 51.763 1.00 40.11 N ATOM 0 H LYS B 611 -13.701 6.287 50.316 1.00 29.33 H new ATOM 0 HA LYS B 611 -15.407 6.486 48.419 1.00 30.83 H new ATOM 0 HB2 LYS B 611 -15.360 7.654 50.586 1.00 31.92 H new ATOM 0 HB3 LYS B 611 -14.450 8.712 49.890 1.00 31.92 H new ATOM 0 HG2 LYS B 611 -16.469 8.823 48.325 1.00 36.99 H new ATOM 0 HG3 LYS B 611 -17.195 8.417 49.644 1.00 36.99 H new ATOM 0 HD2 LYS B 611 -15.534 10.735 49.448 1.00 41.01 H new ATOM 0 HD3 LYS B 611 -17.090 10.810 49.381 1.00 41.01 H new ATOM 0 HE2 LYS B 611 -17.250 10.112 51.634 1.00 43.03 H new ATOM 0 HE3 LYS B 611 -15.702 9.938 51.710 1.00 43.03 H new ATOM 0 HZ1 LYS B 611 -16.307 11.956 52.651 1.00 40.11 H new ATOM 0 HZ2 LYS B 611 -15.486 12.240 51.487 1.00 40.11 H new ATOM 0 HZ3 LYS B 611 -16.929 12.402 51.416 1.00 40.11 H new ATOM 3068 N LYS B 612 -12.705 7.967 47.631 1.00 30.26 N ATOM 3069 CA LYS B 612 -11.967 8.660 46.555 1.00 29.40 C ATOM 3070 C LYS B 612 -11.293 7.717 45.553 1.00 28.67 C ATOM 3071 O LYS B 612 -10.746 8.154 44.535 1.00 28.00 O ATOM 3072 CB LYS B 612 -10.938 9.639 47.132 1.00 30.36 C ATOM 3073 CG LYS B 612 -11.538 10.856 47.805 1.00 32.22 C ATOM 0 H LYS B 612 -12.227 7.788 48.323 1.00 30.26 H new ATOM 0 HA LYS B 612 -12.640 9.151 46.059 1.00 29.40 H new ATOM 0 HB2 LYS B 612 -10.385 9.168 47.775 1.00 30.36 H new ATOM 0 HB3 LYS B 612 -10.353 9.934 46.417 1.00 30.36 H new ATOM 3074 N ALA B 613 -11.340 6.426 45.852 1.00 27.57 N ATOM 3075 CA ALA B 613 -10.728 5.397 45.024 1.00 27.29 C ATOM 3076 C ALA B 613 -11.530 5.127 43.758 1.00 27.18 C ATOM 3077 O ALA B 613 -12.764 5.182 43.762 1.00 26.45 O ATOM 3078 CB ALA B 613 -10.591 4.097 45.841 1.00 26.87 C ATOM 0 H ALA B 613 -11.734 6.118 46.552 1.00 27.57 H new ATOM 0 HA ALA B 613 -9.854 5.717 44.752 1.00 27.29 H new ATOM 0 HB1 ALA B 613 -10.183 3.410 45.291 1.00 26.87 H new ATOM 0 HB2 ALA B 613 -10.035 4.260 46.619 1.00 26.87 H new ATOM 0 HB3 ALA B 613 -11.469 3.801 46.129 1.00 26.87 H new ATOM 3079 N ASP B 614 -10.819 4.818 42.681 1.00 26.26 N ATOM 3080 CA ASP B 614 -11.442 4.396 41.441 1.00 27.53 C ATOM 3081 C ASP B 614 -12.002 2.975 41.599 1.00 26.48 C ATOM 3082 O ASP B 614 -13.121 2.682 41.154 1.00 25.33 O ATOM 3083 CB ASP B 614 -10.430 4.489 40.284 1.00 26.47 C ATOM 3084 CG ASP B 614 -9.993 5.924 40.015 1.00 30.14 C ATOM 3085 OD1 ASP B 614 -10.873 6.754 39.690 1.00 37.13 O ATOM 3086 OD2 ASP B 614 -8.787 6.243 40.143 1.00 29.14 O ATOM 0 H ASP B 614 -9.960 4.848 42.651 1.00 26.26 H new ATOM 0 HA ASP B 614 -12.183 4.985 41.229 1.00 27.53 H new ATOM 0 HB2 ASP B 614 -9.652 3.949 40.493 1.00 26.47 H new ATOM 0 HB3 ASP B 614 -10.825 4.117 39.480 1.00 26.47 H new ATOM 3087 N LYS B 615 -11.219 2.109 42.247 1.00 25.32 N ATOM 3088 CA LYS B 615 -11.645 0.748 42.592 1.00 25.27 C ATOM 3089 C LYS B 615 -11.221 0.420 44.019 1.00 23.85 C ATOM 3090 O LYS B 615 -10.249 0.997 44.534 1.00 21.10 O ATOM 3091 CB LYS B 615 -11.031 -0.284 41.638 1.00 25.94 C ATOM 3092 CG LYS B 615 -11.623 -0.297 40.232 1.00 31.70 C ATOM 3093 CD LYS B 615 -13.103 -0.709 40.264 1.00 35.68 C ATOM 3094 CE LYS B 615 -13.710 -0.713 38.877 1.00 41.32 C ATOM 3095 NZ LYS B 615 -13.319 -1.945 38.125 1.00 45.01 N ATOM 0 H LYS B 615 -10.419 2.296 42.501 1.00 25.32 H new ATOM 0 HA LYS B 615 -12.611 0.709 42.513 1.00 25.27 H new ATOM 0 HB2 LYS B 615 -10.078 -0.116 41.571 1.00 25.94 H new ATOM 0 HB3 LYS B 615 -11.137 -1.166 42.027 1.00 25.94 H new ATOM 0 HG2 LYS B 615 -11.537 0.583 39.833 1.00 31.70 H new ATOM 0 HG3 LYS B 615 -11.124 -0.913 39.673 1.00 31.70 H new ATOM 0 HD2 LYS B 615 -13.185 -1.592 40.657 1.00 35.68 H new ATOM 0 HD3 LYS B 615 -13.597 -0.098 40.833 1.00 35.68 H new ATOM 0 HE2 LYS B 615 -14.676 -0.663 38.943 1.00 41.32 H new ATOM 0 HE3 LYS B 615 -13.418 0.074 38.390 1.00 41.32 H new ATOM 0 HZ1 LYS B 615 -13.686 -1.927 37.314 1.00 45.01 H new ATOM 0 HZ2 LYS B 615 -12.433 -1.978 38.049 1.00 45.01 H new ATOM 0 HZ3 LYS B 615 -13.605 -2.664 38.564 1.00 45.01 H new ATOM 3096 N ILE B 616 -11.962 -0.497 44.642 1.00 22.53 N ATOM 3097 CA ILE B 616 -11.708 -0.942 45.998 1.00 23.93 C ATOM 3098 C ILE B 616 -11.645 -2.470 46.020 1.00 23.82 C ATOM 3099 O ILE B 616 -12.461 -3.144 45.395 1.00 23.61 O ATOM 3100 CB ILE B 616 -12.825 -0.466 46.970 1.00 24.38 C ATOM 3101 CG1 ILE B 616 -12.821 1.062 47.094 1.00 24.82 C ATOM 3102 CG2 ILE B 616 -12.629 -1.047 48.364 1.00 25.97 C ATOM 3103 CD1 ILE B 616 -14.137 1.593 47.591 1.00 32.87 C ATOM 0 H ILE B 616 -12.638 -0.881 44.275 1.00 22.53 H new ATOM 0 HA ILE B 616 -10.866 -0.560 46.291 1.00 23.93 H new ATOM 0 HB ILE B 616 -13.668 -0.773 46.601 1.00 24.38 H new ATOM 0 HG12 ILE B 616 -12.114 1.334 47.700 1.00 24.82 H new ATOM 0 HG13 ILE B 616 -12.621 1.455 46.230 1.00 24.82 H new ATOM 0 HG21 ILE B 616 -13.338 -0.734 48.948 1.00 25.97 H new ATOM 0 HG22 ILE B 616 -12.653 -2.016 48.317 1.00 25.97 H new ATOM 0 HG23 ILE B 616 -11.771 -0.762 48.716 1.00 25.97 H new ATOM 0 HD11 ILE B 616 -14.093 2.560 47.655 1.00 32.87 H new ATOM 0 HD12 ILE B 616 -14.841 1.342 46.973 1.00 32.87 H new ATOM 0 HD13 ILE B 616 -14.327 1.220 48.466 1.00 32.87 H new ATOM 3104 N LEU B 617 -10.666 -3.001 46.737 1.00 22.71 N ATOM 3105 CA LEU B 617 -10.582 -4.438 46.987 1.00 22.35 C ATOM 3106 C LEU B 617 -10.514 -4.652 48.491 1.00 22.20 C ATOM 3107 O LEU B 617 -9.564 -4.203 49.131 1.00 22.54 O ATOM 3108 CB LEU B 617 -9.350 -5.043 46.288 1.00 21.50 C ATOM 3109 CG LEU B 617 -9.026 -6.516 46.592 1.00 23.59 C ATOM 3110 CD1 LEU B 617 -10.082 -7.478 45.990 1.00 21.95 C ATOM 3111 CD2 LEU B 617 -7.626 -6.854 46.087 1.00 23.03 C ATOM 0 H LEU B 617 -10.031 -2.543 47.093 1.00 22.71 H new ATOM 0 HA LEU B 617 -11.363 -4.885 46.626 1.00 22.35 H new ATOM 0 HB2 LEU B 617 -9.473 -4.953 45.330 1.00 21.50 H new ATOM 0 HB3 LEU B 617 -8.576 -4.509 46.526 1.00 21.50 H new ATOM 0 HG LEU B 617 -9.053 -6.637 47.554 1.00 23.59 H new ATOM 0 HD11 LEU B 617 -9.844 -8.394 46.202 1.00 21.95 H new ATOM 0 HD12 LEU B 617 -10.954 -7.276 46.364 1.00 21.95 H new ATOM 0 HD13 LEU B 617 -10.110 -7.366 45.027 1.00 21.95 H new ATOM 0 HD21 LEU B 617 -7.427 -7.783 46.281 1.00 23.03 H new ATOM 0 HD22 LEU B 617 -7.583 -6.708 45.129 1.00 23.03 H new ATOM 0 HD23 LEU B 617 -6.976 -6.286 46.529 1.00 23.03 H new ATOM 3112 N ILE B 618 -11.527 -5.307 49.060 1.00 21.71 N ATOM 3113 CA ILE B 618 -11.495 -5.684 50.474 1.00 21.28 C ATOM 3114 C ILE B 618 -11.103 -7.144 50.590 1.00 22.74 C ATOM 3115 O ILE B 618 -11.791 -8.030 50.075 1.00 22.42 O ATOM 3116 CB ILE B 618 -12.831 -5.429 51.199 1.00 21.31 C ATOM 3117 CG1 ILE B 618 -13.298 -3.989 50.928 1.00 22.35 C ATOM 3118 CG2 ILE B 618 -12.685 -5.666 52.701 1.00 18.73 C ATOM 3119 CD1 ILE B 618 -14.663 -3.675 51.386 1.00 23.93 C ATOM 0 H ILE B 618 -12.242 -5.542 48.644 1.00 21.71 H new ATOM 0 HA ILE B 618 -10.838 -5.121 50.911 1.00 21.28 H new ATOM 0 HB ILE B 618 -13.495 -6.050 50.860 1.00 21.31 H new ATOM 0 HG12 ILE B 618 -12.680 -3.378 51.358 1.00 22.35 H new ATOM 0 HG13 ILE B 618 -13.246 -3.822 49.974 1.00 22.35 H new ATOM 0 HG21 ILE B 618 -13.535 -5.501 53.139 1.00 18.73 H new ATOM 0 HG22 ILE B 618 -12.413 -6.584 52.859 1.00 18.73 H new ATOM 0 HG23 ILE B 618 -12.014 -5.064 53.060 1.00 18.73 H new ATOM 0 HD11 ILE B 618 -14.871 -2.751 51.175 1.00 23.93 H new ATOM 0 HD12 ILE B 618 -15.296 -4.259 50.940 1.00 23.93 H new ATOM 0 HD13 ILE B 618 -14.721 -3.808 52.345 1.00 23.93 H new ATOM 3120 N LEU B 619 -9.978 -7.387 51.254 1.00 22.45 N ATOM 3121 CA LEU B 619 -9.538 -8.742 51.532 1.00 24.87 C ATOM 3122 C LEU B 619 -10.108 -9.185 52.868 1.00 26.45 C ATOM 3123 O LEU B 619 -10.318 -8.363 53.767 1.00 24.97 O ATOM 3124 CB LEU B 619 -8.005 -8.838 51.542 1.00 25.17 C ATOM 3125 CG LEU B 619 -7.291 -8.594 50.197 1.00 28.16 C ATOM 3126 CD1 LEU B 619 -5.795 -8.743 50.326 1.00 26.09 C ATOM 3127 CD2 LEU B 619 -7.823 -9.522 49.075 1.00 25.81 C ATOM 0 H LEU B 619 -9.454 -6.774 51.553 1.00 22.45 H new ATOM 0 HA LEU B 619 -9.861 -9.328 50.830 1.00 24.87 H new ATOM 0 HB2 LEU B 619 -7.665 -8.198 52.187 1.00 25.17 H new ATOM 0 HB3 LEU B 619 -7.758 -9.720 51.861 1.00 25.17 H new ATOM 0 HG LEU B 619 -7.489 -7.678 49.947 1.00 28.16 H new ATOM 0 HD11 LEU B 619 -5.378 -8.584 49.465 1.00 26.09 H new ATOM 0 HD12 LEU B 619 -5.460 -8.100 50.971 1.00 26.09 H new ATOM 0 HD13 LEU B 619 -5.584 -9.641 50.626 1.00 26.09 H new ATOM 0 HD21 LEU B 619 -7.349 -9.336 48.249 1.00 25.81 H new ATOM 0 HD22 LEU B 619 -7.682 -10.448 49.327 1.00 25.81 H new ATOM 0 HD23 LEU B 619 -8.771 -9.363 48.946 1.00 25.81 H new ATOM 3128 N HIS B 620 -10.380 -10.484 52.976 1.00 28.06 N ATOM 3129 CA HIS B 620 -10.761 -11.099 54.241 1.00 29.68 C ATOM 3130 C HIS B 620 -10.155 -12.506 54.361 1.00 29.38 C ATOM 3131 O HIS B 620 -10.448 -13.394 53.560 1.00 29.18 O ATOM 3132 CB HIS B 620 -12.276 -11.128 54.426 1.00 30.20 C ATOM 3133 CG HIS B 620 -12.693 -11.747 55.722 1.00 35.86 C ATOM 3134 ND1 HIS B 620 -12.645 -11.064 56.918 1.00 39.17 N ATOM 3135 CD2 HIS B 620 -13.110 -13.001 56.019 1.00 38.44 C ATOM 3136 CE1 HIS B 620 -13.044 -11.863 57.893 1.00 41.31 C ATOM 3137 NE2 HIS B 620 -13.328 -13.045 57.373 1.00 40.44 N ATOM 0 H HIS B 620 -10.348 -11.033 52.315 1.00 28.06 H new ATOM 0 HA HIS B 620 -10.401 -10.551 54.956 1.00 29.68 H new ATOM 0 HB2 HIS B 620 -12.620 -10.222 54.380 1.00 30.20 H new ATOM 0 HB3 HIS B 620 -12.677 -11.621 53.693 1.00 30.20 H new ATOM 0 HD2 HIS B 620 -13.227 -13.701 55.418 1.00 38.44 H new ATOM 0 HE1 HIS B 620 -13.113 -11.633 58.791 1.00 41.31 H new ATOM 0 HE2 HIS B 620 -13.605 -13.731 57.812 1.00 40.44 H new ATOM 3138 N GLU B 621 -9.292 -12.685 55.354 1.00 29.69 N ATOM 3139 CA GLU B 621 -8.547 -13.932 55.534 1.00 31.10 C ATOM 3140 C GLU B 621 -8.076 -14.529 54.208 1.00 29.14 C ATOM 3141 O GLU B 621 -8.255 -15.722 53.949 1.00 27.75 O ATOM 3142 CB GLU B 621 -9.370 -14.949 56.327 1.00 31.62 C ATOM 3143 CG GLU B 621 -9.853 -14.412 57.670 1.00 34.79 C ATOM 3144 CD GLU B 621 -10.678 -15.422 58.450 1.00 36.20 C ATOM 3145 OE1 GLU B 621 -11.189 -15.048 59.537 1.00 44.32 O ATOM 3146 OE2 GLU B 621 -10.808 -16.584 57.985 1.00 42.02 O ATOM 0 H GLU B 621 -9.119 -12.086 55.946 1.00 29.69 H new ATOM 0 HA GLU B 621 -7.751 -13.713 56.043 1.00 31.10 H new ATOM 0 HB2 GLU B 621 -10.137 -15.219 55.798 1.00 31.62 H new ATOM 0 HB3 GLU B 621 -8.835 -15.744 56.476 1.00 31.62 H new ATOM 0 HG2 GLU B 621 -9.086 -14.148 58.202 1.00 34.79 H new ATOM 0 HG3 GLU B 621 -10.384 -13.614 57.522 1.00 34.79 H new ATOM 3147 N GLY B 622 -7.474 -13.687 53.368 1.00 26.39 N ATOM 3148 CA GLY B 622 -6.903 -14.129 52.112 1.00 26.24 C ATOM 3149 C GLY B 622 -7.843 -14.148 50.924 1.00 25.87 C ATOM 3150 O GLY B 622 -7.392 -14.274 49.780 1.00 26.26 O ATOM 0 H GLY B 622 -7.389 -12.844 53.517 1.00 26.39 H new ATOM 0 HA2 GLY B 622 -6.152 -13.553 51.898 1.00 26.24 H new ATOM 0 HA3 GLY B 622 -6.549 -15.023 52.235 1.00 26.24 H new ATOM 3151 N SER B 623 -9.145 -14.018 51.176 1.00 25.46 N ATOM 3152 CA SER B 623 -10.140 -14.027 50.086 1.00 26.27 C ATOM 3153 C SER B 623 -10.586 -12.620 49.696 1.00 25.54 C ATOM 3154 O SER B 623 -10.463 -11.694 50.482 1.00 25.99 O ATOM 3155 CB SER B 623 -11.375 -14.843 50.481 1.00 26.24 C ATOM 3156 OG SER B 623 -11.008 -16.126 50.969 1.00 32.32 O ATOM 0 H SER B 623 -9.477 -13.924 51.964 1.00 25.46 H new ATOM 0 HA SER B 623 -9.703 -14.434 49.322 1.00 26.27 H new ATOM 0 HB2 SER B 623 -11.877 -14.367 51.161 1.00 26.24 H new ATOM 0 HB3 SER B 623 -11.960 -14.941 49.714 1.00 26.24 H new ATOM 0 HG SER B 623 -11.699 -16.554 51.180 1.00 32.32 H new ATOM 3157 N SER B 624 -11.119 -12.474 48.487 1.00 25.39 N ATOM 3158 CA SER B 624 -11.749 -11.231 48.061 1.00 25.85 C ATOM 3159 C SER B 624 -13.153 -11.137 48.655 1.00 27.98 C ATOM 3160 O SER B 624 -14.066 -11.823 48.211 1.00 27.82 O ATOM 3161 CB SER B 624 -11.813 -11.162 46.530 1.00 25.77 C ATOM 3162 OG SER B 624 -12.425 -9.961 46.085 1.00 25.73 O ATOM 0 H SER B 624 -11.125 -13.094 47.891 1.00 25.39 H new ATOM 0 HA SER B 624 -11.219 -10.483 48.379 1.00 25.85 H new ATOM 0 HB2 SER B 624 -10.916 -11.223 46.165 1.00 25.77 H new ATOM 0 HB3 SER B 624 -12.310 -11.923 46.192 1.00 25.77 H new ATOM 0 HG SER B 624 -12.148 -9.774 45.315 1.00 25.73 H new ATOM 3163 N TYR B 625 -13.317 -10.292 49.661 1.00 28.38 N ATOM 3164 CA TYR B 625 -14.605 -10.071 50.263 1.00 29.48 C ATOM 3165 C TYR B 625 -15.460 -9.164 49.360 1.00 28.85 C ATOM 3166 O TYR B 625 -16.675 -9.338 49.262 1.00 28.72 O ATOM 3167 CB TYR B 625 -14.429 -9.482 51.663 1.00 31.20 C ATOM 3168 CG TYR B 625 -15.718 -9.077 52.327 1.00 33.86 C ATOM 3169 CD1 TYR B 625 -16.151 -7.764 52.278 1.00 33.98 C ATOM 3170 CD2 TYR B 625 -16.514 -10.015 52.990 1.00 35.47 C ATOM 3171 CE1 TYR B 625 -17.337 -7.372 52.883 1.00 38.34 C ATOM 3172 CE2 TYR B 625 -17.725 -9.632 53.593 1.00 39.01 C ATOM 3173 CZ TYR B 625 -18.119 -8.305 53.534 1.00 37.40 C ATOM 3174 OH TYR B 625 -19.305 -7.900 54.108 1.00 40.58 O ATOM 0 H TYR B 625 -12.679 -9.833 50.010 1.00 28.38 H new ATOM 0 HA TYR B 625 -15.073 -10.916 50.355 1.00 29.48 H new ATOM 0 HB2 TYR B 625 -13.979 -10.134 52.223 1.00 31.20 H new ATOM 0 HB3 TYR B 625 -13.848 -8.707 51.607 1.00 31.20 H new ATOM 0 HD1 TYR B 625 -15.637 -7.131 51.831 1.00 33.98 H new ATOM 0 HD2 TYR B 625 -16.240 -10.903 53.033 1.00 35.47 H new ATOM 0 HE1 TYR B 625 -17.605 -6.482 52.850 1.00 38.34 H new ATOM 0 HE2 TYR B 625 -18.255 -10.262 54.026 1.00 39.01 H new ATOM 0 HH TYR B 625 -19.682 -8.559 54.468 1.00 40.58 H new ATOM 3175 N PHE B 626 -14.800 -8.213 48.698 1.00 27.34 N ATOM 3176 CA PHE B 626 -15.446 -7.264 47.812 1.00 26.59 C ATOM 3177 C PHE B 626 -14.446 -6.677 46.831 1.00 26.07 C ATOM 3178 O PHE B 626 -13.326 -6.308 47.204 1.00 24.87 O ATOM 3179 CB PHE B 626 -16.111 -6.114 48.588 1.00 25.69 C ATOM 3180 CG PHE B 626 -16.709 -5.058 47.692 1.00 26.50 C ATOM 3181 CD1 PHE B 626 -17.965 -5.253 47.103 1.00 26.09 C ATOM 3182 CD2 PHE B 626 -16.008 -3.876 47.406 1.00 27.18 C ATOM 3183 CE1 PHE B 626 -18.513 -4.287 46.254 1.00 23.50 C ATOM 3184 CE2 PHE B 626 -16.548 -2.897 46.551 1.00 24.11 C ATOM 3185 CZ PHE B 626 -17.808 -3.095 45.982 1.00 26.49 C ATOM 0 H PHE B 626 -13.949 -8.105 48.757 1.00 27.34 H new ATOM 0 HA PHE B 626 -16.132 -7.754 47.332 1.00 26.59 H new ATOM 0 HB2 PHE B 626 -16.806 -6.477 49.159 1.00 25.69 H new ATOM 0 HB3 PHE B 626 -15.453 -5.701 49.169 1.00 25.69 H new ATOM 0 HD1 PHE B 626 -18.439 -6.033 47.279 1.00 26.09 H new ATOM 0 HD2 PHE B 626 -15.172 -3.737 47.788 1.00 27.18 H new ATOM 0 HE1 PHE B 626 -19.346 -4.431 45.867 1.00 23.50 H new ATOM 0 HE2 PHE B 626 -16.068 -2.122 46.366 1.00 24.11 H new ATOM 0 HZ PHE B 626 -18.179 -2.447 45.428 1.00 26.49 H new ATOM 3186 N TYR B 627 -14.879 -6.573 45.582 1.00 25.39 N ATOM 3187 CA TYR B 627 -14.139 -5.887 44.556 1.00 25.62 C ATOM 3188 C TYR B 627 -15.124 -5.069 43.734 1.00 26.25 C ATOM 3189 O TYR B 627 -16.090 -5.619 43.192 1.00 25.52 O ATOM 3190 CB TYR B 627 -13.399 -6.899 43.677 1.00 26.12 C ATOM 3191 CG TYR B 627 -12.767 -6.279 42.460 1.00 26.52 C ATOM 3192 CD1 TYR B 627 -11.878 -5.203 42.579 1.00 25.17 C ATOM 3193 CD2 TYR B 627 -13.065 -6.754 41.188 1.00 27.15 C ATOM 3194 CE1 TYR B 627 -11.314 -4.619 41.461 1.00 26.40 C ATOM 3195 CE2 TYR B 627 -12.499 -6.178 40.057 1.00 30.47 C ATOM 3196 CZ TYR B 627 -11.624 -5.105 40.201 1.00 28.98 C ATOM 3197 OH TYR B 627 -11.046 -4.539 39.075 1.00 28.92 O ATOM 0 H TYR B 627 -15.623 -6.907 45.310 1.00 25.39 H new ATOM 0 HA TYR B 627 -13.475 -5.299 44.949 1.00 25.62 H new ATOM 0 HB2 TYR B 627 -12.711 -7.335 44.205 1.00 26.12 H new ATOM 0 HB3 TYR B 627 -14.020 -7.589 43.395 1.00 26.12 H new ATOM 0 HD1 TYR B 627 -11.664 -4.877 43.423 1.00 25.17 H new ATOM 0 HD2 TYR B 627 -13.652 -7.469 41.092 1.00 27.15 H new ATOM 0 HE1 TYR B 627 -10.729 -3.902 41.554 1.00 26.40 H new ATOM 0 HE2 TYR B 627 -12.703 -6.507 39.211 1.00 30.47 H new ATOM 0 HH TYR B 627 -11.325 -4.934 38.388 1.00 28.92 H new ATOM 3198 N GLY B 628 -14.889 -3.760 43.655 1.00 25.51 N ATOM 3199 CA GLY B 628 -15.767 -2.855 42.912 1.00 27.56 C ATOM 3200 C GLY B 628 -15.502 -1.408 43.284 1.00 29.66 C ATOM 3201 O GLY B 628 -14.445 -1.088 43.818 1.00 29.15 O ATOM 0 H GLY B 628 -14.219 -3.372 44.029 1.00 25.51 H new ATOM 0 HA2 GLY B 628 -15.631 -2.977 41.959 1.00 27.56 H new ATOM 0 HA3 GLY B 628 -16.694 -3.075 43.096 1.00 27.56 H new ATOM 3202 N THR B 629 -16.454 -0.528 42.995 1.00 31.63 N ATOM 3203 CA THR B 629 -16.347 0.886 43.383 1.00 33.62 C ATOM 3204 C THR B 629 -16.957 1.104 44.772 1.00 34.93 C ATOM 3205 O THR B 629 -17.598 0.204 45.331 1.00 34.08 O ATOM 3206 CB THR B 629 -17.060 1.815 42.367 1.00 34.18 C ATOM 3207 OG1 THR B 629 -18.464 1.547 42.380 1.00 36.80 O ATOM 3208 CG2 THR B 629 -16.549 1.589 40.970 1.00 34.36 C ATOM 0 H THR B 629 -17.176 -0.725 42.572 1.00 31.63 H new ATOM 0 HA THR B 629 -15.403 1.109 43.396 1.00 33.62 H new ATOM 0 HB THR B 629 -16.881 2.733 42.626 1.00 34.18 H new ATOM 0 HG1 THR B 629 -18.871 2.201 42.715 1.00 36.80 H new ATOM 0 HG21 THR B 629 -17.011 2.182 40.356 1.00 34.36 H new ATOM 0 HG22 THR B 629 -15.597 1.772 40.940 1.00 34.36 H new ATOM 0 HG23 THR B 629 -16.709 0.668 40.712 1.00 34.36 H new ATOM 3209 N PHE B 630 -16.768 2.302 45.327 1.00 36.31 N ATOM 3210 CA PHE B 630 -17.343 2.641 46.626 1.00 38.16 C ATOM 3211 C PHE B 630 -18.861 2.760 46.551 1.00 38.54 C ATOM 3212 O PHE B 630 -19.558 2.441 47.514 1.00 38.94 O ATOM 3213 CB PHE B 630 -16.735 3.943 47.194 1.00 39.16 C ATOM 3214 CG PHE B 630 -17.101 4.204 48.632 1.00 39.92 C ATOM 3215 CD1 PHE B 630 -16.693 3.328 49.639 1.00 40.79 C ATOM 3216 CD2 PHE B 630 -17.858 5.321 48.978 1.00 42.31 C ATOM 3217 CE1 PHE B 630 -17.029 3.556 50.971 1.00 44.87 C ATOM 3218 CE2 PHE B 630 -18.200 5.567 50.314 1.00 44.36 C ATOM 3219 CZ PHE B 630 -17.788 4.680 51.313 1.00 43.73 C ATOM 0 H PHE B 630 -16.309 2.933 44.965 1.00 36.31 H new ATOM 0 HA PHE B 630 -17.123 1.914 47.229 1.00 38.16 H new ATOM 0 HB2 PHE B 630 -15.769 3.900 47.117 1.00 39.16 H new ATOM 0 HB3 PHE B 630 -17.030 4.692 46.652 1.00 39.16 H new ATOM 0 HD1 PHE B 630 -16.188 2.579 49.417 1.00 40.79 H new ATOM 0 HD2 PHE B 630 -18.139 5.910 48.315 1.00 42.31 H new ATOM 0 HE1 PHE B 630 -16.750 2.963 51.631 1.00 44.87 H new ATOM 0 HE2 PHE B 630 -18.700 6.319 50.536 1.00 44.36 H new ATOM 0 HZ PHE B 630 -18.017 4.837 52.201 1.00 43.73 H new ATOM 3220 N SER B 631 -19.351 3.228 45.409 1.00 39.25 N ATOM 3221 CA SER B 631 -20.782 3.335 45.158 1.00 40.58 C ATOM 3222 C SER B 631 -21.424 1.946 45.149 1.00 40.27 C ATOM 3223 O SER B 631 -22.474 1.752 45.764 1.00 40.67 O ATOM 3224 CB SER B 631 -21.044 4.090 43.851 1.00 40.77 C ATOM 3225 OG SER B 631 -22.227 3.636 43.206 1.00 44.41 O ATOM 0 H SER B 631 -18.860 3.494 44.755 1.00 39.25 H new ATOM 0 HA SER B 631 -21.191 3.845 45.875 1.00 40.58 H new ATOM 0 HB2 SER B 631 -21.120 5.039 44.036 1.00 40.77 H new ATOM 0 HB3 SER B 631 -20.287 3.977 43.255 1.00 40.77 H new ATOM 0 HG SER B 631 -22.343 4.069 42.496 1.00 44.41 H new ATOM 3226 N GLU B 632 -20.782 0.985 44.480 1.00 39.69 N ATOM 3227 CA GLU B 632 -21.214 -0.417 44.529 1.00 38.96 C ATOM 3228 C GLU B 632 -21.342 -0.898 45.972 1.00 38.40 C ATOM 3229 O GLU B 632 -22.355 -1.465 46.342 1.00 37.95 O ATOM 3230 CB GLU B 632 -20.238 -1.336 43.802 1.00 38.88 C ATOM 3231 CG GLU B 632 -20.038 -1.077 42.317 1.00 41.16 C ATOM 3232 CD GLU B 632 -19.098 -2.093 41.687 1.00 40.60 C ATOM 3233 OE1 GLU B 632 -19.353 -3.316 41.822 1.00 44.35 O ATOM 3234 OE2 GLU B 632 -18.114 -1.674 41.042 1.00 44.51 O ATOM 0 H GLU B 632 -20.090 1.125 43.989 1.00 39.69 H new ATOM 0 HA GLU B 632 -22.077 -0.455 44.087 1.00 38.96 H new ATOM 0 HB2 GLU B 632 -19.375 -1.270 44.240 1.00 38.88 H new ATOM 0 HB3 GLU B 632 -20.543 -2.250 43.912 1.00 38.88 H new ATOM 0 HG2 GLU B 632 -20.896 -1.107 41.865 1.00 41.16 H new ATOM 0 HG3 GLU B 632 -19.681 -0.184 42.190 1.00 41.16 H new ATOM 3235 N LEU B 633 -20.310 -0.638 46.771 1.00 38.35 N ATOM 3236 CA LEU B 633 -20.191 -1.112 48.151 1.00 39.14 C ATOM 3237 C LEU B 633 -21.278 -0.564 49.082 1.00 39.62 C ATOM 3238 O LEU B 633 -21.837 -1.306 49.879 1.00 39.32 O ATOM 3239 CB LEU B 633 -18.790 -0.773 48.704 1.00 38.42 C ATOM 3240 CG LEU B 633 -18.417 -1.135 50.152 1.00 38.74 C ATOM 3241 CD1 LEU B 633 -18.326 -2.644 50.359 1.00 39.51 C ATOM 3242 CD2 LEU B 633 -17.122 -0.440 50.587 1.00 39.58 C ATOM 0 H LEU B 633 -19.637 -0.166 46.518 1.00 38.35 H new ATOM 0 HA LEU B 633 -20.316 -2.074 48.126 1.00 39.14 H new ATOM 0 HB2 LEU B 633 -18.141 -1.203 48.125 1.00 38.42 H new ATOM 0 HB3 LEU B 633 -18.667 0.184 48.607 1.00 38.42 H new ATOM 0 HG LEU B 633 -19.135 -0.810 50.718 1.00 38.74 H new ATOM 0 HD11 LEU B 633 -18.090 -2.831 51.281 1.00 39.51 H new ATOM 0 HD12 LEU B 633 -19.183 -3.051 50.157 1.00 39.51 H new ATOM 0 HD13 LEU B 633 -17.647 -3.011 49.771 1.00 39.51 H new ATOM 0 HD21 LEU B 633 -16.913 -0.687 51.502 1.00 39.58 H new ATOM 0 HD22 LEU B 633 -16.396 -0.714 50.005 1.00 39.58 H new ATOM 0 HD23 LEU B 633 -17.236 0.522 50.530 1.00 39.58 H new ATOM 3243 N GLN B 634 -21.556 0.733 48.983 1.00 41.65 N ATOM 3244 CA GLN B 634 -22.591 1.371 49.806 1.00 43.88 C ATOM 3245 C GLN B 634 -24.004 1.000 49.335 1.00 45.24 C ATOM 3246 O GLN B 634 -24.944 1.000 50.126 1.00 45.73 O ATOM 3247 CB GLN B 634 -22.402 2.896 49.849 1.00 43.96 C ATOM 0 H GLN B 634 -21.155 1.268 48.442 1.00 41.65 H new ATOM 0 HA GLN B 634 -22.491 1.031 50.709 1.00 43.88 H new ATOM 3248 N ASN B 635 -24.143 0.669 48.054 1.00 46.98 N ATOM 3249 CA ASN B 635 -25.410 0.162 47.521 1.00 49.17 C ATOM 3250 C ASN B 635 -25.753 -1.278 47.938 1.00 49.33 C ATOM 3251 O ASN B 635 -26.893 -1.703 47.774 1.00 49.83 O ATOM 3252 CB ASN B 635 -25.464 0.296 45.994 1.00 49.78 C ATOM 3253 CG ASN B 635 -25.660 1.733 45.537 1.00 54.25 C ATOM 3254 OD1 ASN B 635 -25.170 2.677 46.170 1.00 58.38 O ATOM 3255 ND2 ASN B 635 -26.376 1.907 44.426 1.00 56.17 N ATOM 0 H ASN B 635 -23.513 0.730 47.472 1.00 46.98 H new ATOM 0 HA ASN B 635 -26.089 0.725 47.925 1.00 49.17 H new ATOM 0 HB2 ASN B 635 -24.642 -0.051 45.613 1.00 49.78 H new ATOM 0 HB3 ASN B 635 -26.188 -0.250 45.651 1.00 49.78 H new ATOM 0 HD21 ASN B 635 -26.513 2.700 44.122 1.00 56.17 H new ATOM 0 HD22 ASN B 635 -26.701 1.226 44.013 1.00 56.17 H new ATOM 3256 N LEU B 636 -24.782 -2.024 48.466 1.00 49.70 N ATOM 3257 CA LEU B 636 -25.060 -3.375 48.969 1.00 50.47 C ATOM 3258 C LEU B 636 -25.499 -3.332 50.427 1.00 51.40 C ATOM 3259 O LEU B 636 -26.558 -2.787 50.745 1.00 52.49 O ATOM 3260 CB LEU B 636 -23.855 -4.309 48.810 1.00 50.36 C ATOM 3261 CG LEU B 636 -23.181 -4.444 47.439 1.00 49.68 C ATOM 3262 CD1 LEU B 636 -22.085 -5.489 47.496 1.00 49.10 C ATOM 3263 CD2 LEU B 636 -24.180 -4.754 46.323 1.00 49.87 C ATOM 0 H LEU B 636 -23.963 -1.772 48.543 1.00 49.70 H new ATOM 0 HA LEU B 636 -25.784 -3.732 48.431 1.00 50.47 H new ATOM 0 HB2 LEU B 636 -23.177 -4.019 49.440 1.00 50.36 H new ATOM 0 HB3 LEU B 636 -24.136 -5.196 49.084 1.00 50.36 H new ATOM 0 HG LEU B 636 -22.786 -3.585 47.223 1.00 49.68 H new ATOM 0 HD11 LEU B 636 -21.666 -5.566 46.625 1.00 49.10 H new ATOM 0 HD12 LEU B 636 -21.421 -5.226 48.152 1.00 49.10 H new ATOM 0 HD13 LEU B 636 -22.466 -6.345 47.748 1.00 49.10 H new ATOM 0 HD21 LEU B 636 -23.709 -4.830 45.479 1.00 49.87 H new ATOM 0 HD22 LEU B 636 -24.633 -5.590 46.517 1.00 49.87 H new ATOM 0 HD23 LEU B 636 -24.833 -4.039 46.265 1.00 49.87 H new TER 3264 LEU B 636 HETATM 3265 MG MG A 3 6.107 9.788 68.325 1.00 15.47 MG HETATM 3266 PG ATP A 1 4.644 11.482 66.028 1.00 16.44 P HETATM 3267 O1G ATP A 1 3.188 11.541 66.423 1.00 16.93 O HETATM 3268 O2G ATP A 1 5.392 10.262 66.558 1.00 17.01 O HETATM 3269 O3G ATP A 1 4.901 11.770 64.571 1.00 20.30 O HETATM 3270 PB ATP A 1 5.827 13.010 68.293 1.00 16.46 P HETATM 3271 O1B ATP A 1 4.845 14.011 68.862 1.00 16.00 O HETATM 3272 O2B ATP A 1 6.084 11.716 68.980 1.00 16.92 O HETATM 3273 O3B ATP A 1 5.375 12.756 66.733 1.00 16.31 O HETATM 3274 PA ATP A 1 8.649 13.591 68.640 1.00 17.80 P HETATM 3275 O1A ATP A 1 9.164 12.274 68.180 1.00 18.77 O HETATM 3276 O2A ATP A 1 8.641 13.973 70.088 1.00 15.84 O HETATM 3277 O3A ATP A 1 7.173 13.844 68.050 1.00 15.84 O HETATM 3278 O5' ATP A 1 9.368 14.737 67.819 1.00 18.69 O HETATM 3279 C5' ATP A 1 9.266 16.118 68.230 1.00 20.94 C HETATM 3280 C4' ATP A 1 10.319 16.886 67.434 1.00 24.33 C HETATM 3281 O4' ATP A 1 11.609 16.615 67.979 1.00 23.25 O HETATM 3282 C3' ATP A 1 10.364 16.415 65.977 1.00 26.32 C HETATM 3283 O3' ATP A 1 10.576 17.515 65.107 1.00 28.57 O HETATM 3284 C2' ATP A 1 11.576 15.525 65.871 1.00 28.14 C HETATM 3285 O2' ATP A 1 12.238 15.670 64.618 1.00 31.89 O HETATM 3286 C1' ATP A 1 12.456 15.972 67.018 1.00 29.83 C HETATM 3287 N9 ATP A 1 13.111 14.800 67.643 1.00 29.94 N HETATM 3288 C8 ATP A 1 12.522 13.701 68.142 1.00 29.74 C HETATM 3289 N7 ATP A 1 13.449 12.848 68.639 1.00 30.87 N HETATM 3290 C5 ATP A 1 14.660 13.409 68.459 1.00 31.39 C HETATM 3291 C6 ATP A 1 16.071 13.057 68.756 1.00 33.28 C HETATM 3292 N6 ATP A 1 16.394 11.886 69.364 1.00 31.95 N HETATM 3293 N1 ATP A 1 17.021 13.947 68.386 1.00 32.29 N HETATM 3294 C2 ATP A 1 16.742 15.119 67.775 1.00 32.09 C HETATM 3295 N3 ATP A 1 15.484 15.496 67.484 1.00 32.23 N HETATM 3296 C4 ATP A 1 14.431 14.694 67.793 1.00 30.79 C HETATM 0 HO3' ATP A 1 11.309 17.420 64.708 1.00 28.57 H new HETATM 0 HO2' ATP A 1 11.945 15.097 64.078 1.00 31.89 H new HETATM 0 HN62 ATP A 1 17.217 11.699 69.528 1.00 31.95 H new HETATM 0 HN61 ATP A 1 15.775 11.331 69.585 1.00 31.95 H new HETATM 0 H5'2 ATP A 1 8.378 16.466 68.053 1.00 20.94 H new HETATM 0 H5'1 ATP A 1 9.421 16.207 69.183 1.00 20.94 H new HETATM 0 H8 ATP A 1 11.565 13.541 68.146 1.00 29.74 H new HETATM 0 H4' ATP A 1 10.089 17.827 67.479 1.00 24.33 H new HETATM 0 H3' ATP A 1 9.535 15.973 65.737 1.00 26.32 H new HETATM 0 H2' ATP A 1 11.345 14.584 65.920 1.00 28.14 H new HETATM 0 H2 ATP A 1 17.474 15.709 67.538 1.00 32.09 H new HETATM 0 H1' ATP A 1 13.146 16.575 66.702 1.00 29.83 H new HETATM 3297 MG MG B 4 0.653 -5.276 55.824 1.00 18.19 MG HETATM 3298 PG ATP B 2 -1.466 -5.819 58.210 1.00 17.84 P HETATM 3299 O1G ATP B 2 -2.657 -4.984 57.891 1.00 17.76 O HETATM 3300 O2G ATP B 2 -0.111 -5.326 57.741 1.00 19.61 O HETATM 3301 O3G ATP B 2 -1.405 -6.154 59.696 1.00 20.39 O HETATM 3302 PB ATP B 2 -1.649 -7.661 55.930 1.00 18.99 P HETATM 3303 O1B ATP B 2 -3.022 -7.707 55.366 1.00 18.07 O HETATM 3304 O2B ATP B 2 -0.551 -6.844 55.327 1.00 17.64 O HETATM 3305 O3B ATP B 2 -1.768 -7.270 57.520 1.00 17.13 O HETATM 3306 PA ATP B 2 0.141 -9.771 55.394 1.00 18.95 P HETATM 3307 O1A ATP B 2 1.393 -9.074 55.847 1.00 20.02 O HETATM 3308 O2A ATP B 2 -0.090 -9.999 53.929 1.00 21.18 O HETATM 3309 O3A ATP B 2 -1.191 -9.179 56.050 1.00 21.10 O HETATM 3310 O5' ATP B 2 0.112 -11.217 56.089 1.00 21.87 O HETATM 3311 C5' ATP B 2 -0.759 -12.270 55.697 1.00 20.37 C HETATM 3312 C4' ATP B 2 -0.161 -13.549 56.288 1.00 27.86 C HETATM 3313 O4' ATP B 2 1.057 -13.855 55.603 1.00 28.56 O HETATM 3314 C3' ATP B 2 0.237 -13.411 57.752 1.00 28.97 C HETATM 3315 O3' ATP B 2 -0.063 -14.647 58.402 1.00 35.15 O HETATM 3316 C2' ATP B 2 1.739 -13.203 57.753 1.00 29.64 C HETATM 3317 O2' ATP B 2 2.342 -13.748 58.929 1.00 30.87 O HETATM 3318 C1' ATP B 2 2.151 -13.967 56.514 1.00 28.56 C HETATM 3319 N9 ATP B 2 3.324 -13.438 55.805 1.00 26.98 N HETATM 3320 C8 ATP B 2 3.501 -12.178 55.345 1.00 26.60 C HETATM 3321 N7 ATP B 2 4.683 -12.062 54.711 1.00 28.91 N HETATM 3322 C5 ATP B 2 5.261 -13.293 54.742 1.00 27.87 C HETATM 3323 C6 ATP B 2 6.518 -13.894 54.258 1.00 29.27 C HETATM 3324 N6 ATP B 2 7.425 -13.144 53.594 1.00 28.65 N HETATM 3325 N1 ATP B 2 6.728 -15.217 54.507 1.00 30.04 N HETATM 3326 C2 ATP B 2 5.847 -15.988 55.184 1.00 29.03 C HETATM 3327 N3 ATP B 2 4.676 -15.521 55.645 1.00 29.04 N HETATM 3328 C4 ATP B 2 4.355 -14.200 55.455 1.00 28.53 C HETATM 0 HO3' ATP B 2 0.524 -14.809 58.981 1.00 35.15 H new HETATM 0 HO2' ATP B 2 2.214 -13.228 59.576 1.00 30.87 H new HETATM 0 HN62 ATP B 2 8.156 -13.501 53.314 1.00 28.65 H new HETATM 0 HN61 ATP B 2 7.271 -12.310 53.451 1.00 28.65 H new HETATM 0 H5'2 ATP B 2 -1.658 -12.120 56.030 1.00 20.37 H new HETATM 0 H5'1 ATP B 2 -0.821 -12.329 54.731 1.00 20.37 H new HETATM 0 H8 ATP B 2 2.863 -11.456 55.457 1.00 26.60 H new HETATM 0 H4' ATP B 2 -0.848 -14.227 56.197 1.00 27.86 H new HETATM 0 H3' ATP B 2 -0.224 -12.685 58.200 1.00 28.97 H new HETATM 0 H2' ATP B 2 2.009 -12.271 57.750 1.00 29.64 H new HETATM 0 H2 ATP B 2 6.071 -16.918 55.343 1.00 29.03 H new HETATM 0 H1' ATP B 2 2.379 -14.865 56.801 1.00 28.56 H new HETATM 3329 O HOH A 647 4.457 9.286 69.385 0.99 16.46 O HETATM 3330 O HOH A 648 8.031 10.010 67.541 0.99 14.48 O HETATM 3331 O HOH A 649 2.206 9.210 67.664 1.00 18.38 O HETATM 3332 O HOH A 650 8.589 5.682 69.801 1.00 19.02 O HETATM 3333 O HOH A 651 8.389 -3.823 72.777 1.00 23.65 O HETATM 3334 O HOH A 652 11.379 -1.495 77.800 1.00 23.24 O HETATM 3335 O HOH A 653 15.137 13.323 81.817 1.00 24.72 O HETATM 3336 O HOH A 654 9.109 -8.687 78.157 1.00 22.77 O HETATM 3337 O HOH A 655 -3.587 12.339 69.221 1.00 39.53 O HETATM 3338 O HOH A 656 17.372 20.322 77.281 1.00 26.25 O HETATM 3339 O HOH A 657 -5.411 11.983 65.041 1.00 23.89 O HETATM 3340 O HOH A 658 13.589 1.080 83.956 1.00 25.25 O HETATM 3341 O HOH A 659 6.387 4.308 88.462 1.00 30.79 O HETATM 3342 O HOH A 660 -1.808 3.884 68.777 1.00 25.26 O HETATM 3343 O HOH A 661 7.969 19.454 69.836 1.00 23.30 O HETATM 3344 O HOH A 662 9.640 -9.492 83.522 1.00 39.43 O HETATM 3345 O HOH A 663 -1.457 18.929 68.673 1.00 26.36 O HETATM 3346 O HOH A 664 -6.157 -13.836 71.662 1.00 41.52 O HETATM 3347 O HOH A 665 -10.342 1.627 67.250 1.00 29.84 O HETATM 3348 O HOH A 666 9.543 7.646 67.589 1.00 23.57 O HETATM 3349 O HOH A 667 -4.288 8.765 98.409 1.00 35.78 O HETATM 3350 O HOH A 668 13.775 5.137 88.221 1.00 26.97 O HETATM 3351 O HOH A 669 9.463 -3.525 75.232 1.00 22.33 O HETATM 3352 O HOH A 670 14.687 16.471 87.052 1.00 33.67 O HETATM 3353 O HOH A 671 7.853 7.326 91.294 1.00 25.72 O HETATM 3354 O HOH A 672 -8.772 -8.373 72.770 1.00 37.89 O HETATM 3355 O HOH A 673 3.033 23.927 78.170 1.00 34.28 O HETATM 3356 O HOH A 674 2.229 19.873 67.166 1.00 30.61 O HETATM 3357 O HOH A 675 10.661 -13.006 60.246 1.00 37.47 O HETATM 3358 O HOH A 676 -4.448 0.831 90.684 1.00 46.32 O HETATM 3359 O HOH A 677 19.567 15.723 76.813 1.00 43.98 O HETATM 3360 O HOH A 678 -6.069 1.890 87.796 1.00 36.49 O HETATM 3361 O HOH A 679 -5.287 25.590 75.123 1.00 34.43 O HETATM 3362 O HOH A 680 4.707 -5.748 56.372 1.00 40.01 O HETATM 3363 O HOH A 681 12.421 -9.228 74.672 1.00 41.22 O HETATM 3364 O HOH A 682 11.904 5.616 95.145 1.00 48.07 O HETATM 3365 O HOH A 683 -1.147 -20.546 81.691 1.00 39.51 O HETATM 3366 O HOH A 684 9.361 -1.538 71.643 1.00 29.08 O HETATM 3367 O HOH A 685 -0.988 11.700 66.455 1.00 31.47 O HETATM 3368 O HOH A 686 12.567 10.561 69.431 1.00 52.03 O HETATM 3369 O HOH A 687 -5.874 -11.974 79.349 1.00 37.84 O HETATM 3370 O HOH A 688 14.839 21.054 70.231 1.00 40.49 O HETATM 3371 O HOH A 689 3.122 19.432 88.358 1.00 35.39 O HETATM 3372 O HOH A 690 -7.120 -9.308 64.321 1.00 41.55 O HETATM 3373 O HOH A 691 -6.947 1.557 63.986 1.00 44.44 O HETATM 3374 O HOH A 692 5.263 -23.468 79.156 1.00 43.76 O HETATM 3375 O HOH A 693 13.625 -11.249 83.388 1.00 53.12 O HETATM 3376 O HOH A 694 -12.634 7.376 69.269 1.00 39.11 O HETATM 3377 O HOH A 695 15.881 18.645 86.704 1.00 40.95 O HETATM 3378 O HOH A 696 4.332 1.330 69.461 1.00 34.12 O HETATM 3379 O HOH A 697 0.707 20.350 81.115 1.00 44.85 O HETATM 3380 O HOH A 698 10.051 25.556 81.684 1.00 41.38 O HETATM 3381 O HOH A 699 3.088 -28.463 63.294 1.00 47.23 O HETATM 3382 O HOH A 700 -0.543 -0.337 91.548 1.00 49.94 O HETATM 3383 O HOH A 701 -10.724 11.400 82.193 1.00 45.45 O HETATM 3384 O HOH A 702 5.380 30.313 79.261 1.00 41.86 O HETATM 3385 O HOH A 703 9.693 9.183 93.174 1.00 42.02 O HETATM 3386 O HOH A 704 10.274 -5.227 63.395 1.00 44.28 O HETATM 3387 O HOH A 705 12.529 -2.052 69.321 1.00 42.12 O HETATM 3388 O HOH A 706 1.270 -5.151 82.582 1.00 43.86 O HETATM 3389 O HOH A 707 -7.028 3.314 85.605 1.00 39.24 O HETATM 3390 O HOH A 708 11.395 -0.692 72.942 1.00 42.72 O HETATM 3391 O HOH A 709 2.994 -19.366 85.584 1.00 32.83 O HETATM 3392 O HOH A 710 -3.329 -19.370 82.866 1.00 57.35 O HETATM 3393 O HOH A 711 5.875 -1.533 66.350 1.00 37.96 O HETATM 3394 O HOH A 712 14.859 16.366 90.029 1.00 46.66 O HETATM 3395 O HOH A 713 2.539 -19.870 72.636 1.00 50.05 O HETATM 3396 O HOH A 714 -3.190 -4.720 86.474 1.00 37.96 O HETATM 3397 O HOH A 715 17.297 -7.563 64.952 1.00 74.59 O HETATM 3398 O HOH B 647 2.039 -6.797 56.488 0.99 14.03 O HETATM 3399 O HOH B 648 -0.587 -3.692 55.202 0.99 15.31 O HETATM 3400 O HOH B 649 -2.224 -2.561 56.931 1.00 17.78 O HETATM 3401 O HOH B 650 10.133 -2.244 39.212 1.00 22.47 O HETATM 3402 O HOH B 651 10.017 4.466 50.632 1.00 16.29 O HETATM 3403 O HOH B 652 6.894 -17.783 46.180 1.00 30.55 O HETATM 3404 O HOH B 653 -8.761 -11.067 57.493 1.00 30.49 O HETATM 3405 O HOH B 654 1.146 11.581 64.625 1.00 21.93 O HETATM 3406 O HOH B 655 -3.957 -3.753 60.096 1.00 25.34 O HETATM 3407 O HOH B 656 -6.038 -1.364 54.647 1.00 32.36 O HETATM 3408 O HOH B 657 12.983 8.292 45.417 1.00 23.15 O HETATM 3409 O HOH B 658 2.351 -19.675 45.961 1.00 24.19 O HETATM 3410 O HOH B 659 9.606 2.171 52.862 1.00 35.28 O HETATM 3411 O HOH B 660 2.536 6.301 59.570 1.00 33.33 O HETATM 3412 O HOH B 661 0.028 12.730 38.589 1.00 28.53 O HETATM 3413 O HOH B 662 10.521 1.170 45.462 1.00 30.79 O HETATM 3414 O HOH B 663 -11.416 -14.810 46.760 1.00 30.30 O HETATM 3415 O HOH B 664 -4.155 -0.635 56.396 1.00 33.19 O HETATM 3416 O HOH B 665 -11.063 -10.153 43.768 1.00 37.29 O HETATM 3417 O HOH B 666 13.194 9.626 39.429 1.00 40.99 O HETATM 3418 O HOH B 667 10.468 3.732 47.432 1.00 30.65 O HETATM 3419 O HOH B 668 -7.810 11.148 55.278 1.00 32.27 O HETATM 3420 O HOH B 669 2.028 0.233 35.825 1.00 40.06 O HETATM 3421 O HOH B 670 4.320 2.778 54.638 1.00 33.32 O HETATM 3422 O HOH B 671 8.693 -4.438 53.099 1.00 35.23 O HETATM 3423 O HOH B 672 18.413 9.464 62.909 1.00 40.58 O HETATM 3424 O HOH B 673 -5.965 -2.816 58.386 1.00 32.51 O HETATM 3425 O HOH B 674 -6.617 1.954 57.255 1.00 35.63 O HETATM 3426 O HOH B 675 1.884 5.496 37.052 1.00 31.23 O HETATM 3427 O HOH B 676 -6.304 9.186 37.827 1.00 28.97 O HETATM 3428 O HOH B 677 15.306 15.324 63.984 1.00 38.34 O HETATM 3429 O HOH B 678 -2.207 4.079 56.595 1.00 33.78 O HETATM 3430 O HOH B 679 -0.650 18.806 45.645 1.00 37.36 O HETATM 3431 O HOH B 680 4.281 21.549 56.204 1.00 37.59 O HETATM 3432 O HOH B 681 -12.763 8.068 57.188 1.00 41.19 O HETATM 3433 O HOH B 682 10.389 6.899 65.107 1.00 36.58 O HETATM 3434 O HOH B 683 2.030 -14.735 36.632 1.00 39.68 O HETATM 3435 O HOH B 684 14.832 1.932 58.711 1.00 44.98 O HETATM 3436 O HOH B 685 -7.652 8.638 40.045 1.00 35.53 O HETATM 3437 O HOH B 686 -4.109 -14.187 54.194 1.00 33.24 O HETATM 3438 O HOH B 687 -5.797 -5.121 27.850 1.00 51.70 O HETATM 3439 O HOH B 688 12.298 9.745 34.999 1.00 35.26 O HETATM 3440 O HOH B 689 4.396 -12.879 41.710 1.00 29.64 O HETATM 3441 O HOH B 690 10.181 0.791 50.591 1.00 37.24 O HETATM 3442 O HOH B 691 -9.270 -10.079 36.244 1.00 37.90 O HETATM 3443 O HOH B 692 -10.874 -8.161 56.388 1.00 35.57 O HETATM 3444 O HOH B 693 -23.966 -1.634 43.847 1.00 50.53 O HETATM 3445 O HOH B 694 -5.662 10.091 35.441 1.00 46.94 O HETATM 3446 O HOH B 695 6.481 -5.203 37.327 1.00 48.41 O HETATM 3447 O HOH B 696 9.702 -13.968 52.193 1.00 37.63 O HETATM 3448 O HOH B 697 4.823 -3.323 53.739 1.00 36.18 O HETATM 3449 O HOH B 698 -1.100 2.551 29.898 1.00 57.67 O HETATM 3450 O HOH B 699 4.171 10.756 41.668 1.00 40.80 O HETATM 3451 O HOH B 700 4.206 21.106 53.614 1.00 44.79 O HETATM 3452 O HOH B 701 3.745 0.260 32.243 1.00 40.89 O HETATM 3453 O HOH B 702 -4.469 8.048 61.756 1.00 51.92 O HETATM 3454 O HOH B 703 6.344 14.932 63.105 1.00 66.93 O HETATM 3455 O HOH B 704 -19.179 -5.466 43.328 1.00 59.57 O HETATM 3456 O HOH B 705 1.177 -25.754 47.861 1.00 49.48 O HETATM 3457 O HOH B 706 -27.148 -2.177 53.392 1.00 46.82 O HETATM 3458 O HOH B 707 22.541 26.135 58.782 1.00 45.20 O CONECT 126 128 CONECT 128 126 CONECT 1777 1779 CONECT 1779 1777 CONECT 3266 3267 3268 3269 3273 CONECT 3267 3266 CONECT 3268 3266 CONECT 3269 3266 CONECT 3270 3271 3272 3273 3277 CONECT 3271 3270 CONECT 3272 3270 CONECT 3273 3266 3270 CONECT 3274 3275 3276 3277 3278 CONECT 3275 3274 CONECT 3276 3274 CONECT 3277 3270 3274 CONECT 3278 3274 3279 CONECT 3279 3278 3280 CONECT 3280 3279 3281 3282 CONECT 3281 3280 3286 CONECT 3282 3280 3283 3284 CONECT 3283 3282 CONECT 3284 3282 3285 3286 CONECT 3285 3284 CONECT 3286 3281 3284 3287 CONECT 3287 3286 3288 3296 CONECT 3288 3287 3289 CONECT 3289 3288 3290 CONECT 3290 3289 3291 3296 CONECT 3291 3290 3292 3293 CONECT 3292 3291 CONECT 3293 3291 3294 CONECT 3294 3293 3295 CONECT 3295 3294 3296 CONECT 3296 3287 3290 3295 CONECT 3298 3299 3300 3301 3305 CONECT 3299 3298 CONECT 3300 3298 CONECT 3301 3298 CONECT 3302 3303 3304 3305 3309 CONECT 3303 3302 CONECT 3304 3302 CONECT 3305 3298 3302 CONECT 3306 3307 3308 3309 3310 CONECT 3307 3306 CONECT 3308 3306 CONECT 3309 3302 3306 CONECT 3310 3306 3311 CONECT 3311 3310 3312 CONECT 3312 3311 3313 3314 CONECT 3313 3312 3318 CONECT 3314 3312 3315 3316 CONECT 3315 3314 CONECT 3316 3314 3317 3318 CONECT 3317 3316 CONECT 3318 3313 3316 3319 CONECT 3319 3318 3320 3328 CONECT 3320 3319 3321 CONECT 3321 3320 3322 CONECT 3322 3321 3323 3328 CONECT 3323 3322 3324 3325 CONECT 3324 3323 CONECT 3325 3323 3326 CONECT 3326 3325 3327 CONECT 3327 3326 3328 CONECT 3328 3319 3322 3327 END