USER MOD reduce.3.24.130724 H: found=0, std=0, add=1205, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1211 hydrogens (0 hets) HEADER SIGNALING PROTEIN/GROWTH FACTOR RECEPTOR13-OCT-04 1XR0 TITLE STRUCTURAL BASIS OF SNT PTB DOMAIN INTERACTIONS WITH TITLE 2 DISTINCT NEUROTROPHIC RECEPTORS COMPND MOL_ID: 1; COMPND 2 MOLECULE: BASIC FIBROBLAST GROWTH FACTOR RECEPTOR 1; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: SEQUENCE DATABASE RESIDUES 409-430 FROM THE COMPND 5 JUXTAMEMBRANE REGION OF HFGFR1; COMPND 6 SYNONYM: FGFR-1, BFGF-R, FMS-LIKE TYROSINE KINASE-2, C-FGR; COMPND 7 ENGINEERED: YES; COMPND 8 MOL_ID: 2; COMPND 9 MOLECULE: FGFR SIGNALLING ADAPTOR SNT-1; COMPND 0 CHAIN: B; COMPND 1 FRAGMENT: PTB DOMAIN AT THE N TERMINUS; COMPND 2 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE SOURCE 4 SEQUENCE IS TAKEN FROM HOMO SAPIENS (HUMAN).; SOURCE 5 MOL_ID: 2; SOURCE 6 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 7 ORGANISM_COMMON: HUMAN; SOURCE 8 ORGANISM_TAXID: 9606; SOURCE 9 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 0 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS FGFR, SNT, PHOSPHOTYROSINE BINDING DOMAIN, PTB, TRK, NPXPY KEYWDS 2 MOTIF,, SIGNALING PROTEIN/GROWTH FACTOR RECEPTOR COMPLEX EXPDTA SOLUTION NMR AUTHOR C.DHALLUIN,K.S.YAN,O.PLOTNIKOVA,K.W.LEE,L.ZENG,M.KUTI, AUTHOR 2 S.MUJTABA,M.P.GOLDFARB,M.-M.ZHOU REVDAT 2 24-FEB-09 1XR0 1 VERSN REVDAT 1 02-NOV-04 1XR0 0 JRNL AUTH C.DHALLUIN,K.S.YAN,O.PLOTNIKOVA,K.W.LEE,L.ZENG, JRNL AUTH 2 M.KUTI,S.MUJTABA,M.P.GOLDFARB,M.-M.ZHOU JRNL TITL STRUCTURAL BASIS OF SNT PTB DOMAIN INTERACTIONS JRNL TITL 2 WITH DISTINCT NEUROTROPHIC RECEPTORS JRNL REF MOL.CELL V. 6 921 2000 JRNL REFN ISSN 1097-2765 JRNL PMID 11090629 JRNL DOI 10.1016/S1097-2765(05)00087-0 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : ARIA 1.1 REMARK 3 AUTHORS : M. NILGES AND S. O'DONOGHUE REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1XR0 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 15-OCT-04. REMARK 100 THE RCSB ID CODE IS RCSB030666. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 303 REMARK 210 PH : 6.5 REMARK 210 IONIC STRENGTH : 15 MM DTT-D10, AND 0.5 MM REMARK 210 EDTA00 MM PHOSPHATE BUFFER, REMARK 210 PRESSURE : 1ATM REMARK 210 SAMPLE CONTENTS : SNT-1 PTB DOMAIN/HFGFR1 REMARK 210 PEPTIDE COMPLEX (1:1) OF ~0.5 REMARK 210 MM IN 100 MM PHOSPHATE BUFFER REMARK 210 OF PH 6.5, 5 MM DTT-D10, AND REMARK 210 0.5 MM EDTA IN H2O/2H2O (9/1) REMARK 210 OR 2H2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : HNHA, 3D_13C-SEPARATED_NOESY, REMARK 210 3D_15N-SEPARATED_NOESY, 2D REMARK 210 NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ REMARK 210 SPECTROMETER MODEL : DRX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR 3.851 REMARK 210 METHOD USED : STRUCTURES OF THE SNT-1 PTB REMARK 210 DOMAIN IN COMPLEX WITH THE REMARK 210 HFGFR1 PEPTIDE WERE CALCULATED REMARK 210 WITH A DISTANCE GEOMETRY AND REMARK 210 SIMULATED ANNEALING PROTOCOL REMARK 210 BY USING THE X-PLOR PROGRAM REMARK 210 ([4]). NOE DISTANCE AND REMARK 210 DIHEDRAL ANGLE RESTRAINTS WERE REMARK 210 TREATED WITH A SQUARE-WELL REMARK 210 POTENTIAL OF 50 KCAL MOL?1 ?2. REMARK 210 A TOTAL OF 2448 MANUALLY REMARK 210 ASSIGNED NOE-DERIVED DISTANCE REMARK 210 RESTRAINTS WERE OBTAINED FROM REMARK 210 THE 15N- OR 13C-EDITED NOESY REMARK 210 DATA. INCLUDED IN THIS FIGURE REMARK 210 ARE 251 INTRAPEPTIDE AND 258 REMARK 210 INTERMOLECULAR DISTANCE REMARK 210 RESTRAINTS. ADDITIONALLY, 255 REMARK 210 UNAMBIGUOUS AND 52 AMBIGUOUS REMARK 210 DISTANCE RESTRAINTS WERE REMARK 210 IDENTIFIED FROM THE NOE DATA REMARK 210 BY USING ARIA. THE FINAL REMARK 210 STRUCTURE CALCULATIONS REMARK 210 EMPLOYED A TOTAL OF 2755 NOE REMARK 210 RESTRAINTS OBTAINED FROM THE REMARK 210 MANUAL AND THE ARIA-ASSISTED REMARK 210 ASSIGNMENTS, 2703 OF WHICH REMARK 210 WERE UNAMBIGUOUSLY ASSIGNED REMARK 210 NOE-DERIVED DISTANCE REMARK 210 RESTRAINTS THAT COMPRISE 1072 REMARK 210 INTRARESIDUE, 466 SEQUENTIAL, REMARK 210 216 MEDIUM-RANGE, AND 949 LONG REMARK 210 -RANGE NOES. IN ADDITION, 70 REMARK 210 HYDROGEN-BOND DISTANCE REMARK 210 RESTRAINTS FOR 35 HYDROGEN REMARK 210 BONDS AND 19 -ANGLE RESTRAINTS REMARK 210 WERE ALSO USED IN THE REMARK 210 STRUCTURE CALCULATIONS. FOR REMARK 210 THE ENSEMBLE OF THE FINAL 20 REMARK 210 STRUCTURES, NO DISTANCE OR REMARK 210 TORSIONAL ANGLE RESTRAINT WAS REMARK 210 VIOLATED BY MORE THAN 0.4 OR REMARK 210 5, RESPECTIVELY. THE DISTANCE- REMARK 210 VIOLATION, DIHEDRAL-VIOLATION, REMARK 210 AND TOTAL ENERGIES WERE 74.4 REMARK 210 1.7 KCAL MOL/1, 0.82 0.08 KCAL REMARK 210 MOL/1, AND 262.0 6.0 KCAL MOL/ REMARK 210 1, RESPECTIVELY. THE LENNARD- REMARK 210 JONES POTENTIAL, WHICH WAS NOT REMARK 210 USED DURING ANY REFINEMENT REMARK 210 STAGE, WAS 659.3 23.1 KCAL REMARK 210 MOL/1 FOR THE FINAL REMARK 210 STRUCTURES. RAMACHANDRAN PLOT REMARK 210 ANALYSIS BY PROCHECK-NMR REMARK 210 SHOWED THAT IN THE FINAL REMARK 210 STRUCTURES OF THE COMPLEX, REMARK 210 98.1% OF THE BACKBONE REMARK 210 GEOMETRIES OF THE NON-GLY AND REMARK 210 NON-PRO RESIDUES IN THE REMARK 210 COMPLEX (PROTEIN RESIDUES 18- REMARK 210 116 AND PEPTIDE RESIDUES (412- REMARK 210 430) AND NEARLY 100% IN THE REMARK 210 SECONDARY STRUCTURE (PROTEIN REMARK 210 RESIDUES 19-24, 35-40, 45-49, REMARK 210 52-57, 63-68, 71-76, 85-90, REMARK 210 94-107, AND 111-115 AND REMARK 210 PEPTIDE RESIDUES 426-430) LIE REMARK 210 WITHIN ENERGETICALLY FAVORABLE REMARK 210 OR ALLOWED REGIONS. REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LEAST REMARK 210 RESTRAINT VIOLATIONS REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NMR SPECTRA WERE ACQUIRED AT 30C ON A BRUKER DRX600 OR REMARK 210 DRX500 SPECTROMETER. THE BACKBONE AND SIDE CHAIN 1H, 13C, AND REMARK 210 15N RESONANCES OF THE PROTEIN WERE ASSIGNED USING DEUTERIUM- REMARK 210 DECOUPLED TRIPLE-RESONANCE EXPERIMENTS OF HNCA, HN(CO)CA, REMARK 210 HNCACB, HN(CO)CACB, AND (H)C(CO)NH-TOCSY ([34 AND 30]) REMARK 210 RECORDED BY USING UNIFORMLY 15N/13C-LABELED AND FRACTIONALLY REMARK 210 DEUTERATED PROTEIN IN COMPLEX WITH A NONISOTOPICALLY LABELED REMARK 210 HFGFR1 PEPTIDE. THE SIDE CHAIN ASSIGNMENTS WERE COMPLETED REMARK 210 USING 3D HCCH-TOCSY ([7]) DATA COLLECTED FROM A UNIFORMLY 15N/ REMARK 210 13C LABELED-PROTEIN/NONLABELED-PEPTIDE COMPLEX. NOE-DERIVED REMARK 210 DISTANCE RESTRAINTS WERE OBTAINED FROM 15N- OR 13C-EDITED 3D REMARK 210 NOESY SPECTRA ([7]). -ANGLE RESTRAINTS WERE DETERMINED FROM REMARK 210 3JHN,H COUPLING CONSTANTS MEASURED IN A 3D HNHA-J SPECTRUM REMARK 210 ([7]). SLOWLY EXCHANGING AMIDE PROTONS WERE IDENTIFIED FROM A REMARK 210 SERIES OF 2D 15N-HSQC SPECTRA RECORDED AFTER THE H2O BUFFER REMARK 210 WAS CHANGED TO 2H2O BUFFER. THE PEPTIDE RESONANCES WERE REMARK 210 ASSIGNED USING 13C/15N-FILTERED 2D NOESY AND TOCSY SPECTRA REMARK 210 ([30]) COLLECTED FROM A 15N/13C LABELED-PROTEIN/NONLABELED- REMARK 210 PEPTIDE COMPLEX. THE INTERMOLECULAR NOES USED IN DEFINING THE REMARK 210 STRUCTURE OF THE SNT-1 PTB DOMAIN/HFGFR1 COMPLEX WERE DETECTED REMARK 210 IN 13C- OR 15N-EDITED (F 1), 13C/15N-FILTERED (F 3) 3D NOESY REMARK 210 SPECTRA. ALL NMR SPECTRA WERE PROCESSED WITH NMRPIPE/NMRDRAW REMARK 210 ([8]) AND ANALYZED USING NMRVIEW. REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. 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 GLN A 411 -86.34 61.86 REMARK 500 MET A 412 -178.00 50.11 REMARK 500 VAL A 414 95.77 -42.03 REMARK 500 HIS A 415 -173.67 -65.40 REMARK 500 PRO A 422 75.09 -64.72 REMARK 500 GLN A 426 73.55 -161.08 REMARK 500 ASP B 11 33.08 -161.25 REMARK 500 ASN B 16 74.34 -64.62 REMARK 500 HIS B 17 54.30 -160.75 REMARK 500 LYS B 22 82.99 -59.15 REMARK 500 GLU B 32 141.03 60.75 REMARK 500 SER B 35 122.05 167.68 REMARK 500 LEU B 40 66.83 -119.24 REMARK 500 THR B 41 -167.57 -54.15 REMARK 500 THR B 43 54.06 -163.83 REMARK 500 GLU B 44 139.61 178.49 REMARK 500 LEU B 45 67.50 -101.64 REMARK 500 LYS B 51 27.05 47.92 REMARK 500 ARG B 52 -52.35 -152.46 REMARK 500 HIS B 58 32.03 -96.59 REMARK 500 TYR B 59 -80.57 70.02 REMARK 500 LEU B 62 -152.33 -59.81 REMARK 500 ARG B 63 -44.63 -151.73 REMARK 500 SER B 69 -84.68 56.85 REMARK 500 ARG B 79 -74.75 -156.49 REMARK 500 CYS B 80 -155.55 178.88 REMARK 500 GLN B 81 -85.89 69.85 REMARK 500 PHE B 98 -70.83 -49.11 REMARK 500 VAL B 112 54.28 -143.95 REMARK 500 VAL B 113 99.72 -44.22 REMARK 500 VAL B 117 34.88 -146.65 REMARK 500 VAL B 118 96.12 41.10 REMARK 500 ASN B 121 -80.70 61.70 REMARK 500 ASN B 122 119.78 179.43 REMARK 500 GLU B 128 -49.25 -166.21 REMARK 500 THR B 135 79.25 66.04 REMARK 500 REMARK 500 REMARK: NULL DBREF 1XR0 A 409 430 UNP P11362 FGFR1_HUMAN 409 430 DBREF 1XR0 B 11 136 UNP Q8WU20 FRS2_HUMAN 11 136 SEQADV 1XR0 MET B 8 UNP Q8WU20 CLONING ARTIFACT SEQADV 1XR0 GLY B 9 UNP Q8WU20 CLONING ARTIFACT SEQADV 1XR0 SER B 10 UNP Q8WU20 CLONING ARTIFACT SEQRES 1 A 22 HIS SER GLN MET ALA VAL HIS LYS LEU ALA LYS SER ILE SEQRES 2 A 22 PRO LEU ARG ARG GLN VAL THR VAL SER SEQRES 1 B 129 MET GLY SER ASP THR VAL PRO ASP ASN HIS ARG ASN LYS SEQRES 2 B 129 PHE LYS VAL ILE ASN VAL ASP ASP ASP GLY ASN GLU LEU SEQRES 3 B 129 GLY SER GLY ILE MET GLU LEU THR ASP THR GLU LEU ILE SEQRES 4 B 129 LEU TYR THR ARG LYS ARG ASP SER VAL LYS TRP HIS TYR SEQRES 5 B 129 LEU CYS LEU ARG ARG TYR GLY TYR ASP SER ASN LEU PHE SEQRES 6 B 129 SER PHE GLU SER GLY ARG ARG CYS GLN THR GLY GLN GLY SEQRES 7 B 129 ILE PHE ALA PHE LYS CYS ALA ARG ALA GLU GLU LEU PHE SEQRES 8 B 129 ASN MET LEU GLN GLU ILE MET GLN ASN ASN SER ILE ASN SEQRES 9 B 129 VAL VAL GLU GLU PRO VAL VAL GLU ARG ASN ASN HIS GLN SEQRES 10 B 129 THR GLU LEU GLU VAL PRO ARG THR PRO ARG THR PRO HELIX 1 1 ARG B 93 ASN B 108 1 16 SHEET 1 A 2 VAL A 427 THR A 428 0 SHEET 2 A 2 VAL B 113 GLU B 114 -1 O VAL B 113 N THR A 428 SHEET 1 B 7 ASP B 53 TRP B 57 0 SHEET 2 B 7 LEU B 45 THR B 49 -1 N LEU B 47 O VAL B 55 SHEET 3 B 7 GLY B 36 LEU B 40 -1 N ILE B 37 O TYR B 48 SHEET 4 B 7 LYS B 20 VAL B 26 -1 N VAL B 23 O GLY B 36 SHEET 5 B 7 GLY B 85 LYS B 90 -1 O ALA B 88 N VAL B 26 SHEET 6 B 7 LEU B 71 SER B 76 -1 N PHE B 74 O PHE B 87 SHEET 7 B 7 LEU B 62 TYR B 67 -1 N GLY B 66 O SER B 73 CISPEP 1 VAL B 129 PRO B 130 0 0.34 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 412 MET CE :methyl 138:sc= -0.336 (180deg=-0.636) USER MOD Set 1.2: B 81 GLN : amide:sc= 0 X(o=-0.34,f=-0.47) USER MOD Single : A 409 HIS : no HD1:sc= -0.0118 X(o=-0.012,f=0) USER MOD Single : A 410 SER OG : rot 85:sc= 0.608 USER MOD Single : A 411 GLN : amide:sc= -2.91 K(o=-2.9,f=-8.7!) USER MOD Single : A 415 HIS :FLIP no HD1:sc= -1.06 F(o=-1.6,f=-1.1) USER MOD Single : A 416 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 419 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 420 SER OG : rot 180:sc= 0.115 USER MOD Single : A 426 GLN : amide:sc= -0.354 K(o=-0.35,f=-2.3!) USER MOD Single : A 428 THR OG1 : rot 11:sc= -1.39! USER MOD Single : A 430 SER OG : rot -24:sc= 0.463 USER MOD Single : B 8 MET CE :methyl -151:sc= -0.127 (180deg=-0.776) USER MOD Single : B 10 SER OG : rot 180:sc= 0 USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 16 ASN : amide:sc= -0.0367 K(o=-0.037,f=-1.6!) USER MOD Single : B 17 HIS : +bothHN:sc= -0.441 K(o=-0.44,f=-6.5!) USER MOD Single : B 19 ASN : amide:sc= -0.742 X(o=-0.74,f=-1.2) USER MOD Single : B 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 ASN : amide:sc= -3.15 K(o=-3.2,f=-17!) USER MOD Single : B 31 ASN : amide:sc= -0.256 K(o=-0.26,f=-2.5!) USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 38 MET CE :methyl -148:sc= -2.58 (180deg=-5.78!) USER MOD Single : B 41 THR OG1 : rot 133:sc= 0.304 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 48 TYR OH : rot 89:sc= -0.0959! USER MOD Single : B 49 THR OG1 : rot 79:sc= -2.14! USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 SER OG : rot 180:sc= 0 USER MOD Single : B 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 58 HIS : no HD1:sc= -0.177 X(o=-0.18,f=-0.061) USER MOD Single : B 59 TYR OH : rot 172:sc= -4.97! USER MOD Single : B 61 CYS SG : rot -33:sc= 0.063 USER MOD Single : B 65 TYR OH : rot 106:sc= -0.358! USER MOD Single : B 67 TYR OH : rot 180:sc= 0 USER MOD Single : B 69 SER OG : rot 180:sc= -0.0396 USER MOD Single : B 70 ASN : amide:sc= -2.6! C(o=-2.6!,f=-5.1!) USER MOD Single : B 73 SER OG : rot 120:sc= -2.96! USER MOD Single : B 76 SER OG : rot -169:sc= 0.723 USER MOD Single : B 80 CYS SG : rot 180:sc= 0 USER MOD Single : B 82 THR OG1 : rot 180:sc= -0.0291 USER MOD Single : B 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 90 LYS NZ :NH3+ -124:sc= 0.107 (180deg=-0.00293) USER MOD Single : B 91 CYS SG : rot 180:sc= -1.42 USER MOD Single : B 99 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 100 MET CE :methyl 168:sc= -5.48! (180deg=-6.63!) USER MOD Single : B 102 GLN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : B 105 MET CE :methyl -164:sc= -3.42! (180deg=-4.31!) USER MOD Single : B 106 GLN : amide:sc= -0.0821 X(o=-0.082,f=-0.49) USER MOD Single : B 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 108 ASN : amide:sc= 0.0271 X(o=0.027,f=0) USER MOD Single : B 109 SER OG : rot 180:sc= 0 USER MOD Single : B 111 ASN : amide:sc= -0.0107 X(o=-0.011,f=-0.017) USER MOD Single : B 121 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 122 ASN : amide:sc= -0.146 K(o=-0.15,f=-1.6!) USER MOD Single : B 123 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 124 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 125 THR OG1 : rot 180:sc= 0 USER MOD Single : B 132 THR OG1 : rot 180:sc= -0.195 USER MOD Single : B 135 THR OG1 : rot 180:sc=-0.00446 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 409 10.246 -13.975 -11.156 1.00 0.00 N ATOM 2 CA HIS A 409 10.277 -13.652 -9.705 1.00 0.00 C ATOM 3 C HIS A 409 11.455 -12.743 -9.370 1.00 0.00 C ATOM 4 O HIS A 409 11.319 -11.794 -8.598 1.00 0.00 O ATOM 5 CB HIS A 409 10.376 -14.960 -8.917 1.00 0.00 C ATOM 6 CG HIS A 409 9.675 -14.917 -7.594 1.00 0.00 C ATOM 7 ND1 HIS A 409 9.108 -16.029 -7.005 1.00 0.00 N ATOM 8 CD2 HIS A 409 9.448 -13.888 -6.743 1.00 0.00 C ATOM 9 CE1 HIS A 409 8.565 -15.686 -5.851 1.00 0.00 C ATOM 10 NE2 HIS A 409 8.758 -14.393 -5.669 1.00 0.00 N ATOM 0 HA HIS A 409 9.365 -13.120 -9.435 1.00 0.00 H new ATOM 0 HB2 HIS A 409 9.955 -15.768 -9.516 1.00 0.00 H new ATOM 0 HB3 HIS A 409 11.427 -15.198 -8.754 1.00 0.00 H new ATOM 0 HD2 HIS A 409 9.753 -12.861 -6.883 1.00 0.00 H new ATOM 0 HE1 HIS A 409 8.051 -16.350 -5.172 1.00 0.00 H new ATOM 0 HE2 HIS A 409 8.445 -13.856 -4.861 1.00 0.00 H new ATOM 21 N SER A 410 12.609 -13.036 -9.959 1.00 0.00 N ATOM 22 CA SER A 410 13.809 -12.242 -9.726 1.00 0.00 C ATOM 23 C SER A 410 14.098 -12.117 -8.234 1.00 0.00 C ATOM 24 O SER A 410 14.515 -11.061 -7.758 1.00 0.00 O ATOM 25 CB SER A 410 13.652 -10.851 -10.345 1.00 0.00 C ATOM 26 OG SER A 410 12.366 -10.688 -10.917 1.00 0.00 O ATOM 0 H SER A 410 12.739 -13.818 -10.601 1.00 0.00 H new ATOM 0 HA SER A 410 14.649 -12.751 -10.199 1.00 0.00 H new ATOM 0 HB2 SER A 410 13.813 -10.090 -9.581 1.00 0.00 H new ATOM 0 HB3 SER A 410 14.415 -10.702 -11.109 1.00 0.00 H new ATOM 0 HG SER A 410 11.733 -10.404 -10.224 1.00 0.00 H new ATOM 32 N GLN A 411 13.876 -13.202 -7.502 1.00 0.00 N ATOM 33 CA GLN A 411 14.108 -13.213 -6.063 1.00 0.00 C ATOM 34 C GLN A 411 13.208 -12.202 -5.359 1.00 0.00 C ATOM 35 O GLN A 411 12.128 -12.547 -4.879 1.00 0.00 O ATOM 36 CB GLN A 411 15.583 -12.914 -5.759 1.00 0.00 C ATOM 37 CG GLN A 411 15.865 -12.624 -4.290 1.00 0.00 C ATOM 38 CD GLN A 411 15.264 -13.664 -3.364 1.00 0.00 C ATOM 39 OE1 GLN A 411 14.081 -13.990 -3.463 1.00 0.00 O ATOM 40 NE2 GLN A 411 16.079 -14.191 -2.457 1.00 0.00 N ATOM 0 H GLN A 411 13.536 -14.086 -7.881 1.00 0.00 H new ATOM 0 HA GLN A 411 13.865 -14.207 -5.686 1.00 0.00 H new ATOM 0 HB2 GLN A 411 16.188 -13.764 -6.074 1.00 0.00 H new ATOM 0 HB3 GLN A 411 15.900 -12.059 -6.355 1.00 0.00 H new ATOM 0 HG2 GLN A 411 16.943 -12.582 -4.132 1.00 0.00 H new ATOM 0 HG3 GLN A 411 15.467 -11.642 -4.034 1.00 0.00 H new ATOM 0 HE21 GLN A 411 17.053 -13.891 -2.411 1.00 0.00 H new ATOM 0 HE22 GLN A 411 15.731 -14.896 -1.807 1.00 0.00 H new ATOM 49 N MET A 412 13.667 -10.955 -5.282 1.00 0.00 N ATOM 50 CA MET A 412 12.913 -9.904 -4.613 1.00 0.00 C ATOM 51 C MET A 412 12.473 -10.360 -3.226 1.00 0.00 C ATOM 52 O MET A 412 12.794 -11.468 -2.798 1.00 0.00 O ATOM 53 CB MET A 412 11.694 -9.512 -5.448 1.00 0.00 C ATOM 54 CG MET A 412 12.049 -8.898 -6.792 1.00 0.00 C ATOM 55 SD MET A 412 13.018 -7.387 -6.630 1.00 0.00 S ATOM 56 CE MET A 412 13.781 -7.298 -8.248 1.00 0.00 C ATOM 0 H MET A 412 14.557 -10.650 -5.675 1.00 0.00 H new ATOM 0 HA MET A 412 13.560 -9.034 -4.504 1.00 0.00 H new ATOM 0 HB2 MET A 412 11.078 -10.396 -5.613 1.00 0.00 H new ATOM 0 HB3 MET A 412 11.089 -8.803 -4.882 1.00 0.00 H new ATOM 0 HG2 MET A 412 12.610 -9.623 -7.382 1.00 0.00 H new ATOM 0 HG3 MET A 412 11.133 -8.681 -7.341 1.00 0.00 H new ATOM 0 HE1 MET A 412 13.758 -6.268 -8.605 1.00 0.00 H new ATOM 0 HE2 MET A 412 14.815 -7.636 -8.182 1.00 0.00 H new ATOM 0 HE3 MET A 412 13.235 -7.935 -8.943 1.00 0.00 H new ATOM 66 N ALA A 413 11.740 -9.503 -2.529 1.00 0.00 N ATOM 67 CA ALA A 413 11.258 -9.829 -1.194 1.00 0.00 C ATOM 68 C ALA A 413 9.739 -9.896 -1.164 1.00 0.00 C ATOM 69 O ALA A 413 9.157 -10.947 -0.898 1.00 0.00 O ATOM 70 CB ALA A 413 11.760 -8.809 -0.187 1.00 0.00 C ATOM 0 H ALA A 413 11.467 -8.579 -2.864 1.00 0.00 H new ATOM 0 HA ALA A 413 11.647 -10.811 -0.924 1.00 0.00 H new ATOM 0 HB1 ALA A 413 11.391 -9.066 0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 413 12.850 -8.810 -0.181 1.00 0.00 H new ATOM 0 HB3 ALA A 413 11.399 -7.818 -0.462 1.00 0.00 H new ATOM 76 N VAL A 414 9.104 -8.766 -1.453 1.00 0.00 N ATOM 77 CA VAL A 414 7.648 -8.674 -1.462 1.00 0.00 C ATOM 78 C VAL A 414 7.008 -9.899 -2.119 1.00 0.00 C ATOM 79 O VAL A 414 6.870 -9.960 -3.341 1.00 0.00 O ATOM 80 CB VAL A 414 7.184 -7.403 -2.199 1.00 0.00 C ATOM 81 CG1 VAL A 414 7.756 -7.361 -3.603 1.00 0.00 C ATOM 82 CG2 VAL A 414 5.668 -7.324 -2.234 1.00 0.00 C ATOM 0 H VAL A 414 9.579 -7.894 -1.686 1.00 0.00 H new ATOM 0 HA VAL A 414 7.326 -8.629 -0.421 1.00 0.00 H new ATOM 0 HB VAL A 414 7.556 -6.537 -1.652 1.00 0.00 H new ATOM 0 HG11 VAL A 414 7.417 -6.456 -4.107 1.00 0.00 H new ATOM 0 HG12 VAL A 414 8.845 -7.362 -3.552 1.00 0.00 H new ATOM 0 HG13 VAL A 414 7.418 -8.235 -4.160 1.00 0.00 H new ATOM 0 HG21 VAL A 414 5.363 -6.419 -2.759 1.00 0.00 H new ATOM 0 HG22 VAL A 414 5.270 -8.196 -2.753 1.00 0.00 H new ATOM 0 HG23 VAL A 414 5.281 -7.300 -1.215 1.00 0.00 H new ATOM 92 N HIS A 415 6.612 -10.868 -1.297 1.00 0.00 N ATOM 93 CA HIS A 415 5.973 -12.081 -1.797 1.00 0.00 C ATOM 94 C HIS A 415 4.623 -11.754 -2.428 1.00 0.00 C ATOM 95 O HIS A 415 4.256 -10.587 -2.560 1.00 0.00 O ATOM 96 CB HIS A 415 5.786 -13.093 -0.665 1.00 0.00 C ATOM 97 CG HIS A 415 6.037 -14.508 -1.083 1.00 0.00 C ATOM 98 ND1 HIS A 415 5.185 -15.548 -1.250 1.00 0.00 N flip ATOM 99 CD2 HIS A 415 7.293 -14.993 -1.386 1.00 0.00 C flip ATOM 100 CE1 HIS A 415 5.934 -16.628 -1.645 1.00 0.00 C flip ATOM 101 NE2 HIS A 415 7.202 -16.269 -1.719 1.00 0.00 N flip ATOM 0 H HIS A 415 6.722 -10.836 -0.283 1.00 0.00 H new ATOM 0 HA HIS A 415 6.620 -12.518 -2.558 1.00 0.00 H new ATOM 0 HB2 HIS A 415 6.459 -12.839 0.154 1.00 0.00 H new ATOM 0 HB3 HIS A 415 4.770 -13.011 -0.279 1.00 0.00 H new ATOM 0 HD2 HIS A 415 8.208 -14.419 -1.356 1.00 0.00 H new ATOM 0 HE1 HIS A 415 5.548 -17.613 -1.861 1.00 0.00 H new ATOM 0 HE2 HIS A 415 7.979 -16.873 -1.987 1.00 0.00 H new ATOM 110 N LYS A 416 3.882 -12.791 -2.805 1.00 0.00 N ATOM 111 CA LYS A 416 2.569 -12.610 -3.412 1.00 0.00 C ATOM 112 C LYS A 416 1.469 -13.144 -2.500 1.00 0.00 C ATOM 113 O LYS A 416 1.641 -14.169 -1.841 1.00 0.00 O ATOM 114 CB LYS A 416 2.508 -13.313 -4.770 1.00 0.00 C ATOM 115 CG LYS A 416 2.670 -14.822 -4.683 1.00 0.00 C ATOM 116 CD LYS A 416 1.860 -15.531 -5.757 1.00 0.00 C ATOM 117 CE LYS A 416 1.764 -17.025 -5.490 1.00 0.00 C ATOM 118 NZ LYS A 416 0.465 -17.588 -5.950 1.00 0.00 N ATOM 0 H LYS A 416 4.168 -13.764 -2.701 1.00 0.00 H new ATOM 0 HA LYS A 416 2.409 -11.542 -3.557 1.00 0.00 H new ATOM 0 HB2 LYS A 416 1.554 -13.085 -5.245 1.00 0.00 H new ATOM 0 HB3 LYS A 416 3.289 -12.909 -5.414 1.00 0.00 H new ATOM 0 HG2 LYS A 416 3.723 -15.083 -4.788 1.00 0.00 H new ATOM 0 HG3 LYS A 416 2.353 -15.167 -3.699 1.00 0.00 H new ATOM 0 HD2 LYS A 416 0.858 -15.103 -5.800 1.00 0.00 H new ATOM 0 HD3 LYS A 416 2.320 -15.364 -6.731 1.00 0.00 H new ATOM 0 HE2 LYS A 416 2.582 -17.538 -5.996 1.00 0.00 H new ATOM 0 HE3 LYS A 416 1.883 -17.212 -4.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 416 0.439 -18.608 -5.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 416 -0.315 -17.117 -5.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 416 0.362 -17.433 -6.973 1.00 0.00 H new ATOM 132 N LEU A 417 0.342 -12.440 -2.463 1.00 0.00 N ATOM 133 CA LEU A 417 -0.784 -12.844 -1.628 1.00 0.00 C ATOM 134 C LEU A 417 -1.924 -13.399 -2.475 1.00 0.00 C ATOM 135 O LEU A 417 -2.516 -14.426 -2.141 1.00 0.00 O ATOM 136 CB LEU A 417 -1.282 -11.662 -0.795 1.00 0.00 C ATOM 137 CG LEU A 417 -0.792 -11.645 0.654 1.00 0.00 C ATOM 138 CD1 LEU A 417 -1.445 -12.765 1.451 1.00 0.00 C ATOM 139 CD2 LEU A 417 0.724 -11.766 0.704 1.00 0.00 C ATOM 0 H LEU A 417 0.184 -11.588 -3.001 1.00 0.00 H new ATOM 0 HA LEU A 417 -0.438 -13.631 -0.958 1.00 0.00 H new ATOM 0 HB2 LEU A 417 -0.970 -10.737 -1.280 1.00 0.00 H new ATOM 0 HB3 LEU A 417 -2.372 -11.670 -0.795 1.00 0.00 H new ATOM 0 HG LEU A 417 -1.076 -10.694 1.104 1.00 0.00 H new ATOM 0 HD11 LEU A 417 -1.085 -12.738 2.479 1.00 0.00 H new ATOM 0 HD12 LEU A 417 -2.527 -12.635 1.442 1.00 0.00 H new ATOM 0 HD13 LEU A 417 -1.191 -13.726 1.003 1.00 0.00 H new ATOM 0 HD21 LEU A 417 1.056 -11.752 1.742 1.00 0.00 H new ATOM 0 HD22 LEU A 417 1.030 -12.702 0.238 1.00 0.00 H new ATOM 0 HD23 LEU A 417 1.174 -10.930 0.168 1.00 0.00 H new ATOM 151 N ALA A 418 -2.232 -12.712 -3.570 1.00 0.00 N ATOM 152 CA ALA A 418 -3.306 -13.135 -4.460 1.00 0.00 C ATOM 153 C ALA A 418 -4.624 -13.268 -3.703 1.00 0.00 C ATOM 154 O ALA A 418 -5.515 -14.011 -4.114 1.00 0.00 O ATOM 155 CB ALA A 418 -2.948 -14.451 -5.132 1.00 0.00 C ATOM 0 H ALA A 418 -1.753 -11.860 -3.862 1.00 0.00 H new ATOM 0 HA ALA A 418 -3.431 -12.371 -5.227 1.00 0.00 H new ATOM 0 HB1 ALA A 418 -3.759 -14.754 -5.794 1.00 0.00 H new ATOM 0 HB2 ALA A 418 -2.034 -14.326 -5.713 1.00 0.00 H new ATOM 0 HB3 ALA A 418 -2.794 -15.217 -4.372 1.00 0.00 H new ATOM 161 N LYS A 419 -4.740 -12.543 -2.595 1.00 0.00 N ATOM 162 CA LYS A 419 -5.949 -12.581 -1.781 1.00 0.00 C ATOM 163 C LYS A 419 -5.933 -11.474 -0.732 1.00 0.00 C ATOM 164 O LYS A 419 -4.964 -11.323 0.012 1.00 0.00 O ATOM 165 CB LYS A 419 -6.084 -13.943 -1.098 1.00 0.00 C ATOM 166 CG LYS A 419 -7.501 -14.261 -0.651 1.00 0.00 C ATOM 167 CD LYS A 419 -7.547 -14.667 0.813 1.00 0.00 C ATOM 168 CE LYS A 419 -7.569 -16.179 0.972 1.00 0.00 C ATOM 169 NZ LYS A 419 -6.274 -16.798 0.579 1.00 0.00 N ATOM 0 H LYS A 419 -4.012 -11.923 -2.241 1.00 0.00 H new ATOM 0 HA LYS A 419 -6.805 -12.423 -2.437 1.00 0.00 H new ATOM 0 HB2 LYS A 419 -5.745 -14.719 -1.784 1.00 0.00 H new ATOM 0 HB3 LYS A 419 -5.423 -13.973 -0.232 1.00 0.00 H new ATOM 0 HG2 LYS A 419 -8.137 -13.390 -0.808 1.00 0.00 H new ATOM 0 HG3 LYS A 419 -7.905 -15.066 -1.265 1.00 0.00 H new ATOM 0 HD2 LYS A 419 -6.680 -14.258 1.332 1.00 0.00 H new ATOM 0 HD3 LYS A 419 -8.432 -14.238 1.283 1.00 0.00 H new ATOM 0 HE2 LYS A 419 -7.792 -16.432 2.009 1.00 0.00 H new ATOM 0 HE3 LYS A 419 -8.370 -16.596 0.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 419 -6.331 -17.829 0.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 419 -6.073 -16.579 -0.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 419 -5.512 -16.419 1.177 1.00 0.00 H new ATOM 183 N SER A 420 -7.013 -10.702 -0.679 1.00 0.00 N ATOM 184 CA SER A 420 -7.123 -9.607 0.277 1.00 0.00 C ATOM 185 C SER A 420 -6.827 -10.089 1.693 1.00 0.00 C ATOM 186 O SER A 420 -6.766 -11.291 1.951 1.00 0.00 O ATOM 187 CB SER A 420 -8.522 -8.990 0.219 1.00 0.00 C ATOM 188 OG SER A 420 -9.429 -9.840 -0.461 1.00 0.00 O ATOM 0 H SER A 420 -7.824 -10.814 -1.287 1.00 0.00 H new ATOM 0 HA SER A 420 -6.387 -8.849 0.009 1.00 0.00 H new ATOM 0 HB2 SER A 420 -8.883 -8.804 1.231 1.00 0.00 H new ATOM 0 HB3 SER A 420 -8.476 -8.025 -0.285 1.00 0.00 H new ATOM 0 HG SER A 420 -10.315 -9.423 -0.482 1.00 0.00 H new ATOM 194 N ILE A 421 -6.643 -9.142 2.607 1.00 0.00 N ATOM 195 CA ILE A 421 -6.357 -9.467 4.000 1.00 0.00 C ATOM 196 C ILE A 421 -7.194 -8.609 4.945 1.00 0.00 C ATOM 197 O ILE A 421 -7.699 -7.556 4.556 1.00 0.00 O ATOM 198 CB ILE A 421 -4.865 -9.276 4.338 1.00 0.00 C ATOM 199 CG1 ILE A 421 -4.295 -8.065 3.596 1.00 0.00 C ATOM 200 CG2 ILE A 421 -4.080 -10.532 3.992 1.00 0.00 C ATOM 201 CD1 ILE A 421 -2.805 -7.885 3.789 1.00 0.00 C ATOM 0 H ILE A 421 -6.687 -8.143 2.408 1.00 0.00 H new ATOM 0 HA ILE A 421 -6.615 -10.517 4.135 1.00 0.00 H new ATOM 0 HB ILE A 421 -4.774 -9.094 5.409 1.00 0.00 H new ATOM 0 HG12 ILE A 421 -4.505 -8.169 2.532 1.00 0.00 H new ATOM 0 HG13 ILE A 421 -4.809 -7.166 3.936 1.00 0.00 H new ATOM 0 HG21 ILE A 421 -3.028 -10.382 4.236 1.00 0.00 H new ATOM 0 HG22 ILE A 421 -4.469 -11.374 4.565 1.00 0.00 H new ATOM 0 HG23 ILE A 421 -4.179 -10.741 2.927 1.00 0.00 H new ATOM 0 HD11 ILE A 421 -2.470 -7.008 3.235 1.00 0.00 H new ATOM 0 HD12 ILE A 421 -2.589 -7.749 4.849 1.00 0.00 H new ATOM 0 HD13 ILE A 421 -2.281 -8.768 3.422 1.00 0.00 H new ATOM 213 N PRO A 422 -7.355 -9.052 6.203 1.00 0.00 N ATOM 214 CA PRO A 422 -8.137 -8.318 7.205 1.00 0.00 C ATOM 215 C PRO A 422 -7.515 -6.969 7.550 1.00 0.00 C ATOM 216 O PRO A 422 -6.919 -6.803 8.614 1.00 0.00 O ATOM 217 CB PRO A 422 -8.124 -9.245 8.424 1.00 0.00 C ATOM 218 CG PRO A 422 -6.923 -10.103 8.234 1.00 0.00 C ATOM 219 CD PRO A 422 -6.788 -10.296 6.751 1.00 0.00 C ATOM 0 HA PRO A 422 -9.140 -8.085 6.846 1.00 0.00 H new ATOM 0 HB2 PRO A 422 -8.062 -8.677 9.352 1.00 0.00 H new ATOM 0 HB3 PRO A 422 -9.034 -9.843 8.476 1.00 0.00 H new ATOM 0 HG2 PRO A 422 -6.034 -9.628 8.649 1.00 0.00 H new ATOM 0 HG3 PRO A 422 -7.041 -11.059 8.744 1.00 0.00 H new ATOM 0 HD2 PRO A 422 -5.748 -10.431 6.454 1.00 0.00 H new ATOM 0 HD3 PRO A 422 -7.334 -11.174 6.407 1.00 0.00 H new ATOM 227 N LEU A 423 -7.659 -6.007 6.643 1.00 0.00 N ATOM 228 CA LEU A 423 -7.110 -4.672 6.851 1.00 0.00 C ATOM 229 C LEU A 423 -8.045 -3.821 7.704 1.00 0.00 C ATOM 230 O LEU A 423 -9.241 -4.097 7.796 1.00 0.00 O ATOM 231 CB LEU A 423 -6.864 -3.981 5.508 1.00 0.00 C ATOM 232 CG LEU A 423 -5.838 -4.669 4.607 1.00 0.00 C ATOM 233 CD1 LEU A 423 -6.027 -4.243 3.159 1.00 0.00 C ATOM 234 CD2 LEU A 423 -4.424 -4.360 5.076 1.00 0.00 C ATOM 0 H LEU A 423 -8.151 -6.128 5.758 1.00 0.00 H new ATOM 0 HA LEU A 423 -6.162 -4.780 7.378 1.00 0.00 H new ATOM 0 HB2 LEU A 423 -7.810 -3.915 4.971 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -6.533 -2.960 5.697 1.00 0.00 H new ATOM 0 HG LEU A 423 -5.993 -5.746 4.670 1.00 0.00 H new ATOM 0 HD11 LEU A 423 -5.288 -4.743 2.533 1.00 0.00 H new ATOM 0 HD12 LEU A 423 -7.028 -4.517 2.827 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -5.900 -3.163 3.078 1.00 0.00 H new ATOM 0 HD21 LEU A 423 -3.707 -4.858 4.423 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -4.257 -3.283 5.044 1.00 0.00 H new ATOM 0 HD23 LEU A 423 -4.293 -4.717 6.098 1.00 0.00 H new ATOM 246 N ARG A 424 -7.491 -2.783 8.321 1.00 0.00 N ATOM 247 CA ARG A 424 -8.275 -1.883 9.159 1.00 0.00 C ATOM 248 C ARG A 424 -8.761 -0.679 8.358 1.00 0.00 C ATOM 249 O ARG A 424 -9.760 -0.050 8.708 1.00 0.00 O ATOM 250 CB ARG A 424 -7.444 -1.413 10.354 1.00 0.00 C ATOM 251 CG ARG A 424 -7.072 -2.533 11.312 1.00 0.00 C ATOM 252 CD ARG A 424 -8.166 -2.774 12.340 1.00 0.00 C ATOM 253 NE ARG A 424 -7.750 -2.379 13.682 1.00 0.00 N ATOM 254 CZ ARG A 424 -6.886 -3.070 14.418 1.00 0.00 C ATOM 255 NH1 ARG A 424 -6.353 -4.187 13.944 1.00 0.00 N ATOM 256 NH2 ARG A 424 -6.556 -2.644 15.630 1.00 0.00 N ATOM 0 H ARG A 424 -6.502 -2.544 8.257 1.00 0.00 H new ATOM 0 HA ARG A 424 -9.145 -2.430 9.522 1.00 0.00 H new ATOM 0 HB2 ARG A 424 -6.532 -0.940 9.989 1.00 0.00 H new ATOM 0 HB3 ARG A 424 -8.003 -0.651 10.898 1.00 0.00 H new ATOM 0 HG2 ARG A 424 -6.892 -3.449 10.750 1.00 0.00 H new ATOM 0 HG3 ARG A 424 -6.141 -2.283 11.821 1.00 0.00 H new ATOM 0 HD2 ARG A 424 -9.058 -2.216 12.058 1.00 0.00 H new ATOM 0 HD3 ARG A 424 -8.437 -3.830 12.340 1.00 0.00 H new ATOM 0 HE ARG A 424 -8.144 -1.525 14.077 1.00 0.00 H new ATOM 0 HH11 ARG A 424 -6.606 -4.518 13.013 1.00 0.00 H new ATOM 0 HH12 ARG A 424 -5.690 -4.716 14.510 1.00 0.00 H new ATOM 0 HH21 ARG A 424 -6.966 -1.785 15.998 1.00 0.00 H new ATOM 0 HH22 ARG A 424 -5.893 -3.175 16.194 1.00 0.00 H new ATOM 270 N ARG A 425 -8.047 -0.362 7.282 1.00 0.00 N ATOM 271 CA ARG A 425 -8.414 0.759 6.423 1.00 0.00 C ATOM 272 C ARG A 425 -8.754 0.265 5.022 1.00 0.00 C ATOM 273 O ARG A 425 -8.814 -0.940 4.780 1.00 0.00 O ATOM 274 CB ARG A 425 -7.274 1.777 6.357 1.00 0.00 C ATOM 275 CG ARG A 425 -7.461 2.958 7.297 1.00 0.00 C ATOM 276 CD ARG A 425 -7.057 2.608 8.719 1.00 0.00 C ATOM 277 NE ARG A 425 -8.217 2.366 9.574 1.00 0.00 N ATOM 278 CZ ARG A 425 -8.960 3.336 10.097 1.00 0.00 C ATOM 279 NH1 ARG A 425 -8.665 4.606 9.853 1.00 0.00 N ATOM 280 NH2 ARG A 425 -10.000 3.036 10.864 1.00 0.00 N ATOM 0 H ARG A 425 -7.211 -0.865 6.984 1.00 0.00 H new ATOM 0 HA ARG A 425 -9.293 1.244 6.848 1.00 0.00 H new ATOM 0 HB2 ARG A 425 -6.336 1.276 6.597 1.00 0.00 H new ATOM 0 HB3 ARG A 425 -7.186 2.146 5.335 1.00 0.00 H new ATOM 0 HG2 ARG A 425 -6.866 3.801 6.946 1.00 0.00 H new ATOM 0 HG3 ARG A 425 -8.504 3.275 7.282 1.00 0.00 H new ATOM 0 HD2 ARG A 425 -6.423 1.721 8.708 1.00 0.00 H new ATOM 0 HD3 ARG A 425 -6.462 3.420 9.137 1.00 0.00 H new ATOM 0 HE ARG A 425 -8.470 1.400 9.781 1.00 0.00 H new ATOM 0 HH11 ARG A 425 -7.867 4.840 9.263 1.00 0.00 H new ATOM 0 HH12 ARG A 425 -9.237 5.349 10.255 1.00 0.00 H new ATOM 0 HH21 ARG A 425 -10.230 2.060 11.053 1.00 0.00 H new ATOM 0 HH22 ARG A 425 -10.570 3.781 11.265 1.00 0.00 H new ATOM 294 N GLN A 426 -8.978 1.196 4.100 1.00 0.00 N ATOM 295 CA GLN A 426 -9.314 0.828 2.731 1.00 0.00 C ATOM 296 C GLN A 426 -9.077 1.979 1.761 1.00 0.00 C ATOM 297 O GLN A 426 -10.020 2.588 1.256 1.00 0.00 O ATOM 298 CB GLN A 426 -10.770 0.363 2.650 1.00 0.00 C ATOM 299 CG GLN A 426 -10.919 -1.138 2.462 1.00 0.00 C ATOM 300 CD GLN A 426 -11.653 -1.801 3.611 1.00 0.00 C ATOM 301 OE1 GLN A 426 -11.816 -1.214 4.680 1.00 0.00 O ATOM 302 NE2 GLN A 426 -12.099 -3.033 3.395 1.00 0.00 N ATOM 0 H GLN A 426 -8.933 2.200 4.274 1.00 0.00 H new ATOM 0 HA GLN A 426 -8.657 0.009 2.440 1.00 0.00 H new ATOM 0 HB2 GLN A 426 -11.289 0.660 3.561 1.00 0.00 H new ATOM 0 HB3 GLN A 426 -11.261 0.875 1.822 1.00 0.00 H new ATOM 0 HG2 GLN A 426 -11.455 -1.332 1.533 1.00 0.00 H new ATOM 0 HG3 GLN A 426 -9.931 -1.587 2.360 1.00 0.00 H new ATOM 0 HE21 GLN A 426 -11.941 -3.482 2.493 1.00 0.00 H new ATOM 0 HE22 GLN A 426 -12.599 -3.531 4.131 1.00 0.00 H new ATOM 311 N VAL A 427 -7.807 2.248 1.483 1.00 0.00 N ATOM 312 CA VAL A 427 -7.430 3.281 0.525 1.00 0.00 C ATOM 313 C VAL A 427 -6.824 2.619 -0.716 1.00 0.00 C ATOM 314 O VAL A 427 -5.670 2.191 -0.711 1.00 0.00 O ATOM 315 CB VAL A 427 -6.465 4.336 1.153 1.00 0.00 C ATOM 316 CG1 VAL A 427 -5.645 3.728 2.276 1.00 0.00 C ATOM 317 CG2 VAL A 427 -5.551 4.979 0.120 1.00 0.00 C ATOM 0 H VAL A 427 -7.018 1.763 1.909 1.00 0.00 H new ATOM 0 HA VAL A 427 -8.324 3.831 0.231 1.00 0.00 H new ATOM 0 HB VAL A 427 -7.096 5.124 1.564 1.00 0.00 H new ATOM 0 HG11 VAL A 427 -4.982 4.486 2.694 1.00 0.00 H new ATOM 0 HG12 VAL A 427 -6.312 3.359 3.055 1.00 0.00 H new ATOM 0 HG13 VAL A 427 -5.051 2.902 1.886 1.00 0.00 H new ATOM 0 HG21 VAL A 427 -4.901 5.704 0.610 1.00 0.00 H new ATOM 0 HG22 VAL A 427 -4.943 4.210 -0.356 1.00 0.00 H new ATOM 0 HG23 VAL A 427 -6.154 5.484 -0.635 1.00 0.00 H new ATOM 327 N THR A 428 -7.632 2.514 -1.762 1.00 0.00 N ATOM 328 CA THR A 428 -7.224 1.843 -2.986 1.00 0.00 C ATOM 329 C THR A 428 -6.474 2.797 -3.934 1.00 0.00 C ATOM 330 O THR A 428 -7.069 3.417 -4.811 1.00 0.00 O ATOM 331 CB THR A 428 -8.473 1.237 -3.658 1.00 0.00 C ATOM 332 OG1 THR A 428 -8.874 0.052 -2.992 1.00 0.00 O ATOM 333 CG2 THR A 428 -8.307 0.908 -5.124 1.00 0.00 C ATOM 0 H THR A 428 -8.581 2.888 -1.786 1.00 0.00 H new ATOM 0 HA THR A 428 -6.523 1.044 -2.743 1.00 0.00 H new ATOM 0 HB THR A 428 -9.227 2.020 -3.582 1.00 0.00 H new ATOM 0 HG1 THR A 428 -8.381 -0.033 -2.149 1.00 0.00 H new ATOM 0 HG21 THR A 428 -9.236 0.487 -5.510 1.00 0.00 H new ATOM 0 HG22 THR A 428 -8.063 1.816 -5.675 1.00 0.00 H new ATOM 0 HG23 THR A 428 -7.502 0.183 -5.245 1.00 0.00 H new ATOM 341 N VAL A 429 -5.154 2.884 -3.768 1.00 0.00 N ATOM 342 CA VAL A 429 -4.330 3.766 -4.611 1.00 0.00 C ATOM 343 C VAL A 429 -4.039 3.107 -5.959 1.00 0.00 C ATOM 344 O VAL A 429 -3.176 2.227 -6.075 1.00 0.00 O ATOM 345 CB VAL A 429 -3.013 4.265 -3.899 1.00 0.00 C ATOM 346 CG1 VAL A 429 -2.938 3.772 -2.465 1.00 0.00 C ATOM 347 CG2 VAL A 429 -1.727 3.886 -4.638 1.00 0.00 C ATOM 0 H VAL A 429 -4.631 2.361 -3.065 1.00 0.00 H new ATOM 0 HA VAL A 429 -4.917 4.667 -4.790 1.00 0.00 H new ATOM 0 HB VAL A 429 -3.080 5.353 -3.912 1.00 0.00 H new ATOM 0 HG11 VAL A 429 -2.019 4.133 -2.004 1.00 0.00 H new ATOM 0 HG12 VAL A 429 -3.796 4.146 -1.906 1.00 0.00 H new ATOM 0 HG13 VAL A 429 -2.945 2.682 -2.454 1.00 0.00 H new ATOM 0 HG21 VAL A 429 -0.866 4.264 -4.087 1.00 0.00 H new ATOM 0 HG22 VAL A 429 -1.659 2.801 -4.717 1.00 0.00 H new ATOM 0 HG23 VAL A 429 -1.739 4.323 -5.637 1.00 0.00 H new ATOM 357 N SER A 430 -4.740 3.588 -6.980 1.00 0.00 N ATOM 358 CA SER A 430 -4.600 3.066 -8.330 1.00 0.00 C ATOM 359 C SER A 430 -3.135 2.847 -8.701 1.00 0.00 C ATOM 360 O SER A 430 -2.263 3.418 -8.012 1.00 0.00 O ATOM 361 CB SER A 430 -5.250 4.021 -9.333 1.00 0.00 C ATOM 362 OG SER A 430 -5.244 3.472 -10.639 1.00 0.00 O ATOM 363 OXT SER A 430 -2.882 2.239 -9.762 1.00 0.00 O ATOM 0 H SER A 430 -5.417 4.346 -6.894 1.00 0.00 H new ATOM 0 HA SER A 430 -5.104 2.100 -8.364 1.00 0.00 H new ATOM 0 HB2 SER A 430 -6.275 4.230 -9.028 1.00 0.00 H new ATOM 0 HB3 SER A 430 -4.717 4.972 -9.333 1.00 0.00 H new ATOM 0 HG SER A 430 -4.524 2.812 -10.713 1.00 0.00 H new TER 369 SER A 430 ATOM 370 N MET B 8 29.299 11.379 -3.884 1.00 0.00 N ATOM 371 CA MET B 8 28.411 12.178 -3.000 1.00 0.00 C ATOM 372 C MET B 8 27.808 13.363 -3.747 1.00 0.00 C ATOM 373 O MET B 8 26.588 13.501 -3.831 1.00 0.00 O ATOM 374 CB MET B 8 29.229 12.671 -1.804 1.00 0.00 C ATOM 375 CG MET B 8 28.573 12.393 -0.462 1.00 0.00 C ATOM 376 SD MET B 8 29.703 11.633 0.720 1.00 0.00 S ATOM 377 CE MET B 8 30.121 10.117 -0.138 1.00 0.00 C ATOM 0 HA MET B 8 27.587 11.550 -2.661 1.00 0.00 H new ATOM 0 HB2 MET B 8 30.210 12.196 -1.825 1.00 0.00 H new ATOM 0 HB3 MET B 8 29.392 13.744 -1.904 1.00 0.00 H new ATOM 0 HG2 MET B 8 28.194 13.327 -0.047 1.00 0.00 H new ATOM 0 HG3 MET B 8 27.714 11.738 -0.610 1.00 0.00 H new ATOM 0 HE1 MET B 8 30.355 9.340 0.590 1.00 0.00 H new ATOM 0 HE2 MET B 8 29.276 9.800 -0.749 1.00 0.00 H new ATOM 0 HE3 MET B 8 30.987 10.288 -0.778 1.00 0.00 H new ATOM 389 N GLY B 9 28.672 14.218 -4.285 1.00 0.00 N ATOM 390 CA GLY B 9 28.205 15.382 -5.016 1.00 0.00 C ATOM 391 C GLY B 9 28.498 16.680 -4.289 1.00 0.00 C ATOM 392 O GLY B 9 28.098 16.858 -3.138 1.00 0.00 O ATOM 0 H GLY B 9 29.686 14.126 -4.228 1.00 0.00 H new ATOM 0 HA2 GLY B 9 28.678 15.404 -5.998 1.00 0.00 H new ATOM 0 HA3 GLY B 9 27.131 15.296 -5.181 1.00 0.00 H new ATOM 396 N SER B 10 29.196 17.589 -4.962 1.00 0.00 N ATOM 397 CA SER B 10 29.542 18.877 -4.372 1.00 0.00 C ATOM 398 C SER B 10 28.668 19.988 -4.943 1.00 0.00 C ATOM 399 O SER B 10 29.030 20.635 -5.926 1.00 0.00 O ATOM 400 CB SER B 10 31.017 19.195 -4.621 1.00 0.00 C ATOM 401 OG SER B 10 31.642 19.675 -3.443 1.00 0.00 O ATOM 0 H SER B 10 29.533 17.458 -5.916 1.00 0.00 H new ATOM 0 HA SER B 10 29.366 18.816 -3.298 1.00 0.00 H new ATOM 0 HB2 SER B 10 31.531 18.300 -4.970 1.00 0.00 H new ATOM 0 HB3 SER B 10 31.103 19.941 -5.412 1.00 0.00 H new ATOM 0 HG SER B 10 32.584 19.869 -3.629 1.00 0.00 H new ATOM 407 N ASP B 11 27.514 20.205 -4.320 1.00 0.00 N ATOM 408 CA ASP B 11 26.588 21.239 -4.766 1.00 0.00 C ATOM 409 C ASP B 11 25.599 21.599 -3.662 1.00 0.00 C ATOM 410 O ASP B 11 24.447 21.934 -3.934 1.00 0.00 O ATOM 411 CB ASP B 11 25.831 20.771 -6.011 1.00 0.00 C ATOM 412 CG ASP B 11 26.008 21.715 -7.183 1.00 0.00 C ATOM 413 OD1 ASP B 11 25.347 22.775 -7.197 1.00 0.00 O ATOM 414 OD2 ASP B 11 26.809 21.396 -8.087 1.00 0.00 O ATOM 0 H ASP B 11 27.198 19.679 -3.505 1.00 0.00 H new ATOM 0 HA ASP B 11 27.168 22.128 -5.013 1.00 0.00 H new ATOM 0 HB2 ASP B 11 26.179 19.777 -6.293 1.00 0.00 H new ATOM 0 HB3 ASP B 11 24.770 20.682 -5.776 1.00 0.00 H new ATOM 419 N THR B 12 26.057 21.528 -2.417 1.00 0.00 N ATOM 420 CA THR B 12 25.211 21.847 -1.273 1.00 0.00 C ATOM 421 C THR B 12 24.002 20.919 -1.215 1.00 0.00 C ATOM 422 O THR B 12 22.858 21.371 -1.261 1.00 0.00 O ATOM 423 CB THR B 12 24.746 23.303 -1.348 1.00 0.00 C ATOM 424 OG1 THR B 12 25.765 24.127 -1.886 1.00 0.00 O ATOM 425 CG2 THR B 12 24.352 23.876 -0.004 1.00 0.00 C ATOM 0 H THR B 12 27.009 21.253 -2.174 1.00 0.00 H new ATOM 0 HA THR B 12 25.799 21.705 -0.366 1.00 0.00 H new ATOM 0 HB THR B 12 23.866 23.293 -1.991 1.00 0.00 H new ATOM 0 HG1 THR B 12 25.449 25.054 -1.928 1.00 0.00 H new ATOM 0 HG21 THR B 12 24.033 24.911 -0.129 1.00 0.00 H new ATOM 0 HG22 THR B 12 23.533 23.291 0.415 1.00 0.00 H new ATOM 0 HG23 THR B 12 25.206 23.839 0.672 1.00 0.00 H new ATOM 433 N VAL B 13 24.264 19.620 -1.113 1.00 0.00 N ATOM 434 CA VAL B 13 23.196 18.628 -1.052 1.00 0.00 C ATOM 435 C VAL B 13 23.251 17.842 0.259 1.00 0.00 C ATOM 436 O VAL B 13 24.204 17.103 0.505 1.00 0.00 O ATOM 437 CB VAL B 13 23.281 17.640 -2.230 1.00 0.00 C ATOM 438 CG1 VAL B 13 21.973 16.881 -2.386 1.00 0.00 C ATOM 439 CG2 VAL B 13 23.639 18.372 -3.514 1.00 0.00 C ATOM 0 H VAL B 13 25.205 19.230 -1.071 1.00 0.00 H new ATOM 0 HA VAL B 13 22.253 19.172 -1.110 1.00 0.00 H new ATOM 0 HB VAL B 13 24.069 16.917 -2.019 1.00 0.00 H new ATOM 0 HG11 VAL B 13 22.052 16.188 -3.223 1.00 0.00 H new ATOM 0 HG12 VAL B 13 21.764 16.324 -1.472 1.00 0.00 H new ATOM 0 HG13 VAL B 13 21.163 17.586 -2.574 1.00 0.00 H new ATOM 0 HG21 VAL B 13 23.695 17.658 -4.336 1.00 0.00 H new ATOM 0 HG22 VAL B 13 22.875 19.118 -3.732 1.00 0.00 H new ATOM 0 HG23 VAL B 13 24.604 18.865 -3.395 1.00 0.00 H new ATOM 449 N PRO B 14 22.229 17.989 1.123 1.00 0.00 N ATOM 450 CA PRO B 14 22.171 17.286 2.411 1.00 0.00 C ATOM 451 C PRO B 14 21.890 15.795 2.248 1.00 0.00 C ATOM 452 O PRO B 14 21.534 15.336 1.163 1.00 0.00 O ATOM 453 CB PRO B 14 21.017 17.977 3.128 1.00 0.00 C ATOM 454 CG PRO B 14 20.127 18.385 2.019 1.00 0.00 C ATOM 455 CD PRO B 14 21.046 18.845 0.924 1.00 0.00 C ATOM 0 HA PRO B 14 23.117 17.333 2.950 1.00 0.00 H new ATOM 0 HB2 PRO B 14 20.513 17.304 3.822 1.00 0.00 H new ATOM 0 HB3 PRO B 14 21.358 18.835 3.707 1.00 0.00 H new ATOM 0 HG2 PRO B 14 19.505 17.554 1.687 1.00 0.00 H new ATOM 0 HG3 PRO B 14 19.453 19.184 2.329 1.00 0.00 H new ATOM 0 HD2 PRO B 14 20.604 18.705 -0.063 1.00 0.00 H new ATOM 0 HD3 PRO B 14 21.290 19.903 1.016 1.00 0.00 H new ATOM 463 N ASP B 15 22.056 15.045 3.332 1.00 0.00 N ATOM 464 CA ASP B 15 21.827 13.604 3.307 1.00 0.00 C ATOM 465 C ASP B 15 20.634 13.219 4.177 1.00 0.00 C ATOM 466 O ASP B 15 20.046 12.152 3.999 1.00 0.00 O ATOM 467 CB ASP B 15 23.077 12.861 3.783 1.00 0.00 C ATOM 468 CG ASP B 15 23.233 11.508 3.118 1.00 0.00 C ATOM 469 OD1 ASP B 15 23.542 11.474 1.908 1.00 0.00 O ATOM 470 OD2 ASP B 15 23.047 10.483 3.806 1.00 0.00 O ATOM 0 H ASP B 15 22.348 15.410 4.239 1.00 0.00 H new ATOM 0 HA ASP B 15 21.607 13.318 2.278 1.00 0.00 H new ATOM 0 HB2 ASP B 15 23.958 13.468 3.576 1.00 0.00 H new ATOM 0 HB3 ASP B 15 23.028 12.728 4.864 1.00 0.00 H new ATOM 475 N ASN B 16 20.284 14.087 5.121 1.00 0.00 N ATOM 476 CA ASN B 16 19.163 13.830 6.017 1.00 0.00 C ATOM 477 C ASN B 16 17.848 13.780 5.246 1.00 0.00 C ATOM 478 O ASN B 16 17.045 14.711 5.310 1.00 0.00 O ATOM 479 CB ASN B 16 19.089 14.910 7.098 1.00 0.00 C ATOM 480 CG ASN B 16 20.148 14.733 8.168 1.00 0.00 C ATOM 481 OD1 ASN B 16 20.692 13.643 8.346 1.00 0.00 O ATOM 482 ND2 ASN B 16 20.446 15.807 8.890 1.00 0.00 N ATOM 0 H ASN B 16 20.760 14.974 5.285 1.00 0.00 H new ATOM 0 HA ASN B 16 19.325 12.861 6.489 1.00 0.00 H new ATOM 0 HB2 ASN B 16 19.204 15.891 6.636 1.00 0.00 H new ATOM 0 HB3 ASN B 16 18.102 14.889 7.561 1.00 0.00 H new ATOM 0 HD21 ASN B 16 21.150 15.748 9.626 1.00 0.00 H new ATOM 0 HD22 ASN B 16 19.971 16.691 8.709 1.00 0.00 H new ATOM 489 N HIS B 17 17.632 12.689 4.518 1.00 0.00 N ATOM 490 CA HIS B 17 16.411 12.520 3.741 1.00 0.00 C ATOM 491 C HIS B 17 16.180 11.053 3.393 1.00 0.00 C ATOM 492 O HIS B 17 16.006 10.700 2.227 1.00 0.00 O ATOM 493 CB HIS B 17 16.470 13.358 2.462 1.00 0.00 C ATOM 494 CG HIS B 17 17.781 13.271 1.743 1.00 0.00 C ATOM 495 ND1 HIS B 17 18.357 12.074 1.370 1.00 0.00 N ATOM 496 CD2 HIS B 17 18.628 14.241 1.322 1.00 0.00 C ATOM 497 CE1 HIS B 17 19.502 12.311 0.754 1.00 0.00 C ATOM 498 NE2 HIS B 17 19.688 13.617 0.712 1.00 0.00 N ATOM 0 H HIS B 17 18.287 11.910 4.450 1.00 0.00 H new ATOM 0 HA HIS B 17 15.576 12.863 4.352 1.00 0.00 H new ATOM 0 HB2 HIS B 17 15.675 13.035 1.790 1.00 0.00 H new ATOM 0 HB3 HIS B 17 16.272 14.400 2.712 1.00 0.00 H new ATOM 0 HD1 HIS B 17 17.961 11.150 1.543 1.00 0.00 H new ATOM 0 HD2 HIS B 17 18.494 15.306 1.443 1.00 0.00 H new ATOM 0 HE1 HIS B 17 20.171 11.564 0.353 1.00 0.00 H new ATOM 0 HE2 HIS B 17 20.491 14.087 0.293 1.00 0.00 H new ATOM 507 N ARG B 18 16.171 10.204 4.416 1.00 0.00 N ATOM 508 CA ARG B 18 15.947 8.775 4.226 1.00 0.00 C ATOM 509 C ARG B 18 14.819 8.282 5.128 1.00 0.00 C ATOM 510 O ARG B 18 14.914 8.359 6.353 1.00 0.00 O ATOM 511 CB ARG B 18 17.229 7.990 4.517 1.00 0.00 C ATOM 512 CG ARG B 18 17.948 8.441 5.779 1.00 0.00 C ATOM 513 CD ARG B 18 18.451 7.255 6.586 1.00 0.00 C ATOM 514 NE ARG B 18 19.905 7.138 6.540 1.00 0.00 N ATOM 515 CZ ARG B 18 20.579 6.114 7.053 1.00 0.00 C ATOM 516 NH1 ARG B 18 19.930 5.123 7.649 1.00 0.00 N ATOM 517 NH2 ARG B 18 21.902 6.079 6.970 1.00 0.00 N ATOM 0 H ARG B 18 16.317 10.482 5.387 1.00 0.00 H new ATOM 0 HA ARG B 18 15.660 8.611 3.187 1.00 0.00 H new ATOM 0 HB2 ARG B 18 16.984 6.932 4.607 1.00 0.00 H new ATOM 0 HB3 ARG B 18 17.906 8.089 3.668 1.00 0.00 H new ATOM 0 HG2 ARG B 18 18.787 9.083 5.511 1.00 0.00 H new ATOM 0 HG3 ARG B 18 17.272 9.039 6.391 1.00 0.00 H new ATOM 0 HD2 ARG B 18 18.129 7.359 7.622 1.00 0.00 H new ATOM 0 HD3 ARG B 18 18.002 6.339 6.202 1.00 0.00 H new ATOM 0 HE ARG B 18 20.434 7.884 6.089 1.00 0.00 H new ATOM 0 HH11 ARG B 18 18.912 5.146 7.714 1.00 0.00 H new ATOM 0 HH12 ARG B 18 20.448 4.338 8.042 1.00 0.00 H new ATOM 0 HH21 ARG B 18 22.405 6.839 6.512 1.00 0.00 H new ATOM 0 HH22 ARG B 18 22.417 5.292 7.365 1.00 0.00 H new ATOM 531 N ASN B 19 13.749 7.785 4.515 1.00 0.00 N ATOM 532 CA ASN B 19 12.598 7.299 5.267 1.00 0.00 C ATOM 533 C ASN B 19 12.151 5.929 4.773 1.00 0.00 C ATOM 534 O ASN B 19 11.342 5.825 3.849 1.00 0.00 O ATOM 535 CB ASN B 19 11.440 8.292 5.158 1.00 0.00 C ATOM 536 CG ASN B 19 11.847 9.701 5.543 1.00 0.00 C ATOM 537 OD1 ASN B 19 12.766 9.898 6.338 1.00 0.00 O ATOM 538 ND2 ASN B 19 11.163 10.690 4.979 1.00 0.00 N ATOM 0 H ASN B 19 13.655 7.708 3.502 1.00 0.00 H new ATOM 0 HA ASN B 19 12.897 7.204 6.311 1.00 0.00 H new ATOM 0 HB2 ASN B 19 11.061 8.293 4.136 1.00 0.00 H new ATOM 0 HB3 ASN B 19 10.623 7.965 5.801 1.00 0.00 H new ATOM 0 HD21 ASN B 19 11.392 11.659 5.200 1.00 0.00 H new ATOM 0 HD22 ASN B 19 10.409 10.480 4.325 1.00 0.00 H new ATOM 545 N LYS B 20 12.671 4.879 5.401 1.00 0.00 N ATOM 546 CA LYS B 20 12.280 3.522 5.050 1.00 0.00 C ATOM 547 C LYS B 20 11.650 2.822 6.248 1.00 0.00 C ATOM 548 O LYS B 20 11.467 3.428 7.304 1.00 0.00 O ATOM 549 CB LYS B 20 13.471 2.711 4.540 1.00 0.00 C ATOM 550 CG LYS B 20 14.783 3.067 5.205 1.00 0.00 C ATOM 551 CD LYS B 20 15.547 4.087 4.385 1.00 0.00 C ATOM 552 CE LYS B 20 16.750 3.462 3.700 1.00 0.00 C ATOM 553 NZ LYS B 20 17.911 3.331 4.624 1.00 0.00 N ATOM 0 H LYS B 20 13.360 4.943 6.151 1.00 0.00 H new ATOM 0 HA LYS B 20 11.546 3.588 4.247 1.00 0.00 H new ATOM 0 HB2 LYS B 20 13.271 1.651 4.697 1.00 0.00 H new ATOM 0 HB3 LYS B 20 13.567 2.861 3.465 1.00 0.00 H new ATOM 0 HG2 LYS B 20 14.594 3.465 6.202 1.00 0.00 H new ATOM 0 HG3 LYS B 20 15.387 2.169 5.330 1.00 0.00 H new ATOM 0 HD2 LYS B 20 14.886 4.522 3.636 1.00 0.00 H new ATOM 0 HD3 LYS B 20 15.877 4.901 5.030 1.00 0.00 H new ATOM 0 HE2 LYS B 20 16.479 2.478 3.317 1.00 0.00 H new ATOM 0 HE3 LYS B 20 17.036 4.071 2.842 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 18.711 2.900 4.118 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 18.187 4.272 4.970 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 17.647 2.729 5.430 1.00 0.00 H new ATOM 567 N PHE B 21 11.325 1.544 6.085 1.00 0.00 N ATOM 568 CA PHE B 21 10.706 0.777 7.157 1.00 0.00 C ATOM 569 C PHE B 21 11.008 -0.711 7.018 1.00 0.00 C ATOM 570 O PHE B 21 10.623 -1.344 6.035 1.00 0.00 O ATOM 571 CB PHE B 21 9.197 1.011 7.160 1.00 0.00 C ATOM 572 CG PHE B 21 8.825 2.463 7.239 1.00 0.00 C ATOM 573 CD1 PHE B 21 9.042 3.187 8.400 1.00 0.00 C ATOM 574 CD2 PHE B 21 8.280 3.108 6.143 1.00 0.00 C ATOM 575 CE1 PHE B 21 8.709 4.527 8.468 1.00 0.00 C ATOM 576 CE2 PHE B 21 7.941 4.444 6.206 1.00 0.00 C ATOM 577 CZ PHE B 21 8.158 5.155 7.369 1.00 0.00 C ATOM 0 H PHE B 21 11.480 1.020 5.224 1.00 0.00 H new ATOM 0 HA PHE B 21 11.125 1.117 8.104 1.00 0.00 H new ATOM 0 HB2 PHE B 21 8.767 0.581 6.255 1.00 0.00 H new ATOM 0 HB3 PHE B 21 8.755 0.483 8.005 1.00 0.00 H new ATOM 0 HD1 PHE B 21 9.476 2.700 9.261 1.00 0.00 H new ATOM 0 HD2 PHE B 21 8.118 2.559 5.227 1.00 0.00 H new ATOM 0 HE1 PHE B 21 8.880 5.081 9.379 1.00 0.00 H new ATOM 0 HE2 PHE B 21 7.506 4.933 5.347 1.00 0.00 H new ATOM 0 HZ PHE B 21 7.897 6.202 7.419 1.00 0.00 H new ATOM 587 N LYS B 22 11.698 -1.261 8.011 1.00 0.00 N ATOM 588 CA LYS B 22 12.052 -2.675 8.008 1.00 0.00 C ATOM 589 C LYS B 22 10.805 -3.549 7.944 1.00 0.00 C ATOM 590 O LYS B 22 10.317 -4.027 8.968 1.00 0.00 O ATOM 591 CB LYS B 22 12.862 -3.016 9.261 1.00 0.00 C ATOM 592 CG LYS B 22 13.652 -4.310 9.144 1.00 0.00 C ATOM 593 CD LYS B 22 14.353 -4.659 10.448 1.00 0.00 C ATOM 594 CE LYS B 22 15.169 -3.490 10.977 1.00 0.00 C ATOM 595 NZ LYS B 22 16.008 -3.880 12.144 1.00 0.00 N ATOM 0 H LYS B 22 12.024 -0.748 8.830 1.00 0.00 H new ATOM 0 HA LYS B 22 12.656 -2.873 7.123 1.00 0.00 H new ATOM 0 HB2 LYS B 22 13.551 -2.198 9.472 1.00 0.00 H new ATOM 0 HB3 LYS B 22 12.185 -3.090 10.112 1.00 0.00 H new ATOM 0 HG2 LYS B 22 12.981 -5.122 8.862 1.00 0.00 H new ATOM 0 HG3 LYS B 22 14.390 -4.215 8.348 1.00 0.00 H new ATOM 0 HD2 LYS B 22 13.613 -4.953 11.192 1.00 0.00 H new ATOM 0 HD3 LYS B 22 15.006 -5.518 10.292 1.00 0.00 H new ATOM 0 HE2 LYS B 22 15.809 -3.105 10.183 1.00 0.00 H new ATOM 0 HE3 LYS B 22 14.498 -2.681 11.266 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 16.548 -3.055 12.474 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 15.396 -4.223 12.912 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 16.666 -4.634 11.862 1.00 0.00 H new ATOM 609 N VAL B 23 10.292 -3.751 6.736 1.00 0.00 N ATOM 610 CA VAL B 23 9.101 -4.566 6.539 1.00 0.00 C ATOM 611 C VAL B 23 9.469 -6.009 6.216 1.00 0.00 C ATOM 612 O VAL B 23 10.424 -6.270 5.484 1.00 0.00 O ATOM 613 CB VAL B 23 8.214 -4.007 5.412 1.00 0.00 C ATOM 614 CG1 VAL B 23 7.643 -2.652 5.803 1.00 0.00 C ATOM 615 CG2 VAL B 23 8.998 -3.908 4.115 1.00 0.00 C ATOM 0 H VAL B 23 10.683 -3.361 5.878 1.00 0.00 H new ATOM 0 HA VAL B 23 8.542 -4.538 7.475 1.00 0.00 H new ATOM 0 HB VAL B 23 7.382 -4.694 5.255 1.00 0.00 H new ATOM 0 HG11 VAL B 23 7.019 -2.273 4.994 1.00 0.00 H new ATOM 0 HG12 VAL B 23 7.042 -2.757 6.706 1.00 0.00 H new ATOM 0 HG13 VAL B 23 8.459 -1.954 5.990 1.00 0.00 H new ATOM 0 HG21 VAL B 23 8.354 -3.511 3.330 1.00 0.00 H new ATOM 0 HG22 VAL B 23 9.851 -3.244 4.255 1.00 0.00 H new ATOM 0 HG23 VAL B 23 9.352 -4.898 3.827 1.00 0.00 H new ATOM 625 N ILE B 24 8.712 -6.943 6.779 1.00 0.00 N ATOM 626 CA ILE B 24 8.947 -8.362 6.553 1.00 0.00 C ATOM 627 C ILE B 24 8.173 -8.842 5.333 1.00 0.00 C ATOM 628 O ILE B 24 6.967 -8.632 5.233 1.00 0.00 O ATOM 629 CB ILE B 24 8.532 -9.198 7.784 1.00 0.00 C ATOM 630 CG1 ILE B 24 9.426 -8.856 8.981 1.00 0.00 C ATOM 631 CG2 ILE B 24 8.584 -10.696 7.483 1.00 0.00 C ATOM 632 CD1 ILE B 24 9.314 -9.840 10.126 1.00 0.00 C ATOM 0 H ILE B 24 7.927 -6.741 7.398 1.00 0.00 H new ATOM 0 HA ILE B 24 10.015 -8.496 6.381 1.00 0.00 H new ATOM 0 HB ILE B 24 7.501 -8.947 8.032 1.00 0.00 H new ATOM 0 HG12 ILE B 24 10.463 -8.816 8.649 1.00 0.00 H new ATOM 0 HG13 ILE B 24 9.168 -7.861 9.343 1.00 0.00 H new ATOM 0 HG21 ILE B 24 8.286 -11.256 8.370 1.00 0.00 H new ATOM 0 HG22 ILE B 24 7.904 -10.926 6.663 1.00 0.00 H new ATOM 0 HG23 ILE B 24 9.599 -10.975 7.201 1.00 0.00 H new ATOM 0 HD11 ILE B 24 9.975 -9.532 10.936 1.00 0.00 H new ATOM 0 HD12 ILE B 24 8.286 -9.864 10.486 1.00 0.00 H new ATOM 0 HD13 ILE B 24 9.601 -10.834 9.781 1.00 0.00 H new ATOM 644 N ASN B 25 8.867 -9.499 4.417 1.00 0.00 N ATOM 645 CA ASN B 25 8.220 -10.038 3.229 1.00 0.00 C ATOM 646 C ASN B 25 7.529 -11.352 3.569 1.00 0.00 C ATOM 647 O ASN B 25 8.185 -12.365 3.800 1.00 0.00 O ATOM 648 CB ASN B 25 9.238 -10.239 2.102 1.00 0.00 C ATOM 649 CG ASN B 25 10.220 -11.354 2.397 1.00 0.00 C ATOM 650 OD1 ASN B 25 10.498 -11.661 3.556 1.00 0.00 O ATOM 651 ND2 ASN B 25 10.755 -11.965 1.347 1.00 0.00 N ATOM 0 H ASN B 25 9.871 -9.672 4.471 1.00 0.00 H new ATOM 0 HA ASN B 25 7.472 -9.325 2.882 1.00 0.00 H new ATOM 0 HB2 ASN B 25 8.709 -10.461 1.175 1.00 0.00 H new ATOM 0 HB3 ASN B 25 9.786 -9.310 1.942 1.00 0.00 H new ATOM 0 HD21 ASN B 25 11.425 -12.722 1.484 1.00 0.00 H new ATOM 0 HD22 ASN B 25 10.496 -11.678 0.403 1.00 0.00 H new ATOM 658 N VAL B 26 6.203 -11.312 3.662 1.00 0.00 N ATOM 659 CA VAL B 26 5.428 -12.493 4.025 1.00 0.00 C ATOM 660 C VAL B 26 4.768 -13.126 2.806 1.00 0.00 C ATOM 661 O VAL B 26 4.538 -12.462 1.795 1.00 0.00 O ATOM 662 CB VAL B 26 4.344 -12.153 5.066 1.00 0.00 C ATOM 663 CG1 VAL B 26 4.980 -11.756 6.385 1.00 0.00 C ATOM 664 CG2 VAL B 26 3.438 -11.043 4.564 1.00 0.00 C ATOM 0 H VAL B 26 5.644 -10.476 3.491 1.00 0.00 H new ATOM 0 HA VAL B 26 6.130 -13.206 4.458 1.00 0.00 H new ATOM 0 HB VAL B 26 3.737 -13.044 5.224 1.00 0.00 H new ATOM 0 HG11 VAL B 26 4.200 -11.519 7.108 1.00 0.00 H new ATOM 0 HG12 VAL B 26 5.585 -12.582 6.760 1.00 0.00 H new ATOM 0 HG13 VAL B 26 5.613 -10.882 6.235 1.00 0.00 H new ATOM 0 HG21 VAL B 26 2.682 -10.822 5.317 1.00 0.00 H new ATOM 0 HG22 VAL B 26 4.031 -10.149 4.372 1.00 0.00 H new ATOM 0 HG23 VAL B 26 2.950 -11.360 3.642 1.00 0.00 H new ATOM 674 N ASP B 27 4.465 -14.416 2.913 1.00 0.00 N ATOM 675 CA ASP B 27 3.829 -15.150 1.826 1.00 0.00 C ATOM 676 C ASP B 27 2.317 -15.205 2.019 1.00 0.00 C ATOM 677 O ASP B 27 1.772 -14.560 2.915 1.00 0.00 O ATOM 678 CB ASP B 27 4.399 -16.569 1.746 1.00 0.00 C ATOM 679 CG ASP B 27 4.258 -17.324 3.053 1.00 0.00 C ATOM 680 OD1 ASP B 27 3.718 -16.744 4.018 1.00 0.00 O ATOM 681 OD2 ASP B 27 4.688 -18.495 3.112 1.00 0.00 O ATOM 0 H ASP B 27 4.651 -14.976 3.745 1.00 0.00 H new ATOM 0 HA ASP B 27 4.037 -14.627 0.892 1.00 0.00 H new ATOM 0 HB2 ASP B 27 3.888 -17.119 0.955 1.00 0.00 H new ATOM 0 HB3 ASP B 27 5.452 -16.519 1.470 1.00 0.00 H new ATOM 686 N ASP B 28 1.643 -15.986 1.178 1.00 0.00 N ATOM 687 CA ASP B 28 0.191 -16.125 1.249 1.00 0.00 C ATOM 688 C ASP B 28 -0.278 -16.330 2.688 1.00 0.00 C ATOM 689 O ASP B 28 -1.025 -15.515 3.229 1.00 0.00 O ATOM 690 CB ASP B 28 -0.268 -17.299 0.382 1.00 0.00 C ATOM 691 CG ASP B 28 -1.706 -17.154 -0.075 1.00 0.00 C ATOM 692 OD1 ASP B 28 -2.219 -16.016 -0.069 1.00 0.00 O ATOM 693 OD2 ASP B 28 -2.319 -18.180 -0.439 1.00 0.00 O ATOM 0 H ASP B 28 2.081 -16.534 0.437 1.00 0.00 H new ATOM 0 HA ASP B 28 -0.252 -15.202 0.875 1.00 0.00 H new ATOM 0 HB2 ASP B 28 0.381 -17.378 -0.490 1.00 0.00 H new ATOM 0 HB3 ASP B 28 -0.160 -18.226 0.945 1.00 0.00 H new ATOM 698 N ASP B 29 0.165 -17.423 3.302 1.00 0.00 N ATOM 699 CA ASP B 29 -0.213 -17.732 4.676 1.00 0.00 C ATOM 700 C ASP B 29 0.157 -16.587 5.613 1.00 0.00 C ATOM 701 O ASP B 29 -0.671 -16.122 6.397 1.00 0.00 O ATOM 702 CB ASP B 29 0.468 -19.023 5.137 1.00 0.00 C ATOM 703 CG ASP B 29 -0.515 -20.019 5.720 1.00 0.00 C ATOM 704 OD1 ASP B 29 -1.438 -19.589 6.444 1.00 0.00 O ATOM 705 OD2 ASP B 29 -0.361 -21.230 5.454 1.00 0.00 O ATOM 0 H ASP B 29 0.785 -18.108 2.870 1.00 0.00 H new ATOM 0 HA ASP B 29 -1.294 -17.868 4.707 1.00 0.00 H new ATOM 0 HB2 ASP B 29 0.985 -19.479 4.293 1.00 0.00 H new ATOM 0 HB3 ASP B 29 1.225 -18.784 5.884 1.00 0.00 H new ATOM 710 N GLY B 30 1.405 -16.137 5.528 1.00 0.00 N ATOM 711 CA GLY B 30 1.860 -15.049 6.374 1.00 0.00 C ATOM 712 C GLY B 30 2.744 -15.527 7.509 1.00 0.00 C ATOM 713 O GLY B 30 2.554 -15.136 8.660 1.00 0.00 O ATOM 0 H GLY B 30 2.109 -16.506 4.889 1.00 0.00 H new ATOM 0 HA2 GLY B 30 2.409 -14.328 5.769 1.00 0.00 H new ATOM 0 HA3 GLY B 30 0.996 -14.527 6.786 1.00 0.00 H new ATOM 717 N ASN B 31 3.716 -16.374 7.184 1.00 0.00 N ATOM 718 CA ASN B 31 4.630 -16.908 8.187 1.00 0.00 C ATOM 719 C ASN B 31 6.019 -16.291 8.050 1.00 0.00 C ATOM 720 O ASN B 31 7.011 -16.878 8.481 1.00 0.00 O ATOM 721 CB ASN B 31 4.723 -18.430 8.061 1.00 0.00 C ATOM 722 CG ASN B 31 4.863 -19.115 9.406 1.00 0.00 C ATOM 723 OD1 ASN B 31 4.688 -18.493 10.454 1.00 0.00 O ATOM 724 ND2 ASN B 31 5.179 -20.405 9.384 1.00 0.00 N ATOM 0 H ASN B 31 3.891 -16.705 6.235 1.00 0.00 H new ATOM 0 HA ASN B 31 4.236 -16.652 9.171 1.00 0.00 H new ATOM 0 HB2 ASN B 31 3.832 -18.805 7.557 1.00 0.00 H new ATOM 0 HB3 ASN B 31 5.577 -18.688 7.434 1.00 0.00 H new ATOM 0 HD21 ASN B 31 5.286 -20.919 10.259 1.00 0.00 H new ATOM 0 HD22 ASN B 31 5.315 -20.882 8.493 1.00 0.00 H new ATOM 731 N GLU B 32 6.082 -15.108 7.445 1.00 0.00 N ATOM 732 CA GLU B 32 7.347 -14.411 7.259 1.00 0.00 C ATOM 733 C GLU B 32 8.315 -15.232 6.412 1.00 0.00 C ATOM 734 O GLU B 32 8.400 -16.452 6.550 1.00 0.00 O ATOM 735 CB GLU B 32 7.981 -14.105 8.616 1.00 0.00 C ATOM 736 CG GLU B 32 7.020 -13.468 9.606 1.00 0.00 C ATOM 737 CD GLU B 32 7.067 -14.125 10.972 1.00 0.00 C ATOM 738 OE1 GLU B 32 8.152 -14.129 11.591 1.00 0.00 O ATOM 739 OE2 GLU B 32 6.019 -14.633 11.422 1.00 0.00 O ATOM 0 H GLU B 32 5.270 -14.613 7.076 1.00 0.00 H new ATOM 0 HA GLU B 32 7.141 -13.479 6.733 1.00 0.00 H new ATOM 0 HB2 GLU B 32 8.370 -15.030 9.043 1.00 0.00 H new ATOM 0 HB3 GLU B 32 8.832 -13.440 8.469 1.00 0.00 H new ATOM 0 HG2 GLU B 32 7.259 -12.409 9.708 1.00 0.00 H new ATOM 0 HG3 GLU B 32 6.005 -13.530 9.212 1.00 0.00 H new ATOM 746 N LEU B 33 9.051 -14.551 5.541 1.00 0.00 N ATOM 747 CA LEU B 33 10.033 -15.208 4.686 1.00 0.00 C ATOM 748 C LEU B 33 11.436 -14.737 5.038 1.00 0.00 C ATOM 749 O LEU B 33 12.310 -15.534 5.379 1.00 0.00 O ATOM 750 CB LEU B 33 9.740 -14.908 3.215 1.00 0.00 C ATOM 751 CG LEU B 33 8.258 -14.864 2.846 1.00 0.00 C ATOM 752 CD1 LEU B 33 8.031 -13.945 1.656 1.00 0.00 C ATOM 753 CD2 LEU B 33 7.747 -16.261 2.547 1.00 0.00 C ATOM 0 H LEU B 33 8.986 -13.542 5.408 1.00 0.00 H new ATOM 0 HA LEU B 33 9.968 -16.284 4.848 1.00 0.00 H new ATOM 0 HB2 LEU B 33 10.191 -13.949 2.959 1.00 0.00 H new ATOM 0 HB3 LEU B 33 10.229 -15.665 2.601 1.00 0.00 H new ATOM 0 HG LEU B 33 7.701 -14.467 3.695 1.00 0.00 H new ATOM 0 HD11 LEU B 33 6.970 -13.926 1.408 1.00 0.00 H new ATOM 0 HD12 LEU B 33 8.363 -12.937 1.906 1.00 0.00 H new ATOM 0 HD13 LEU B 33 8.597 -14.312 0.800 1.00 0.00 H new ATOM 0 HD21 LEU B 33 6.690 -16.214 2.286 1.00 0.00 H new ATOM 0 HD22 LEU B 33 8.308 -16.683 1.713 1.00 0.00 H new ATOM 0 HD23 LEU B 33 7.875 -16.891 3.427 1.00 0.00 H new ATOM 765 N GLY B 34 11.635 -13.428 4.961 1.00 0.00 N ATOM 766 CA GLY B 34 12.922 -12.847 5.286 1.00 0.00 C ATOM 767 C GLY B 34 12.782 -11.521 6.006 1.00 0.00 C ATOM 768 O GLY B 34 12.386 -11.478 7.170 1.00 0.00 O ATOM 0 H GLY B 34 10.923 -12.755 4.677 1.00 0.00 H new ATOM 0 HA2 GLY B 34 13.485 -13.541 5.910 1.00 0.00 H new ATOM 0 HA3 GLY B 34 13.496 -12.703 4.371 1.00 0.00 H new ATOM 772 N SER B 35 13.099 -10.433 5.308 1.00 0.00 N ATOM 773 CA SER B 35 12.994 -9.090 5.878 1.00 0.00 C ATOM 774 C SER B 35 13.698 -8.074 4.983 1.00 0.00 C ATOM 775 O SER B 35 14.891 -8.199 4.706 1.00 0.00 O ATOM 776 CB SER B 35 13.584 -9.056 7.299 1.00 0.00 C ATOM 777 OG SER B 35 14.314 -7.864 7.539 1.00 0.00 O ATOM 0 H SER B 35 13.432 -10.454 4.344 1.00 0.00 H new ATOM 0 HA SER B 35 11.939 -8.825 5.939 1.00 0.00 H new ATOM 0 HB2 SER B 35 12.779 -9.142 8.029 1.00 0.00 H new ATOM 0 HB3 SER B 35 14.237 -9.917 7.442 1.00 0.00 H new ATOM 0 HG SER B 35 14.672 -7.878 8.451 1.00 0.00 H new ATOM 783 N GLY B 36 12.952 -7.071 4.531 1.00 0.00 N ATOM 784 CA GLY B 36 13.525 -6.052 3.673 1.00 0.00 C ATOM 785 C GLY B 36 13.238 -4.649 4.169 1.00 0.00 C ATOM 786 O GLY B 36 12.382 -4.451 5.031 1.00 0.00 O ATOM 0 H GLY B 36 11.962 -6.946 4.744 1.00 0.00 H new ATOM 0 HA2 GLY B 36 14.603 -6.198 3.610 1.00 0.00 H new ATOM 0 HA3 GLY B 36 13.128 -6.166 2.664 1.00 0.00 H new ATOM 790 N ILE B 37 13.957 -3.672 3.627 1.00 0.00 N ATOM 791 CA ILE B 37 13.770 -2.281 4.020 1.00 0.00 C ATOM 792 C ILE B 37 12.912 -1.541 2.997 1.00 0.00 C ATOM 793 O ILE B 37 13.361 -1.241 1.891 1.00 0.00 O ATOM 794 CB ILE B 37 15.130 -1.559 4.201 1.00 0.00 C ATOM 795 CG1 ILE B 37 15.845 -2.104 5.435 1.00 0.00 C ATOM 796 CG2 ILE B 37 14.958 -0.048 4.326 1.00 0.00 C ATOM 797 CD1 ILE B 37 15.135 -1.788 6.733 1.00 0.00 C ATOM 0 H ILE B 37 14.673 -3.818 2.916 1.00 0.00 H new ATOM 0 HA ILE B 37 13.253 -2.276 4.980 1.00 0.00 H new ATOM 0 HB ILE B 37 15.730 -1.752 3.312 1.00 0.00 H new ATOM 0 HG12 ILE B 37 15.945 -3.185 5.339 1.00 0.00 H new ATOM 0 HG13 ILE B 37 16.854 -1.692 5.472 1.00 0.00 H new ATOM 0 HG21 ILE B 37 15.934 0.420 4.451 1.00 0.00 H new ATOM 0 HG22 ILE B 37 14.483 0.340 3.425 1.00 0.00 H new ATOM 0 HG23 ILE B 37 14.334 0.177 5.191 1.00 0.00 H new ATOM 0 HD11 ILE B 37 15.699 -2.205 7.567 1.00 0.00 H new ATOM 0 HD12 ILE B 37 15.058 -0.707 6.852 1.00 0.00 H new ATOM 0 HD13 ILE B 37 14.136 -2.223 6.717 1.00 0.00 H new ATOM 809 N MET B 38 11.676 -1.249 3.383 1.00 0.00 N ATOM 810 CA MET B 38 10.761 -0.514 2.520 1.00 0.00 C ATOM 811 C MET B 38 11.159 0.948 2.472 1.00 0.00 C ATOM 812 O MET B 38 11.265 1.597 3.507 1.00 0.00 O ATOM 813 CB MET B 38 9.318 -0.648 3.021 1.00 0.00 C ATOM 814 CG MET B 38 8.316 0.259 2.309 1.00 0.00 C ATOM 815 SD MET B 38 8.599 0.382 0.536 1.00 0.00 S ATOM 816 CE MET B 38 7.629 -1.010 -0.013 1.00 0.00 C ATOM 0 H MET B 38 11.285 -1.510 4.288 1.00 0.00 H new ATOM 0 HA MET B 38 10.818 -0.935 1.516 1.00 0.00 H new ATOM 0 HB2 MET B 38 9.000 -1.684 2.903 1.00 0.00 H new ATOM 0 HB3 MET B 38 9.295 -0.427 4.088 1.00 0.00 H new ATOM 0 HG2 MET B 38 7.308 -0.118 2.483 1.00 0.00 H new ATOM 0 HG3 MET B 38 8.364 1.256 2.747 1.00 0.00 H new ATOM 0 HE1 MET B 38 8.085 -1.443 -0.903 1.00 0.00 H new ATOM 0 HE2 MET B 38 7.590 -1.761 0.776 1.00 0.00 H new ATOM 0 HE3 MET B 38 6.618 -0.679 -0.248 1.00 0.00 H new ATOM 826 N GLU B 39 11.413 1.455 1.273 1.00 0.00 N ATOM 827 CA GLU B 39 11.843 2.830 1.122 1.00 0.00 C ATOM 828 C GLU B 39 10.853 3.639 0.303 1.00 0.00 C ATOM 829 O GLU B 39 10.412 3.216 -0.767 1.00 0.00 O ATOM 830 CB GLU B 39 13.229 2.889 0.478 1.00 0.00 C ATOM 831 CG GLU B 39 14.034 4.113 0.882 1.00 0.00 C ATOM 832 CD GLU B 39 14.899 4.640 -0.245 1.00 0.00 C ATOM 833 OE1 GLU B 39 14.841 4.069 -1.353 1.00 0.00 O ATOM 834 OE2 GLU B 39 15.634 5.625 -0.020 1.00 0.00 O ATOM 0 H GLU B 39 11.328 0.936 0.399 1.00 0.00 H new ATOM 0 HA GLU B 39 11.893 3.270 2.118 1.00 0.00 H new ATOM 0 HB2 GLU B 39 13.786 1.992 0.750 1.00 0.00 H new ATOM 0 HB3 GLU B 39 13.118 2.879 -0.606 1.00 0.00 H new ATOM 0 HG2 GLU B 39 13.353 4.899 1.210 1.00 0.00 H new ATOM 0 HG3 GLU B 39 14.666 3.862 1.734 1.00 0.00 H new ATOM 841 N LEU B 40 10.520 4.814 0.816 1.00 0.00 N ATOM 842 CA LEU B 40 9.577 5.699 0.157 1.00 0.00 C ATOM 843 C LEU B 40 10.241 7.024 -0.191 1.00 0.00 C ATOM 844 O LEU B 40 9.912 8.066 0.377 1.00 0.00 O ATOM 845 CB LEU B 40 8.371 5.923 1.065 1.00 0.00 C ATOM 846 CG LEU B 40 7.954 4.694 1.874 1.00 0.00 C ATOM 847 CD1 LEU B 40 8.724 4.624 3.183 1.00 0.00 C ATOM 848 CD2 LEU B 40 6.459 4.712 2.131 1.00 0.00 C ATOM 0 H LEU B 40 10.893 5.177 1.693 1.00 0.00 H new ATOM 0 HA LEU B 40 9.242 5.238 -0.772 1.00 0.00 H new ATOM 0 HB2 LEU B 40 8.596 6.737 1.754 1.00 0.00 H new ATOM 0 HB3 LEU B 40 7.527 6.245 0.455 1.00 0.00 H new ATOM 0 HG LEU B 40 8.193 3.803 1.293 1.00 0.00 H new ATOM 0 HD11 LEU B 40 8.411 3.742 3.742 1.00 0.00 H new ATOM 0 HD12 LEU B 40 9.792 4.561 2.974 1.00 0.00 H new ATOM 0 HD13 LEU B 40 8.521 5.518 3.773 1.00 0.00 H new ATOM 0 HD21 LEU B 40 6.178 3.831 2.708 1.00 0.00 H new ATOM 0 HD22 LEU B 40 6.197 5.610 2.690 1.00 0.00 H new ATOM 0 HD23 LEU B 40 5.926 4.708 1.180 1.00 0.00 H new ATOM 860 N THR B 41 11.197 6.965 -1.112 1.00 0.00 N ATOM 861 CA THR B 41 11.931 8.150 -1.536 1.00 0.00 C ATOM 862 C THR B 41 10.981 9.250 -1.991 1.00 0.00 C ATOM 863 O THR B 41 9.772 9.174 -1.772 1.00 0.00 O ATOM 864 CB THR B 41 12.895 7.800 -2.674 1.00 0.00 C ATOM 865 OG1 THR B 41 12.197 7.683 -3.901 1.00 0.00 O ATOM 866 CG2 THR B 41 13.650 6.509 -2.448 1.00 0.00 C ATOM 0 H THR B 41 11.482 6.105 -1.580 1.00 0.00 H new ATOM 0 HA THR B 41 12.499 8.514 -0.680 1.00 0.00 H new ATOM 0 HB THR B 41 13.615 8.618 -2.704 1.00 0.00 H new ATOM 0 HG1 THR B 41 12.674 8.181 -4.597 1.00 0.00 H new ATOM 0 HG21 THR B 41 14.314 6.323 -3.292 1.00 0.00 H new ATOM 0 HG22 THR B 41 14.239 6.587 -1.534 1.00 0.00 H new ATOM 0 HG23 THR B 41 12.942 5.685 -2.355 1.00 0.00 H new ATOM 874 N ASP B 42 11.538 10.268 -2.633 1.00 0.00 N ATOM 875 CA ASP B 42 10.744 11.383 -3.129 1.00 0.00 C ATOM 876 C ASP B 42 9.899 10.969 -4.333 1.00 0.00 C ATOM 877 O ASP B 42 8.956 11.667 -4.705 1.00 0.00 O ATOM 878 CB ASP B 42 11.655 12.550 -3.511 1.00 0.00 C ATOM 879 CG ASP B 42 12.511 13.019 -2.350 1.00 0.00 C ATOM 880 OD1 ASP B 42 13.276 12.195 -1.806 1.00 0.00 O ATOM 881 OD2 ASP B 42 12.416 14.209 -1.984 1.00 0.00 O ATOM 0 H ASP B 42 12.537 10.344 -2.822 1.00 0.00 H new ATOM 0 HA ASP B 42 10.071 11.696 -2.331 1.00 0.00 H new ATOM 0 HB2 ASP B 42 12.300 12.249 -4.336 1.00 0.00 H new ATOM 0 HB3 ASP B 42 11.046 13.380 -3.869 1.00 0.00 H new ATOM 886 N THR B 43 10.238 9.832 -4.941 1.00 0.00 N ATOM 887 CA THR B 43 9.505 9.350 -6.105 1.00 0.00 C ATOM 888 C THR B 43 9.799 7.875 -6.384 1.00 0.00 C ATOM 889 O THR B 43 10.175 7.517 -7.500 1.00 0.00 O ATOM 890 CB THR B 43 9.866 10.186 -7.335 1.00 0.00 C ATOM 891 OG1 THR B 43 11.220 10.600 -7.279 1.00 0.00 O ATOM 892 CG2 THR B 43 9.011 11.425 -7.492 1.00 0.00 C ATOM 0 H THR B 43 11.010 9.234 -4.647 1.00 0.00 H new ATOM 0 HA THR B 43 8.441 9.450 -5.891 1.00 0.00 H new ATOM 0 HB THR B 43 9.687 9.534 -8.190 1.00 0.00 H new ATOM 0 HG1 THR B 43 11.433 11.132 -8.074 1.00 0.00 H new ATOM 0 HG21 THR B 43 9.321 11.970 -8.383 1.00 0.00 H new ATOM 0 HG22 THR B 43 7.965 11.135 -7.589 1.00 0.00 H new ATOM 0 HG23 THR B 43 9.131 12.063 -6.616 1.00 0.00 H new ATOM 900 N GLU B 44 9.612 7.016 -5.379 1.00 0.00 N ATOM 901 CA GLU B 44 9.869 5.588 -5.557 1.00 0.00 C ATOM 902 C GLU B 44 9.629 4.784 -4.277 1.00 0.00 C ATOM 903 O GLU B 44 10.013 5.201 -3.185 1.00 0.00 O ATOM 904 CB GLU B 44 11.313 5.377 -6.021 1.00 0.00 C ATOM 905 CG GLU B 44 11.478 4.234 -7.009 1.00 0.00 C ATOM 906 CD GLU B 44 11.134 4.635 -8.430 1.00 0.00 C ATOM 907 OE1 GLU B 44 11.492 5.762 -8.832 1.00 0.00 O ATOM 908 OE2 GLU B 44 10.506 3.822 -9.140 1.00 0.00 O ATOM 0 H GLU B 44 9.289 7.280 -4.448 1.00 0.00 H new ATOM 0 HA GLU B 44 9.168 5.228 -6.310 1.00 0.00 H new ATOM 0 HB2 GLU B 44 11.676 6.297 -6.480 1.00 0.00 H new ATOM 0 HB3 GLU B 44 11.940 5.186 -5.150 1.00 0.00 H new ATOM 0 HG2 GLU B 44 12.507 3.876 -6.976 1.00 0.00 H new ATOM 0 HG3 GLU B 44 10.841 3.403 -6.706 1.00 0.00 H new ATOM 915 N LEU B 45 9.029 3.603 -4.439 1.00 0.00 N ATOM 916 CA LEU B 45 8.807 2.679 -3.324 1.00 0.00 C ATOM 917 C LEU B 45 9.860 1.572 -3.377 1.00 0.00 C ATOM 918 O LEU B 45 9.552 0.426 -3.699 1.00 0.00 O ATOM 919 CB LEU B 45 7.400 2.059 -3.404 1.00 0.00 C ATOM 920 CG LEU B 45 6.549 2.137 -2.134 1.00 0.00 C ATOM 921 CD1 LEU B 45 6.151 3.551 -1.841 1.00 0.00 C ATOM 922 CD2 LEU B 45 5.305 1.290 -2.284 1.00 0.00 C ATOM 0 H LEU B 45 8.686 3.262 -5.337 1.00 0.00 H new ATOM 0 HA LEU B 45 8.888 3.228 -2.386 1.00 0.00 H new ATOM 0 HB2 LEU B 45 6.856 2.550 -4.211 1.00 0.00 H new ATOM 0 HB3 LEU B 45 7.504 1.010 -3.682 1.00 0.00 H new ATOM 0 HG LEU B 45 7.150 1.761 -1.306 1.00 0.00 H new ATOM 0 HD11 LEU B 45 5.547 3.579 -0.934 1.00 0.00 H new ATOM 0 HD12 LEU B 45 7.045 4.159 -1.701 1.00 0.00 H new ATOM 0 HD13 LEU B 45 5.571 3.946 -2.675 1.00 0.00 H new ATOM 0 HD21 LEU B 45 4.709 1.355 -1.374 1.00 0.00 H new ATOM 0 HD22 LEU B 45 4.718 1.652 -3.128 1.00 0.00 H new ATOM 0 HD23 LEU B 45 5.590 0.252 -2.458 1.00 0.00 H new ATOM 934 N ILE B 46 11.117 1.934 -3.137 1.00 0.00 N ATOM 935 CA ILE B 46 12.212 0.971 -3.223 1.00 0.00 C ATOM 936 C ILE B 46 12.241 0.043 -2.020 1.00 0.00 C ATOM 937 O ILE B 46 12.651 0.428 -0.928 1.00 0.00 O ATOM 938 CB ILE B 46 13.577 1.668 -3.375 1.00 0.00 C ATOM 939 CG1 ILE B 46 13.577 2.546 -4.625 1.00 0.00 C ATOM 940 CG2 ILE B 46 14.699 0.642 -3.454 1.00 0.00 C ATOM 941 CD1 ILE B 46 14.519 3.720 -4.534 1.00 0.00 C ATOM 0 H ILE B 46 11.402 2.880 -2.883 1.00 0.00 H new ATOM 0 HA ILE B 46 12.027 0.375 -4.117 1.00 0.00 H new ATOM 0 HB ILE B 46 13.746 2.294 -2.499 1.00 0.00 H new ATOM 0 HG12 ILE B 46 13.850 1.937 -5.487 1.00 0.00 H new ATOM 0 HG13 ILE B 46 12.566 2.914 -4.801 1.00 0.00 H new ATOM 0 HG21 ILE B 46 15.655 1.155 -3.561 1.00 0.00 H new ATOM 0 HG22 ILE B 46 14.709 0.043 -2.543 1.00 0.00 H new ATOM 0 HG23 ILE B 46 14.538 -0.008 -4.314 1.00 0.00 H new ATOM 0 HD11 ILE B 46 14.468 4.300 -5.456 1.00 0.00 H new ATOM 0 HD12 ILE B 46 14.234 4.351 -3.692 1.00 0.00 H new ATOM 0 HD13 ILE B 46 15.537 3.359 -4.389 1.00 0.00 H new ATOM 953 N LEU B 47 11.838 -1.197 -2.252 1.00 0.00 N ATOM 954 CA LEU B 47 11.791 -2.202 -1.204 1.00 0.00 C ATOM 955 C LEU B 47 13.061 -3.046 -1.187 1.00 0.00 C ATOM 956 O LEU B 47 13.125 -4.103 -1.811 1.00 0.00 O ATOM 957 CB LEU B 47 10.570 -3.092 -1.419 1.00 0.00 C ATOM 958 CG LEU B 47 10.203 -3.993 -0.247 1.00 0.00 C ATOM 959 CD1 LEU B 47 10.179 -3.197 1.041 1.00 0.00 C ATOM 960 CD2 LEU B 47 8.854 -4.643 -0.489 1.00 0.00 C ATOM 0 H LEU B 47 11.536 -1.532 -3.167 1.00 0.00 H new ATOM 0 HA LEU B 47 11.717 -1.698 -0.240 1.00 0.00 H new ATOM 0 HB2 LEU B 47 9.715 -2.457 -1.649 1.00 0.00 H new ATOM 0 HB3 LEU B 47 10.747 -3.717 -2.294 1.00 0.00 H new ATOM 0 HG LEU B 47 10.957 -4.775 -0.158 1.00 0.00 H new ATOM 0 HD11 LEU B 47 9.915 -3.854 1.870 1.00 0.00 H new ATOM 0 HD12 LEU B 47 11.163 -2.765 1.220 1.00 0.00 H new ATOM 0 HD13 LEU B 47 9.441 -2.399 0.962 1.00 0.00 H new ATOM 0 HD21 LEU B 47 8.603 -5.285 0.355 1.00 0.00 H new ATOM 0 HD22 LEU B 47 8.092 -3.871 -0.598 1.00 0.00 H new ATOM 0 HD23 LEU B 47 8.896 -5.241 -1.399 1.00 0.00 H new ATOM 972 N TYR B 48 14.069 -2.571 -0.464 1.00 0.00 N ATOM 973 CA TYR B 48 15.335 -3.286 -0.354 1.00 0.00 C ATOM 974 C TYR B 48 15.110 -4.710 0.142 1.00 0.00 C ATOM 975 O TYR B 48 14.205 -4.963 0.936 1.00 0.00 O ATOM 976 CB TYR B 48 16.270 -2.549 0.604 1.00 0.00 C ATOM 977 CG TYR B 48 16.485 -1.097 0.248 1.00 0.00 C ATOM 978 CD1 TYR B 48 17.163 -0.737 -0.910 1.00 0.00 C ATOM 979 CD2 TYR B 48 16.014 -0.086 1.073 1.00 0.00 C ATOM 980 CE1 TYR B 48 17.362 0.591 -1.235 1.00 0.00 C ATOM 981 CE2 TYR B 48 16.209 1.244 0.756 1.00 0.00 C ATOM 982 CZ TYR B 48 16.883 1.578 -0.399 1.00 0.00 C ATOM 983 OH TYR B 48 17.080 2.901 -0.719 1.00 0.00 O ATOM 0 H TYR B 48 14.034 -1.694 0.055 1.00 0.00 H new ATOM 0 HA TYR B 48 15.791 -3.330 -1.343 1.00 0.00 H new ATOM 0 HB2 TYR B 48 15.863 -2.610 1.613 1.00 0.00 H new ATOM 0 HB3 TYR B 48 17.234 -3.057 0.618 1.00 0.00 H new ATOM 0 HD1 TYR B 48 17.540 -1.507 -1.566 1.00 0.00 H new ATOM 0 HD2 TYR B 48 15.486 -0.344 1.979 1.00 0.00 H new ATOM 0 HE1 TYR B 48 17.890 0.855 -2.139 1.00 0.00 H new ATOM 0 HE2 TYR B 48 15.835 2.018 1.410 1.00 0.00 H new ATOM 0 HH TYR B 48 16.336 3.218 -1.273 1.00 0.00 H new ATOM 993 N THR B 49 15.944 -5.636 -0.321 1.00 0.00 N ATOM 994 CA THR B 49 15.824 -7.033 0.082 1.00 0.00 C ATOM 995 C THR B 49 17.044 -7.842 -0.351 1.00 0.00 C ATOM 996 O THR B 49 17.576 -7.648 -1.444 1.00 0.00 O ATOM 997 CB THR B 49 14.549 -7.648 -0.505 1.00 0.00 C ATOM 998 OG1 THR B 49 14.678 -9.056 -0.620 1.00 0.00 O ATOM 999 CG2 THR B 49 14.187 -7.105 -1.872 1.00 0.00 C ATOM 0 H THR B 49 16.706 -5.446 -0.972 1.00 0.00 H new ATOM 0 HA THR B 49 15.767 -7.063 1.170 1.00 0.00 H new ATOM 0 HB THR B 49 13.755 -7.378 0.192 1.00 0.00 H new ATOM 0 HG1 THR B 49 14.535 -9.470 0.257 1.00 0.00 H new ATOM 0 HG21 THR B 49 13.274 -7.586 -2.224 1.00 0.00 H new ATOM 0 HG22 THR B 49 14.028 -6.029 -1.806 1.00 0.00 H new ATOM 0 HG23 THR B 49 14.998 -7.309 -2.571 1.00 0.00 H new ATOM 1007 N ARG B 50 17.478 -8.752 0.516 1.00 0.00 N ATOM 1008 CA ARG B 50 18.627 -9.604 0.229 1.00 0.00 C ATOM 1009 C ARG B 50 19.875 -8.778 -0.071 1.00 0.00 C ATOM 1010 O ARG B 50 20.816 -9.267 -0.696 1.00 0.00 O ATOM 1011 CB ARG B 50 18.320 -10.526 -0.953 1.00 0.00 C ATOM 1012 CG ARG B 50 18.859 -11.936 -0.779 1.00 0.00 C ATOM 1013 CD ARG B 50 20.322 -12.027 -1.183 1.00 0.00 C ATOM 1014 NE ARG B 50 21.217 -11.850 -0.044 1.00 0.00 N ATOM 1015 CZ ARG B 50 22.489 -12.238 -0.040 1.00 0.00 C ATOM 1016 NH1 ARG B 50 23.010 -12.823 -1.110 1.00 0.00 N ATOM 1017 NH2 ARG B 50 23.239 -12.042 1.035 1.00 0.00 N ATOM 0 H ARG B 50 17.049 -8.919 1.426 1.00 0.00 H new ATOM 0 HA ARG B 50 18.823 -10.205 1.117 1.00 0.00 H new ATOM 0 HB2 ARG B 50 17.240 -10.573 -1.095 1.00 0.00 H new ATOM 0 HB3 ARG B 50 18.743 -10.094 -1.860 1.00 0.00 H new ATOM 0 HG2 ARG B 50 18.748 -12.243 0.261 1.00 0.00 H new ATOM 0 HG3 ARG B 50 18.270 -12.628 -1.381 1.00 0.00 H new ATOM 0 HD2 ARG B 50 20.511 -12.996 -1.645 1.00 0.00 H new ATOM 0 HD3 ARG B 50 20.538 -11.268 -1.935 1.00 0.00 H new ATOM 0 HE ARG B 50 20.847 -11.404 0.795 1.00 0.00 H new ATOM 0 HH11 ARG B 50 22.435 -12.976 -1.938 1.00 0.00 H new ATOM 0 HH12 ARG B 50 23.986 -13.120 -1.105 1.00 0.00 H new ATOM 0 HH21 ARG B 50 22.841 -11.593 1.860 1.00 0.00 H new ATOM 0 HH22 ARG B 50 24.215 -12.340 1.037 1.00 0.00 H new ATOM 1031 N LYS B 51 19.882 -7.526 0.380 1.00 0.00 N ATOM 1032 CA LYS B 51 21.021 -6.639 0.160 1.00 0.00 C ATOM 1033 C LYS B 51 21.470 -6.674 -1.298 1.00 0.00 C ATOM 1034 O LYS B 51 22.638 -6.434 -1.605 1.00 0.00 O ATOM 1035 CB LYS B 51 22.184 -7.035 1.073 1.00 0.00 C ATOM 1036 CG LYS B 51 22.781 -5.864 1.838 1.00 0.00 C ATOM 1037 CD LYS B 51 24.065 -5.371 1.191 1.00 0.00 C ATOM 1038 CE LYS B 51 23.816 -4.155 0.313 1.00 0.00 C ATOM 1039 NZ LYS B 51 24.207 -2.889 0.992 1.00 0.00 N ATOM 0 H LYS B 51 19.113 -7.103 0.899 1.00 0.00 H new ATOM 0 HA LYS B 51 20.708 -5.623 0.398 1.00 0.00 H new ATOM 0 HB2 LYS B 51 21.838 -7.785 1.784 1.00 0.00 H new ATOM 0 HB3 LYS B 51 22.964 -7.502 0.472 1.00 0.00 H new ATOM 0 HG2 LYS B 51 22.058 -5.049 1.880 1.00 0.00 H new ATOM 0 HG3 LYS B 51 22.983 -6.165 2.866 1.00 0.00 H new ATOM 0 HD2 LYS B 51 24.790 -5.120 1.965 1.00 0.00 H new ATOM 0 HD3 LYS B 51 24.502 -6.170 0.592 1.00 0.00 H new ATOM 0 HE2 LYS B 51 24.377 -4.257 -0.616 1.00 0.00 H new ATOM 0 HE3 LYS B 51 22.761 -4.112 0.044 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 24.021 -2.084 0.360 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 23.653 -2.778 1.865 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 25.220 -2.919 1.226 1.00 0.00 H new ATOM 1053 N ARG B 52 20.535 -6.981 -2.191 1.00 0.00 N ATOM 1054 CA ARG B 52 20.831 -7.053 -3.617 1.00 0.00 C ATOM 1055 C ARG B 52 19.589 -6.746 -4.447 1.00 0.00 C ATOM 1056 O ARG B 52 19.616 -5.890 -5.331 1.00 0.00 O ATOM 1057 CB ARG B 52 21.368 -8.440 -3.977 1.00 0.00 C ATOM 1058 CG ARG B 52 22.832 -8.635 -3.619 1.00 0.00 C ATOM 1059 CD ARG B 52 23.447 -9.787 -4.395 1.00 0.00 C ATOM 1060 NE ARG B 52 24.352 -9.322 -5.442 1.00 0.00 N ATOM 1061 CZ ARG B 52 24.897 -10.121 -6.353 1.00 0.00 C ATOM 1062 NH1 ARG B 52 24.628 -11.419 -6.345 1.00 0.00 N ATOM 1063 NH2 ARG B 52 25.711 -9.622 -7.273 1.00 0.00 N ATOM 0 H ARG B 52 19.564 -7.184 -1.952 1.00 0.00 H new ATOM 0 HA ARG B 52 21.591 -6.305 -3.843 1.00 0.00 H new ATOM 0 HB2 ARG B 52 20.773 -9.196 -3.464 1.00 0.00 H new ATOM 0 HB3 ARG B 52 21.239 -8.605 -5.047 1.00 0.00 H new ATOM 0 HG2 ARG B 52 23.384 -7.719 -3.828 1.00 0.00 H new ATOM 0 HG3 ARG B 52 22.924 -8.825 -2.550 1.00 0.00 H new ATOM 0 HD2 ARG B 52 23.990 -10.437 -3.709 1.00 0.00 H new ATOM 0 HD3 ARG B 52 22.654 -10.387 -4.842 1.00 0.00 H new ATOM 0 HE ARG B 52 24.579 -8.328 -5.476 1.00 0.00 H new ATOM 0 HH11 ARG B 52 24.002 -11.806 -5.639 1.00 0.00 H new ATOM 0 HH12 ARG B 52 25.047 -12.031 -7.045 1.00 0.00 H new ATOM 0 HH21 ARG B 52 25.920 -8.624 -7.282 1.00 0.00 H new ATOM 0 HH22 ARG B 52 26.129 -10.237 -7.972 1.00 0.00 H new ATOM 1077 N ASP B 53 18.500 -7.451 -4.155 1.00 0.00 N ATOM 1078 CA ASP B 53 17.246 -7.256 -4.875 1.00 0.00 C ATOM 1079 C ASP B 53 16.506 -6.028 -4.356 1.00 0.00 C ATOM 1080 O ASP B 53 16.294 -5.881 -3.153 1.00 0.00 O ATOM 1081 CB ASP B 53 16.360 -8.496 -4.741 1.00 0.00 C ATOM 1082 CG ASP B 53 16.628 -9.512 -5.833 1.00 0.00 C ATOM 1083 OD1 ASP B 53 16.136 -9.313 -6.964 1.00 0.00 O ATOM 1084 OD2 ASP B 53 17.331 -10.508 -5.559 1.00 0.00 O ATOM 0 H ASP B 53 18.461 -8.162 -3.425 1.00 0.00 H new ATOM 0 HA ASP B 53 17.480 -7.097 -5.928 1.00 0.00 H new ATOM 0 HB2 ASP B 53 16.529 -8.958 -3.768 1.00 0.00 H new ATOM 0 HB3 ASP B 53 15.312 -8.197 -4.774 1.00 0.00 H new ATOM 1089 N SER B 54 16.115 -5.149 -5.273 1.00 0.00 N ATOM 1090 CA SER B 54 15.396 -3.935 -4.909 1.00 0.00 C ATOM 1091 C SER B 54 14.031 -3.884 -5.584 1.00 0.00 C ATOM 1092 O SER B 54 13.916 -3.490 -6.744 1.00 0.00 O ATOM 1093 CB SER B 54 16.209 -2.695 -5.296 1.00 0.00 C ATOM 1094 OG SER B 54 17.600 -2.959 -5.247 1.00 0.00 O ATOM 0 H SER B 54 16.284 -5.255 -6.273 1.00 0.00 H new ATOM 0 HA SER B 54 15.250 -3.946 -3.829 1.00 0.00 H new ATOM 0 HB2 SER B 54 15.932 -2.374 -6.300 1.00 0.00 H new ATOM 0 HB3 SER B 54 15.968 -1.874 -4.621 1.00 0.00 H new ATOM 0 HG SER B 54 18.095 -2.152 -5.500 1.00 0.00 H new ATOM 1100 N VAL B 55 12.997 -4.293 -4.855 1.00 0.00 N ATOM 1101 CA VAL B 55 11.633 -4.242 -5.383 1.00 0.00 C ATOM 1102 C VAL B 55 11.118 -2.811 -5.314 1.00 0.00 C ATOM 1103 O VAL B 55 10.396 -2.447 -4.388 1.00 0.00 O ATOM 1104 CB VAL B 55 10.632 -5.177 -4.641 1.00 0.00 C ATOM 1105 CG1 VAL B 55 9.930 -6.091 -5.628 1.00 0.00 C ATOM 1106 CG2 VAL B 55 11.301 -6.007 -3.561 1.00 0.00 C ATOM 0 H VAL B 55 13.073 -4.660 -3.906 1.00 0.00 H new ATOM 0 HA VAL B 55 11.690 -4.598 -6.412 1.00 0.00 H new ATOM 0 HB VAL B 55 9.902 -4.531 -4.153 1.00 0.00 H new ATOM 0 HG11 VAL B 55 9.234 -6.738 -5.094 1.00 0.00 H new ATOM 0 HG12 VAL B 55 9.382 -5.490 -6.354 1.00 0.00 H new ATOM 0 HG13 VAL B 55 10.669 -6.702 -6.146 1.00 0.00 H new ATOM 0 HG21 VAL B 55 10.558 -6.640 -3.076 1.00 0.00 H new ATOM 0 HG22 VAL B 55 12.074 -6.632 -4.009 1.00 0.00 H new ATOM 0 HG23 VAL B 55 11.753 -5.346 -2.821 1.00 0.00 H new ATOM 1116 N LYS B 56 11.537 -1.988 -6.270 1.00 0.00 N ATOM 1117 CA LYS B 56 11.153 -0.584 -6.279 1.00 0.00 C ATOM 1118 C LYS B 56 10.119 -0.281 -7.356 1.00 0.00 C ATOM 1119 O LYS B 56 10.372 -0.465 -8.547 1.00 0.00 O ATOM 1120 CB LYS B 56 12.381 0.304 -6.472 1.00 0.00 C ATOM 1121 CG LYS B 56 12.966 0.247 -7.866 1.00 0.00 C ATOM 1122 CD LYS B 56 12.616 1.489 -8.665 1.00 0.00 C ATOM 1123 CE LYS B 56 13.835 2.367 -8.889 1.00 0.00 C ATOM 1124 NZ LYS B 56 14.329 2.285 -10.291 1.00 0.00 N ATOM 0 H LYS B 56 12.139 -2.269 -7.044 1.00 0.00 H new ATOM 0 HA LYS B 56 10.698 -0.368 -5.312 1.00 0.00 H new ATOM 0 HB2 LYS B 56 12.111 1.335 -6.244 1.00 0.00 H new ATOM 0 HB3 LYS B 56 13.147 0.009 -5.755 1.00 0.00 H new ATOM 0 HG2 LYS B 56 14.050 0.146 -7.804 1.00 0.00 H new ATOM 0 HG3 LYS B 56 12.593 -0.637 -8.383 1.00 0.00 H new ATOM 0 HD2 LYS B 56 12.194 1.198 -9.627 1.00 0.00 H new ATOM 0 HD3 LYS B 56 11.848 2.057 -8.139 1.00 0.00 H new ATOM 0 HE2 LYS B 56 13.586 3.401 -8.652 1.00 0.00 H new ATOM 0 HE3 LYS B 56 14.629 2.066 -8.206 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 15.161 2.898 -10.402 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 14.591 1.303 -10.510 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 13.580 2.597 -10.942 1.00 0.00 H new ATOM 1138 N TRP B 57 8.960 0.207 -6.925 1.00 0.00 N ATOM 1139 CA TRP B 57 7.901 0.595 -7.851 1.00 0.00 C ATOM 1140 C TRP B 57 7.940 2.100 -8.083 1.00 0.00 C ATOM 1141 O TRP B 57 8.833 2.789 -7.589 1.00 0.00 O ATOM 1142 CB TRP B 57 6.525 0.195 -7.310 1.00 0.00 C ATOM 1143 CG TRP B 57 6.377 -1.270 -7.029 1.00 0.00 C ATOM 1144 CD1 TRP B 57 5.750 -2.200 -7.807 1.00 0.00 C ATOM 1145 CD2 TRP B 57 6.826 -1.964 -5.865 1.00 0.00 C ATOM 1146 NE1 TRP B 57 5.800 -3.434 -7.203 1.00 0.00 N ATOM 1147 CE2 TRP B 57 6.457 -3.312 -6.008 1.00 0.00 C ATOM 1148 CE3 TRP B 57 7.514 -1.575 -4.721 1.00 0.00 C ATOM 1149 CZ2 TRP B 57 6.757 -4.270 -5.042 1.00 0.00 C ATOM 1150 CZ3 TRP B 57 7.810 -2.513 -3.769 1.00 0.00 C ATOM 1151 CH2 TRP B 57 7.440 -3.852 -3.931 1.00 0.00 C ATOM 0 H TRP B 57 8.730 0.343 -5.941 1.00 0.00 H new ATOM 0 HA TRP B 57 8.067 0.075 -8.794 1.00 0.00 H new ATOM 0 HB2 TRP B 57 6.332 0.751 -6.392 1.00 0.00 H new ATOM 0 HB3 TRP B 57 5.763 0.494 -8.030 1.00 0.00 H new ATOM 0 HD1 TRP B 57 5.282 -1.996 -8.759 1.00 0.00 H new ATOM 0 HE1 TRP B 57 5.412 -4.298 -7.582 1.00 0.00 H new ATOM 0 HE3 TRP B 57 7.811 -0.546 -4.585 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 6.462 -5.302 -5.164 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 8.339 -2.214 -2.876 1.00 0.00 H new ATOM 0 HH2 TRP B 57 7.698 -4.569 -3.166 1.00 0.00 H new ATOM 1162 N HIS B 58 6.964 2.608 -8.822 1.00 0.00 N ATOM 1163 CA HIS B 58 6.895 4.035 -9.107 1.00 0.00 C ATOM 1164 C HIS B 58 5.953 4.741 -8.137 1.00 0.00 C ATOM 1165 O HIS B 58 5.309 5.730 -8.489 1.00 0.00 O ATOM 1166 CB HIS B 58 6.439 4.264 -10.548 1.00 0.00 C ATOM 1167 CG HIS B 58 6.866 5.586 -11.105 1.00 0.00 C ATOM 1168 ND1 HIS B 58 6.201 6.224 -12.131 1.00 0.00 N ATOM 1169 CD2 HIS B 58 7.905 6.392 -10.775 1.00 0.00 C ATOM 1170 CE1 HIS B 58 6.810 7.364 -12.407 1.00 0.00 C ATOM 1171 NE2 HIS B 58 7.845 7.489 -11.599 1.00 0.00 N ATOM 0 H HIS B 58 6.211 2.056 -9.234 1.00 0.00 H new ATOM 0 HA HIS B 58 7.892 4.456 -8.979 1.00 0.00 H new ATOM 0 HB2 HIS B 58 6.836 3.468 -11.178 1.00 0.00 H new ATOM 0 HB3 HIS B 58 5.352 4.194 -10.593 1.00 0.00 H new ATOM 0 HD2 HIS B 58 8.642 6.206 -10.008 1.00 0.00 H new ATOM 0 HE1 HIS B 58 6.511 8.073 -13.165 1.00 0.00 H new ATOM 0 HE2 HIS B 58 8.496 8.274 -11.588 1.00 0.00 H new ATOM 1180 N TYR B 59 5.887 4.232 -6.910 1.00 0.00 N ATOM 1181 CA TYR B 59 5.038 4.820 -5.878 1.00 0.00 C ATOM 1182 C TYR B 59 3.566 4.597 -6.179 1.00 0.00 C ATOM 1183 O TYR B 59 2.930 3.715 -5.606 1.00 0.00 O ATOM 1184 CB TYR B 59 5.306 6.321 -5.764 1.00 0.00 C ATOM 1185 CG TYR B 59 5.943 6.739 -4.464 1.00 0.00 C ATOM 1186 CD1 TYR B 59 5.657 6.079 -3.282 1.00 0.00 C ATOM 1187 CD2 TYR B 59 6.830 7.801 -4.423 1.00 0.00 C ATOM 1188 CE1 TYR B 59 6.237 6.463 -2.091 1.00 0.00 C ATOM 1189 CE2 TYR B 59 7.424 8.191 -3.240 1.00 0.00 C ATOM 1190 CZ TYR B 59 7.134 7.513 -2.078 1.00 0.00 C ATOM 1191 OH TYR B 59 7.729 7.897 -0.900 1.00 0.00 O ATOM 0 H TYR B 59 6.412 3.412 -6.606 1.00 0.00 H new ATOM 0 HA TYR B 59 5.279 4.329 -4.935 1.00 0.00 H new ATOM 0 HB2 TYR B 59 5.952 6.627 -6.587 1.00 0.00 H new ATOM 0 HB3 TYR B 59 4.364 6.857 -5.883 1.00 0.00 H new ATOM 0 HD1 TYR B 59 4.967 5.248 -3.292 1.00 0.00 H new ATOM 0 HD2 TYR B 59 7.061 8.334 -5.333 1.00 0.00 H new ATOM 0 HE1 TYR B 59 5.991 5.946 -1.175 1.00 0.00 H new ATOM 0 HE2 TYR B 59 8.112 9.023 -3.226 1.00 0.00 H new ATOM 0 HH TYR B 59 8.427 8.560 -1.087 1.00 0.00 H new ATOM 1201 N LEU B 60 3.022 5.428 -7.059 1.00 0.00 N ATOM 1202 CA LEU B 60 1.614 5.348 -7.399 1.00 0.00 C ATOM 1203 C LEU B 60 1.337 4.267 -8.440 1.00 0.00 C ATOM 1204 O LEU B 60 0.199 4.104 -8.881 1.00 0.00 O ATOM 1205 CB LEU B 60 1.117 6.698 -7.911 1.00 0.00 C ATOM 1206 CG LEU B 60 1.594 7.073 -9.314 1.00 0.00 C ATOM 1207 CD1 LEU B 60 0.498 7.813 -10.061 1.00 0.00 C ATOM 1208 CD2 LEU B 60 2.859 7.915 -9.241 1.00 0.00 C ATOM 0 H LEU B 60 3.536 6.162 -7.547 1.00 0.00 H new ATOM 0 HA LEU B 60 1.076 5.080 -6.490 1.00 0.00 H new ATOM 0 HB2 LEU B 60 0.027 6.693 -7.903 1.00 0.00 H new ATOM 0 HB3 LEU B 60 1.437 7.474 -7.215 1.00 0.00 H new ATOM 0 HG LEU B 60 1.827 6.158 -9.859 1.00 0.00 H new ATOM 0 HD11 LEU B 60 0.850 8.074 -11.059 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -0.382 7.175 -10.143 1.00 0.00 H new ATOM 0 HD13 LEU B 60 0.238 8.722 -9.518 1.00 0.00 H new ATOM 0 HD21 LEU B 60 3.184 8.172 -10.249 1.00 0.00 H new ATOM 0 HD22 LEU B 60 2.657 8.828 -8.681 1.00 0.00 H new ATOM 0 HD23 LEU B 60 3.645 7.349 -8.740 1.00 0.00 H new ATOM 1220 N CYS B 61 2.367 3.510 -8.815 1.00 0.00 N ATOM 1221 CA CYS B 61 2.195 2.415 -9.763 1.00 0.00 C ATOM 1222 C CYS B 61 1.348 1.294 -9.154 1.00 0.00 C ATOM 1223 O CYS B 61 0.951 0.359 -9.848 1.00 0.00 O ATOM 1224 CB CYS B 61 3.559 1.866 -10.187 1.00 0.00 C ATOM 1225 SG CYS B 61 3.481 0.622 -11.497 1.00 0.00 S ATOM 0 H CYS B 61 3.322 3.635 -8.479 1.00 0.00 H new ATOM 0 HA CYS B 61 1.676 2.802 -10.640 1.00 0.00 H new ATOM 0 HB2 CYS B 61 4.183 2.694 -10.524 1.00 0.00 H new ATOM 0 HB3 CYS B 61 4.050 1.431 -9.316 1.00 0.00 H new ATOM 0 HG CYS B 61 2.385 -0.067 -11.377 1.00 0.00 H new ATOM 1231 N LEU B 62 1.076 1.397 -7.851 1.00 0.00 N ATOM 1232 CA LEU B 62 0.291 0.401 -7.141 1.00 0.00 C ATOM 1233 C LEU B 62 -1.115 0.270 -7.745 1.00 0.00 C ATOM 1234 O LEU B 62 -1.298 0.454 -8.948 1.00 0.00 O ATOM 1235 CB LEU B 62 0.215 0.780 -5.657 1.00 0.00 C ATOM 1236 CG LEU B 62 1.551 1.163 -5.011 1.00 0.00 C ATOM 1237 CD1 LEU B 62 1.359 2.280 -3.996 1.00 0.00 C ATOM 1238 CD2 LEU B 62 2.187 -0.046 -4.354 1.00 0.00 C ATOM 0 H LEU B 62 1.394 2.170 -7.267 1.00 0.00 H new ATOM 0 HA LEU B 62 0.778 -0.569 -7.239 1.00 0.00 H new ATOM 0 HB2 LEU B 62 -0.476 1.616 -5.547 1.00 0.00 H new ATOM 0 HB3 LEU B 62 -0.209 -0.059 -5.106 1.00 0.00 H new ATOM 0 HG LEU B 62 2.218 1.524 -5.794 1.00 0.00 H new ATOM 0 HD11 LEU B 62 2.320 2.536 -3.550 1.00 0.00 H new ATOM 0 HD12 LEU B 62 0.945 3.157 -4.494 1.00 0.00 H new ATOM 0 HD13 LEU B 62 0.674 1.949 -3.216 1.00 0.00 H new ATOM 0 HD21 LEU B 62 3.135 0.243 -3.900 1.00 0.00 H new ATOM 0 HD22 LEU B 62 1.520 -0.435 -3.585 1.00 0.00 H new ATOM 0 HD23 LEU B 62 2.364 -0.817 -5.104 1.00 0.00 H new ATOM 1250 N ARG B 63 -2.086 -0.130 -6.924 1.00 0.00 N ATOM 1251 CA ARG B 63 -3.461 -0.279 -7.364 1.00 0.00 C ATOM 1252 C ARG B 63 -4.403 -0.053 -6.194 1.00 0.00 C ATOM 1253 O ARG B 63 -5.355 0.714 -6.295 1.00 0.00 O ATOM 1254 CB ARG B 63 -3.684 -1.663 -7.964 1.00 0.00 C ATOM 1255 CG ARG B 63 -4.181 -1.623 -9.394 1.00 0.00 C ATOM 1256 CD ARG B 63 -5.358 -0.672 -9.547 1.00 0.00 C ATOM 1257 NE ARG B 63 -6.064 -0.870 -10.810 1.00 0.00 N ATOM 1258 CZ ARG B 63 -7.270 -0.372 -11.064 1.00 0.00 C ATOM 1259 NH1 ARG B 63 -7.897 0.352 -10.147 1.00 0.00 N ATOM 1260 NH2 ARG B 63 -7.848 -0.597 -12.236 1.00 0.00 N ATOM 0 H ARG B 63 -1.936 -0.357 -5.941 1.00 0.00 H new ATOM 0 HA ARG B 63 -3.666 0.464 -8.134 1.00 0.00 H new ATOM 0 HB2 ARG B 63 -2.749 -2.222 -7.927 1.00 0.00 H new ATOM 0 HB3 ARG B 63 -4.404 -2.205 -7.351 1.00 0.00 H new ATOM 0 HG2 ARG B 63 -3.371 -1.311 -10.053 1.00 0.00 H new ATOM 0 HG3 ARG B 63 -4.478 -2.624 -9.706 1.00 0.00 H new ATOM 0 HD2 ARG B 63 -6.051 -0.817 -8.718 1.00 0.00 H new ATOM 0 HD3 ARG B 63 -5.002 0.357 -9.488 1.00 0.00 H new ATOM 0 HE ARG B 63 -5.607 -1.420 -11.537 1.00 0.00 H new ATOM 0 HH11 ARG B 63 -7.454 0.528 -9.245 1.00 0.00 H new ATOM 0 HH12 ARG B 63 -8.822 0.733 -10.343 1.00 0.00 H new ATOM 0 HH21 ARG B 63 -7.367 -1.153 -12.943 1.00 0.00 H new ATOM 0 HH22 ARG B 63 -8.773 -0.214 -12.430 1.00 0.00 H new ATOM 1274 N ARG B 64 -4.062 -0.649 -5.057 1.00 0.00 N ATOM 1275 CA ARG B 64 -4.818 -0.458 -3.826 1.00 0.00 C ATOM 1276 C ARG B 64 -3.945 -0.833 -2.628 1.00 0.00 C ATOM 1277 O ARG B 64 -3.465 -1.963 -2.530 1.00 0.00 O ATOM 1278 CB ARG B 64 -6.128 -1.265 -3.828 1.00 0.00 C ATOM 1279 CG ARG B 64 -6.521 -1.844 -5.180 1.00 0.00 C ATOM 1280 CD ARG B 64 -7.453 -3.034 -5.028 1.00 0.00 C ATOM 1281 NE ARG B 64 -7.129 -4.104 -5.968 1.00 0.00 N ATOM 1282 CZ ARG B 64 -7.993 -5.039 -6.350 1.00 0.00 C ATOM 1283 NH1 ARG B 64 -9.231 -5.039 -5.874 1.00 0.00 N ATOM 1284 NH2 ARG B 64 -7.619 -5.977 -7.209 1.00 0.00 N ATOM 0 H ARG B 64 -3.261 -1.273 -4.963 1.00 0.00 H new ATOM 0 HA ARG B 64 -5.096 0.593 -3.753 1.00 0.00 H new ATOM 0 HB2 ARG B 64 -6.036 -2.082 -3.112 1.00 0.00 H new ATOM 0 HB3 ARG B 64 -6.935 -0.622 -3.476 1.00 0.00 H new ATOM 0 HG2 ARG B 64 -7.007 -1.074 -5.779 1.00 0.00 H new ATOM 0 HG3 ARG B 64 -5.625 -2.149 -5.720 1.00 0.00 H new ATOM 0 HD2 ARG B 64 -7.391 -3.415 -4.009 1.00 0.00 H new ATOM 0 HD3 ARG B 64 -8.482 -2.711 -5.186 1.00 0.00 H new ATOM 0 HE ARG B 64 -6.185 -4.135 -6.354 1.00 0.00 H new ATOM 0 HH11 ARG B 64 -9.523 -4.320 -5.212 1.00 0.00 H new ATOM 0 HH12 ARG B 64 -9.891 -5.758 -6.170 1.00 0.00 H new ATOM 0 HH21 ARG B 64 -6.668 -5.981 -7.577 1.00 0.00 H new ATOM 0 HH22 ARG B 64 -8.282 -6.694 -7.502 1.00 0.00 H new ATOM 1298 N TYR B 65 -3.681 0.142 -1.757 1.00 0.00 N ATOM 1299 CA TYR B 65 -2.785 -0.065 -0.625 1.00 0.00 C ATOM 1300 C TYR B 65 -3.507 0.112 0.716 1.00 0.00 C ATOM 1301 O TYR B 65 -4.280 1.051 0.904 1.00 0.00 O ATOM 1302 CB TYR B 65 -1.563 0.876 -0.766 1.00 0.00 C ATOM 1303 CG TYR B 65 -1.476 2.034 0.219 1.00 0.00 C ATOM 1304 CD1 TYR B 65 -2.507 2.965 0.345 1.00 0.00 C ATOM 1305 CD2 TYR B 65 -0.337 2.211 0.998 1.00 0.00 C ATOM 1306 CE1 TYR B 65 -2.411 4.016 1.236 1.00 0.00 C ATOM 1307 CE2 TYR B 65 -0.236 3.263 1.886 1.00 0.00 C ATOM 1308 CZ TYR B 65 -1.275 4.160 2.004 1.00 0.00 C ATOM 1309 OH TYR B 65 -1.177 5.206 2.891 1.00 0.00 O ATOM 0 H TYR B 65 -4.076 1.081 -1.816 1.00 0.00 H new ATOM 0 HA TYR B 65 -2.432 -1.096 -0.634 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -0.658 0.276 -0.667 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -1.564 1.287 -1.776 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -3.394 2.863 -0.263 1.00 0.00 H new ATOM 0 HD2 TYR B 65 0.482 1.513 0.906 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -3.223 4.722 1.331 1.00 0.00 H new ATOM 0 HE2 TYR B 65 0.654 3.382 2.486 1.00 0.00 H new ATOM 0 HH TYR B 65 -1.282 4.870 3.806 1.00 0.00 H new ATOM 1319 N GLY B 66 -3.243 -0.807 1.640 1.00 0.00 N ATOM 1320 CA GLY B 66 -3.850 -0.747 2.957 1.00 0.00 C ATOM 1321 C GLY B 66 -2.880 -1.152 4.051 1.00 0.00 C ATOM 1322 O GLY B 66 -1.705 -1.399 3.781 1.00 0.00 O ATOM 0 H GLY B 66 -2.615 -1.598 1.498 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -4.206 0.266 3.146 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -4.721 -1.402 2.985 1.00 0.00 H new ATOM 1326 N TYR B 67 -3.369 -1.235 5.284 1.00 0.00 N ATOM 1327 CA TYR B 67 -2.527 -1.638 6.407 1.00 0.00 C ATOM 1328 C TYR B 67 -3.371 -1.982 7.632 1.00 0.00 C ATOM 1329 O TYR B 67 -4.429 -1.395 7.855 1.00 0.00 O ATOM 1330 CB TYR B 67 -1.515 -0.534 6.744 1.00 0.00 C ATOM 1331 CG TYR B 67 -2.091 0.616 7.543 1.00 0.00 C ATOM 1332 CD1 TYR B 67 -3.271 1.236 7.154 1.00 0.00 C ATOM 1333 CD2 TYR B 67 -1.453 1.076 8.688 1.00 0.00 C ATOM 1334 CE1 TYR B 67 -3.799 2.284 7.884 1.00 0.00 C ATOM 1335 CE2 TYR B 67 -1.974 2.124 9.422 1.00 0.00 C ATOM 1336 CZ TYR B 67 -3.147 2.724 9.017 1.00 0.00 C ATOM 1337 OH TYR B 67 -3.669 3.767 9.745 1.00 0.00 O ATOM 0 H TYR B 67 -4.337 -1.030 5.531 1.00 0.00 H new ATOM 0 HA TYR B 67 -1.980 -2.534 6.113 1.00 0.00 H new ATOM 0 HB2 TYR B 67 -0.689 -0.973 7.304 1.00 0.00 H new ATOM 0 HB3 TYR B 67 -1.098 -0.143 5.816 1.00 0.00 H new ATOM 0 HD1 TYR B 67 -3.784 0.894 6.267 1.00 0.00 H new ATOM 0 HD2 TYR B 67 -0.535 0.607 9.010 1.00 0.00 H new ATOM 0 HE1 TYR B 67 -4.718 2.756 7.569 1.00 0.00 H new ATOM 0 HE2 TYR B 67 -1.465 2.471 10.309 1.00 0.00 H new ATOM 0 HH TYR B 67 -3.089 3.952 10.513 1.00 0.00 H new ATOM 1347 N ASP B 68 -2.892 -2.939 8.421 1.00 0.00 N ATOM 1348 CA ASP B 68 -3.600 -3.366 9.623 1.00 0.00 C ATOM 1349 C ASP B 68 -2.712 -3.231 10.856 1.00 0.00 C ATOM 1350 O ASP B 68 -1.850 -4.074 11.106 1.00 0.00 O ATOM 1351 CB ASP B 68 -4.066 -4.816 9.478 1.00 0.00 C ATOM 1352 CG ASP B 68 -4.899 -5.277 10.658 1.00 0.00 C ATOM 1353 OD1 ASP B 68 -4.982 -4.529 11.655 1.00 0.00 O ATOM 1354 OD2 ASP B 68 -5.467 -6.387 10.586 1.00 0.00 O ATOM 0 H ASP B 68 -2.016 -3.433 8.250 1.00 0.00 H new ATOM 0 HA ASP B 68 -4.469 -2.720 9.749 1.00 0.00 H new ATOM 0 HB2 ASP B 68 -4.650 -4.917 8.563 1.00 0.00 H new ATOM 0 HB3 ASP B 68 -3.197 -5.465 9.375 1.00 0.00 H new ATOM 1359 N SER B 69 -2.931 -2.169 11.624 1.00 0.00 N ATOM 1360 CA SER B 69 -2.156 -1.925 12.836 1.00 0.00 C ATOM 1361 C SER B 69 -0.661 -1.862 12.530 1.00 0.00 C ATOM 1362 O SER B 69 -0.103 -0.781 12.344 1.00 0.00 O ATOM 1363 CB SER B 69 -2.432 -3.019 13.869 1.00 0.00 C ATOM 1364 OG SER B 69 -1.469 -2.995 14.908 1.00 0.00 O ATOM 0 H SER B 69 -3.640 -1.462 11.429 1.00 0.00 H new ATOM 0 HA SER B 69 -2.462 -0.961 13.243 1.00 0.00 H new ATOM 0 HB2 SER B 69 -3.428 -2.883 14.289 1.00 0.00 H new ATOM 0 HB3 SER B 69 -2.422 -3.994 13.382 1.00 0.00 H new ATOM 0 HG SER B 69 -1.669 -3.703 15.556 1.00 0.00 H new ATOM 1370 N ASN B 70 -0.018 -3.024 12.485 1.00 0.00 N ATOM 1371 CA ASN B 70 1.411 -3.097 12.206 1.00 0.00 C ATOM 1372 C ASN B 70 1.686 -3.978 10.992 1.00 0.00 C ATOM 1373 O ASN B 70 2.662 -4.728 10.966 1.00 0.00 O ATOM 1374 CB ASN B 70 2.158 -3.646 13.424 1.00 0.00 C ATOM 1375 CG ASN B 70 2.724 -2.546 14.301 1.00 0.00 C ATOM 1376 OD1 ASN B 70 3.050 -1.460 13.823 1.00 0.00 O ATOM 1377 ND2 ASN B 70 2.843 -2.824 15.595 1.00 0.00 N ATOM 0 H ASN B 70 -0.464 -3.928 12.638 1.00 0.00 H new ATOM 0 HA ASN B 70 1.766 -2.089 11.989 1.00 0.00 H new ATOM 0 HB2 ASN B 70 1.481 -4.264 14.013 1.00 0.00 H new ATOM 0 HB3 ASN B 70 2.969 -4.292 13.088 1.00 0.00 H new ATOM 0 HD21 ASN B 70 3.217 -2.123 16.235 1.00 0.00 H new ATOM 0 HD22 ASN B 70 2.560 -3.738 15.948 1.00 0.00 H new ATOM 1384 N LEU B 71 0.820 -3.883 9.987 1.00 0.00 N ATOM 1385 CA LEU B 71 0.966 -4.686 8.778 1.00 0.00 C ATOM 1386 C LEU B 71 0.906 -3.815 7.525 1.00 0.00 C ATOM 1387 O LEU B 71 -0.102 -3.161 7.258 1.00 0.00 O ATOM 1388 CB LEU B 71 -0.130 -5.752 8.723 1.00 0.00 C ATOM 1389 CG LEU B 71 0.046 -6.808 7.630 1.00 0.00 C ATOM 1390 CD1 LEU B 71 -0.872 -7.994 7.884 1.00 0.00 C ATOM 1391 CD2 LEU B 71 -0.224 -6.205 6.260 1.00 0.00 C ATOM 0 H LEU B 71 0.012 -3.260 9.986 1.00 0.00 H new ATOM 0 HA LEU B 71 1.942 -5.170 8.809 1.00 0.00 H new ATOM 0 HB2 LEU B 71 -0.175 -6.255 9.689 1.00 0.00 H new ATOM 0 HB3 LEU B 71 -1.090 -5.257 8.577 1.00 0.00 H new ATOM 0 HG LEU B 71 1.077 -7.161 7.652 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -0.734 -8.736 7.097 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -0.632 -8.440 8.849 1.00 0.00 H new ATOM 0 HD13 LEU B 71 -1.909 -7.657 7.888 1.00 0.00 H new ATOM 0 HD21 LEU B 71 -0.094 -6.970 5.494 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -1.245 -5.825 6.224 1.00 0.00 H new ATOM 0 HD23 LEU B 71 0.474 -5.388 6.078 1.00 0.00 H new ATOM 1403 N PHE B 72 1.989 -3.824 6.753 1.00 0.00 N ATOM 1404 CA PHE B 72 2.059 -3.052 5.517 1.00 0.00 C ATOM 1405 C PHE B 72 1.481 -3.853 4.350 1.00 0.00 C ATOM 1406 O PHE B 72 2.081 -4.823 3.895 1.00 0.00 O ATOM 1407 CB PHE B 72 3.517 -2.659 5.220 1.00 0.00 C ATOM 1408 CG PHE B 72 3.760 -2.198 3.805 1.00 0.00 C ATOM 1409 CD1 PHE B 72 2.963 -1.218 3.236 1.00 0.00 C ATOM 1410 CD2 PHE B 72 4.767 -2.765 3.041 1.00 0.00 C ATOM 1411 CE1 PHE B 72 3.179 -0.797 1.937 1.00 0.00 C ATOM 1412 CE2 PHE B 72 4.986 -2.350 1.740 1.00 0.00 C ATOM 1413 CZ PHE B 72 4.191 -1.365 1.188 1.00 0.00 C ATOM 0 H PHE B 72 2.832 -4.359 6.963 1.00 0.00 H new ATOM 0 HA PHE B 72 1.467 -2.146 5.641 1.00 0.00 H new ATOM 0 HB2 PHE B 72 3.813 -1.864 5.904 1.00 0.00 H new ATOM 0 HB3 PHE B 72 4.161 -3.514 5.427 1.00 0.00 H new ATOM 0 HD1 PHE B 72 2.164 -0.778 3.814 1.00 0.00 H new ATOM 0 HD2 PHE B 72 5.388 -3.540 3.466 1.00 0.00 H new ATOM 0 HE1 PHE B 72 2.557 -0.025 1.508 1.00 0.00 H new ATOM 0 HE2 PHE B 72 5.778 -2.796 1.156 1.00 0.00 H new ATOM 0 HZ PHE B 72 4.360 -1.039 0.172 1.00 0.00 H new ATOM 1423 N SER B 73 0.329 -3.427 3.852 1.00 0.00 N ATOM 1424 CA SER B 73 -0.293 -4.091 2.714 1.00 0.00 C ATOM 1425 C SER B 73 -0.329 -3.154 1.515 1.00 0.00 C ATOM 1426 O SER B 73 -0.751 -2.004 1.629 1.00 0.00 O ATOM 1427 CB SER B 73 -1.707 -4.557 3.065 1.00 0.00 C ATOM 1428 OG SER B 73 -2.653 -3.525 2.855 1.00 0.00 O ATOM 0 H SER B 73 -0.192 -2.629 4.215 1.00 0.00 H new ATOM 0 HA SER B 73 0.303 -4.967 2.459 1.00 0.00 H new ATOM 0 HB2 SER B 73 -1.969 -5.423 2.457 1.00 0.00 H new ATOM 0 HB3 SER B 73 -1.739 -4.877 4.106 1.00 0.00 H new ATOM 0 HG SER B 73 -3.314 -3.817 2.193 1.00 0.00 H new ATOM 1434 N PHE B 74 0.185 -3.623 0.384 1.00 0.00 N ATOM 1435 CA PHE B 74 0.202 -2.818 -0.829 1.00 0.00 C ATOM 1436 C PHE B 74 0.146 -3.714 -2.063 1.00 0.00 C ATOM 1437 O PHE B 74 0.829 -4.739 -2.132 1.00 0.00 O ATOM 1438 CB PHE B 74 1.438 -1.899 -0.857 1.00 0.00 C ATOM 1439 CG PHE B 74 2.725 -2.595 -1.198 1.00 0.00 C ATOM 1440 CD1 PHE B 74 3.058 -3.795 -0.601 1.00 0.00 C ATOM 1441 CD2 PHE B 74 3.620 -2.032 -2.098 1.00 0.00 C ATOM 1442 CE1 PHE B 74 4.227 -4.441 -0.916 1.00 0.00 C ATOM 1443 CE2 PHE B 74 4.804 -2.674 -2.412 1.00 0.00 C ATOM 1444 CZ PHE B 74 5.106 -3.885 -1.818 1.00 0.00 C ATOM 0 H PHE B 74 0.593 -4.552 0.283 1.00 0.00 H new ATOM 0 HA PHE B 74 -0.682 -2.181 -0.836 1.00 0.00 H new ATOM 0 HB2 PHE B 74 1.267 -1.103 -1.582 1.00 0.00 H new ATOM 0 HB3 PHE B 74 1.544 -1.424 0.118 1.00 0.00 H new ATOM 0 HD1 PHE B 74 2.388 -4.232 0.125 1.00 0.00 H new ATOM 0 HD2 PHE B 74 3.389 -1.082 -2.558 1.00 0.00 H new ATOM 0 HE1 PHE B 74 4.458 -5.390 -0.454 1.00 0.00 H new ATOM 0 HE2 PHE B 74 5.490 -2.231 -3.119 1.00 0.00 H new ATOM 0 HZ PHE B 74 6.028 -4.393 -2.060 1.00 0.00 H new ATOM 1454 N GLU B 75 -0.724 -3.360 -3.006 1.00 0.00 N ATOM 1455 CA GLU B 75 -0.904 -4.153 -4.216 1.00 0.00 C ATOM 1456 C GLU B 75 -0.676 -3.311 -5.467 1.00 0.00 C ATOM 1457 O GLU B 75 -1.276 -2.248 -5.632 1.00 0.00 O ATOM 1458 CB GLU B 75 -2.311 -4.756 -4.246 1.00 0.00 C ATOM 1459 CG GLU B 75 -2.618 -5.526 -5.521 1.00 0.00 C ATOM 1460 CD GLU B 75 -3.232 -4.652 -6.597 1.00 0.00 C ATOM 1461 OE1 GLU B 75 -4.353 -4.144 -6.382 1.00 0.00 O ATOM 1462 OE2 GLU B 75 -2.593 -4.477 -7.655 1.00 0.00 O ATOM 0 H GLU B 75 -1.314 -2.530 -2.954 1.00 0.00 H new ATOM 0 HA GLU B 75 -0.166 -4.955 -4.205 1.00 0.00 H new ATOM 0 HB2 GLU B 75 -2.429 -5.423 -3.392 1.00 0.00 H new ATOM 0 HB3 GLU B 75 -3.042 -3.956 -4.130 1.00 0.00 H new ATOM 0 HG2 GLU B 75 -1.699 -5.973 -5.901 1.00 0.00 H new ATOM 0 HG3 GLU B 75 -3.299 -6.345 -5.291 1.00 0.00 H new ATOM 1469 N SER B 76 0.188 -3.802 -6.349 1.00 0.00 N ATOM 1470 CA SER B 76 0.497 -3.103 -7.589 1.00 0.00 C ATOM 1471 C SER B 76 0.154 -3.964 -8.800 1.00 0.00 C ATOM 1472 O SER B 76 0.400 -5.170 -8.806 1.00 0.00 O ATOM 1473 CB SER B 76 1.977 -2.718 -7.626 1.00 0.00 C ATOM 1474 OG SER B 76 2.805 -3.857 -7.470 1.00 0.00 O ATOM 0 H SER B 76 0.687 -4.683 -6.227 1.00 0.00 H new ATOM 0 HA SER B 76 -0.109 -2.198 -7.627 1.00 0.00 H new ATOM 0 HB2 SER B 76 2.204 -2.226 -8.572 1.00 0.00 H new ATOM 0 HB3 SER B 76 2.189 -2.000 -6.834 1.00 0.00 H new ATOM 0 HG SER B 76 3.730 -3.571 -7.318 1.00 0.00 H new ATOM 1480 N GLY B 77 -0.417 -3.336 -9.822 1.00 0.00 N ATOM 1481 CA GLY B 77 -0.787 -4.059 -11.024 1.00 0.00 C ATOM 1482 C GLY B 77 0.399 -4.740 -11.680 1.00 0.00 C ATOM 1483 O GLY B 77 1.537 -4.580 -11.239 1.00 0.00 O ATOM 0 H GLY B 77 -0.630 -2.339 -9.839 1.00 0.00 H new ATOM 0 HA2 GLY B 77 -1.540 -4.807 -10.777 1.00 0.00 H new ATOM 0 HA3 GLY B 77 -1.244 -3.369 -11.733 1.00 0.00 H new ATOM 1487 N ARG B 78 0.131 -5.499 -12.737 1.00 0.00 N ATOM 1488 CA ARG B 78 1.182 -6.214 -13.452 1.00 0.00 C ATOM 1489 C ARG B 78 2.266 -5.254 -13.931 1.00 0.00 C ATOM 1490 O ARG B 78 1.973 -4.234 -14.555 1.00 0.00 O ATOM 1491 CB ARG B 78 0.592 -6.970 -14.644 1.00 0.00 C ATOM 1492 CG ARG B 78 1.122 -8.386 -14.791 1.00 0.00 C ATOM 1493 CD ARG B 78 1.113 -8.831 -16.243 1.00 0.00 C ATOM 1494 NE ARG B 78 0.152 -9.904 -16.482 1.00 0.00 N ATOM 1495 CZ ARG B 78 -0.333 -10.205 -17.683 1.00 0.00 C ATOM 1496 NH1 ARG B 78 0.055 -9.515 -18.747 1.00 0.00 N ATOM 1497 NH2 ARG B 78 -1.204 -11.195 -17.821 1.00 0.00 N ATOM 0 H ARG B 78 -0.805 -5.635 -13.118 1.00 0.00 H new ATOM 0 HA ARG B 78 1.634 -6.928 -12.764 1.00 0.00 H new ATOM 0 HB2 ARG B 78 -0.492 -7.006 -14.539 1.00 0.00 H new ATOM 0 HB3 ARG B 78 0.806 -6.415 -15.557 1.00 0.00 H new ATOM 0 HG2 ARG B 78 2.138 -8.439 -14.399 1.00 0.00 H new ATOM 0 HG3 ARG B 78 0.514 -9.068 -14.196 1.00 0.00 H new ATOM 0 HD2 ARG B 78 0.872 -7.981 -16.881 1.00 0.00 H new ATOM 0 HD3 ARG B 78 2.110 -9.169 -16.525 1.00 0.00 H new ATOM 0 HE ARG B 78 -0.165 -10.453 -15.683 1.00 0.00 H new ATOM 0 HH11 ARG B 78 0.726 -8.753 -18.644 1.00 0.00 H new ATOM 0 HH12 ARG B 78 -0.317 -9.746 -19.668 1.00 0.00 H new ATOM 0 HH21 ARG B 78 -1.504 -11.728 -17.005 1.00 0.00 H new ATOM 0 HH22 ARG B 78 -1.574 -11.424 -18.744 1.00 0.00 H new ATOM 1511 N ARG B 79 3.519 -5.586 -13.635 1.00 0.00 N ATOM 1512 CA ARG B 79 4.644 -4.750 -14.034 1.00 0.00 C ATOM 1513 C ARG B 79 5.932 -5.562 -14.113 1.00 0.00 C ATOM 1514 O ARG B 79 6.414 -5.874 -15.202 1.00 0.00 O ATOM 1515 CB ARG B 79 4.817 -3.591 -13.050 1.00 0.00 C ATOM 1516 CG ARG B 79 6.011 -2.702 -13.361 1.00 0.00 C ATOM 1517 CD ARG B 79 5.773 -1.860 -14.604 1.00 0.00 C ATOM 1518 NE ARG B 79 6.448 -2.410 -15.775 1.00 0.00 N ATOM 1519 CZ ARG B 79 6.727 -1.702 -16.865 1.00 0.00 C ATOM 1520 NH1 ARG B 79 6.390 -0.421 -16.930 1.00 0.00 N ATOM 1521 NH2 ARG B 79 7.343 -2.274 -17.890 1.00 0.00 N ATOM 0 H ARG B 79 3.780 -6.427 -13.121 1.00 0.00 H new ATOM 0 HA ARG B 79 4.431 -4.350 -15.025 1.00 0.00 H new ATOM 0 HB2 ARG B 79 3.912 -2.984 -13.054 1.00 0.00 H new ATOM 0 HB3 ARG B 79 4.927 -3.993 -12.043 1.00 0.00 H new ATOM 0 HG2 ARG B 79 6.210 -2.049 -12.511 1.00 0.00 H new ATOM 0 HG3 ARG B 79 6.898 -3.320 -13.503 1.00 0.00 H new ATOM 0 HD2 ARG B 79 4.703 -1.797 -14.799 1.00 0.00 H new ATOM 0 HD3 ARG B 79 6.125 -0.844 -14.426 1.00 0.00 H new ATOM 0 HE ARG B 79 6.721 -3.393 -15.756 1.00 0.00 H new ATOM 0 HH11 ARG B 79 5.916 0.022 -16.143 1.00 0.00 H new ATOM 0 HH12 ARG B 79 6.605 0.121 -17.767 1.00 0.00 H new ATOM 0 HH21 ARG B 79 7.604 -3.259 -17.843 1.00 0.00 H new ATOM 0 HH22 ARG B 79 7.556 -1.729 -18.725 1.00 0.00 H new ATOM 1535 N CYS B 80 6.490 -5.898 -12.954 1.00 0.00 N ATOM 1536 CA CYS B 80 7.732 -6.662 -12.900 1.00 0.00 C ATOM 1537 C CYS B 80 8.174 -6.892 -11.453 1.00 0.00 C ATOM 1538 O CYS B 80 7.350 -6.884 -10.539 1.00 0.00 O ATOM 1539 CB CYS B 80 8.825 -5.929 -13.683 1.00 0.00 C ATOM 1540 SG CYS B 80 9.765 -6.988 -14.808 1.00 0.00 S ATOM 0 H CYS B 80 6.103 -5.654 -12.042 1.00 0.00 H new ATOM 0 HA CYS B 80 7.559 -7.637 -13.355 1.00 0.00 H new ATOM 0 HB2 CYS B 80 8.367 -5.123 -14.257 1.00 0.00 H new ATOM 0 HB3 CYS B 80 9.514 -5.466 -12.977 1.00 0.00 H new ATOM 0 HG CYS B 80 10.662 -6.278 -15.425 1.00 0.00 H new ATOM 1546 N GLN B 81 9.476 -7.108 -11.255 1.00 0.00 N ATOM 1547 CA GLN B 81 10.030 -7.344 -9.924 1.00 0.00 C ATOM 1548 C GLN B 81 9.596 -8.703 -9.379 1.00 0.00 C ATOM 1549 O GLN B 81 10.314 -9.693 -9.520 1.00 0.00 O ATOM 1550 CB GLN B 81 9.615 -6.230 -8.957 1.00 0.00 C ATOM 1551 CG GLN B 81 10.696 -5.184 -8.735 1.00 0.00 C ATOM 1552 CD GLN B 81 11.042 -4.425 -10.001 1.00 0.00 C ATOM 1553 OE1 GLN B 81 11.906 -4.842 -10.772 1.00 0.00 O ATOM 1554 NE2 GLN B 81 10.365 -3.304 -10.222 1.00 0.00 N ATOM 0 H GLN B 81 10.168 -7.124 -12.005 1.00 0.00 H new ATOM 0 HA GLN B 81 11.116 -7.342 -10.013 1.00 0.00 H new ATOM 0 HB2 GLN B 81 8.721 -5.740 -9.342 1.00 0.00 H new ATOM 0 HB3 GLN B 81 9.348 -6.674 -7.998 1.00 0.00 H new ATOM 0 HG2 GLN B 81 10.363 -4.479 -7.973 1.00 0.00 H new ATOM 0 HG3 GLN B 81 11.593 -5.670 -8.350 1.00 0.00 H new ATOM 0 HE21 GLN B 81 9.657 -2.996 -9.555 1.00 0.00 H new ATOM 0 HE22 GLN B 81 10.553 -2.751 -11.058 1.00 0.00 H new ATOM 1563 N THR B 82 8.425 -8.744 -8.751 1.00 0.00 N ATOM 1564 CA THR B 82 7.912 -9.984 -8.179 1.00 0.00 C ATOM 1565 C THR B 82 6.766 -10.541 -9.017 1.00 0.00 C ATOM 1566 O THR B 82 6.660 -11.752 -9.212 1.00 0.00 O ATOM 1567 CB THR B 82 7.446 -9.748 -6.742 1.00 0.00 C ATOM 1568 OG1 THR B 82 6.246 -8.994 -6.720 1.00 0.00 O ATOM 1569 CG2 THR B 82 8.465 -9.018 -5.898 1.00 0.00 C ATOM 0 H THR B 82 7.815 -7.936 -8.626 1.00 0.00 H new ATOM 0 HA THR B 82 8.719 -10.716 -8.177 1.00 0.00 H new ATOM 0 HB THR B 82 7.293 -10.741 -6.320 1.00 0.00 H new ATOM 0 HG1 THR B 82 5.964 -8.855 -5.792 1.00 0.00 H new ATOM 0 HG21 THR B 82 8.073 -8.882 -4.890 1.00 0.00 H new ATOM 0 HG22 THR B 82 9.385 -9.600 -5.854 1.00 0.00 H new ATOM 0 HG23 THR B 82 8.673 -8.044 -6.340 1.00 0.00 H new ATOM 1577 N GLY B 83 5.912 -9.653 -9.514 1.00 0.00 N ATOM 1578 CA GLY B 83 4.794 -10.083 -10.332 1.00 0.00 C ATOM 1579 C GLY B 83 3.503 -9.367 -9.986 1.00 0.00 C ATOM 1580 O GLY B 83 3.517 -8.338 -9.310 1.00 0.00 O ATOM 0 H GLY B 83 5.974 -8.646 -9.365 1.00 0.00 H new ATOM 0 HA2 GLY B 83 5.030 -9.910 -11.382 1.00 0.00 H new ATOM 0 HA3 GLY B 83 4.652 -11.157 -10.210 1.00 0.00 H new ATOM 1584 N GLN B 84 2.385 -9.914 -10.453 1.00 0.00 N ATOM 1585 CA GLN B 84 1.076 -9.324 -10.198 1.00 0.00 C ATOM 1586 C GLN B 84 0.410 -9.972 -8.989 1.00 0.00 C ATOM 1587 O GLN B 84 0.498 -11.184 -8.796 1.00 0.00 O ATOM 1588 CB GLN B 84 0.179 -9.483 -11.428 1.00 0.00 C ATOM 1589 CG GLN B 84 -0.595 -8.225 -11.784 1.00 0.00 C ATOM 1590 CD GLN B 84 -1.967 -8.182 -11.141 1.00 0.00 C ATOM 1591 OE1 GLN B 84 -2.181 -7.479 -10.153 1.00 0.00 O ATOM 1592 NE2 GLN B 84 -2.906 -8.933 -11.703 1.00 0.00 N ATOM 0 H GLN B 84 2.360 -10.767 -11.011 1.00 0.00 H new ATOM 0 HA GLN B 84 1.218 -8.264 -9.987 1.00 0.00 H new ATOM 0 HB2 GLN B 84 0.793 -9.775 -12.280 1.00 0.00 H new ATOM 0 HB3 GLN B 84 -0.526 -10.295 -11.250 1.00 0.00 H new ATOM 0 HG2 GLN B 84 -0.024 -7.351 -11.471 1.00 0.00 H new ATOM 0 HG3 GLN B 84 -0.703 -8.164 -12.867 1.00 0.00 H new ATOM 0 HE21 GLN B 84 -2.684 -9.500 -12.521 1.00 0.00 H new ATOM 0 HE22 GLN B 84 -3.850 -8.943 -11.317 1.00 0.00 H new ATOM 1601 N GLY B 85 -0.262 -9.158 -8.180 1.00 0.00 N ATOM 1602 CA GLY B 85 -0.941 -9.679 -7.008 1.00 0.00 C ATOM 1603 C GLY B 85 -0.833 -8.762 -5.805 1.00 0.00 C ATOM 1604 O GLY B 85 -0.277 -7.667 -5.894 1.00 0.00 O ATOM 0 H GLY B 85 -0.348 -8.151 -8.315 1.00 0.00 H new ATOM 0 HA2 GLY B 85 -1.993 -9.837 -7.245 1.00 0.00 H new ATOM 0 HA3 GLY B 85 -0.522 -10.653 -6.755 1.00 0.00 H new ATOM 1608 N ILE B 86 -1.371 -9.215 -4.677 1.00 0.00 N ATOM 1609 CA ILE B 86 -1.339 -8.445 -3.439 1.00 0.00 C ATOM 1610 C ILE B 86 -0.084 -8.768 -2.634 1.00 0.00 C ATOM 1611 O ILE B 86 0.440 -9.880 -2.701 1.00 0.00 O ATOM 1612 CB ILE B 86 -2.593 -8.727 -2.582 1.00 0.00 C ATOM 1613 CG1 ILE B 86 -3.847 -8.255 -3.322 1.00 0.00 C ATOM 1614 CG2 ILE B 86 -2.491 -8.054 -1.218 1.00 0.00 C ATOM 1615 CD1 ILE B 86 -5.124 -8.443 -2.534 1.00 0.00 C ATOM 0 H ILE B 86 -1.838 -10.118 -4.595 1.00 0.00 H new ATOM 0 HA ILE B 86 -1.326 -7.388 -3.706 1.00 0.00 H new ATOM 0 HB ILE B 86 -2.661 -9.802 -2.417 1.00 0.00 H new ATOM 0 HG12 ILE B 86 -3.736 -7.200 -3.571 1.00 0.00 H new ATOM 0 HG13 ILE B 86 -3.928 -8.798 -4.264 1.00 0.00 H new ATOM 0 HG21 ILE B 86 -3.388 -8.270 -0.638 1.00 0.00 H new ATOM 0 HG22 ILE B 86 -1.616 -8.433 -0.690 1.00 0.00 H new ATOM 0 HG23 ILE B 86 -2.396 -6.976 -1.350 1.00 0.00 H new ATOM 0 HD11 ILE B 86 -5.970 -8.086 -3.122 1.00 0.00 H new ATOM 0 HD12 ILE B 86 -5.260 -9.501 -2.308 1.00 0.00 H new ATOM 0 HD13 ILE B 86 -5.064 -7.878 -1.604 1.00 0.00 H new ATOM 1627 N PHE B 87 0.388 -7.790 -1.870 1.00 0.00 N ATOM 1628 CA PHE B 87 1.581 -7.969 -1.058 1.00 0.00 C ATOM 1629 C PHE B 87 1.277 -7.776 0.424 1.00 0.00 C ATOM 1630 O PHE B 87 0.545 -6.859 0.804 1.00 0.00 O ATOM 1631 CB PHE B 87 2.652 -6.972 -1.477 1.00 0.00 C ATOM 1632 CG PHE B 87 2.885 -6.897 -2.957 1.00 0.00 C ATOM 1633 CD1 PHE B 87 2.993 -8.049 -3.720 1.00 0.00 C ATOM 1634 CD2 PHE B 87 3.034 -5.669 -3.579 1.00 0.00 C ATOM 1635 CE1 PHE B 87 3.224 -7.973 -5.081 1.00 0.00 C ATOM 1636 CE2 PHE B 87 3.265 -5.587 -4.937 1.00 0.00 C ATOM 1637 CZ PHE B 87 3.361 -6.740 -5.689 1.00 0.00 C ATOM 0 H PHE B 87 -0.038 -6.866 -1.797 1.00 0.00 H new ATOM 0 HA PHE B 87 1.937 -8.987 -1.213 1.00 0.00 H new ATOM 0 HB2 PHE B 87 2.372 -5.983 -1.115 1.00 0.00 H new ATOM 0 HB3 PHE B 87 3.589 -7.237 -0.987 1.00 0.00 H new ATOM 0 HD1 PHE B 87 2.896 -9.015 -3.247 1.00 0.00 H new ATOM 0 HD2 PHE B 87 2.969 -4.764 -2.994 1.00 0.00 H new ATOM 0 HE1 PHE B 87 3.297 -8.876 -5.668 1.00 0.00 H new ATOM 0 HE2 PHE B 87 3.370 -4.622 -5.410 1.00 0.00 H new ATOM 0 HZ PHE B 87 3.543 -6.679 -6.752 1.00 0.00 H new ATOM 1647 N ALA B 88 1.882 -8.615 1.257 1.00 0.00 N ATOM 1648 CA ALA B 88 1.712 -8.524 2.702 1.00 0.00 C ATOM 1649 C ALA B 88 3.054 -8.291 3.385 1.00 0.00 C ATOM 1650 O ALA B 88 4.050 -8.930 3.048 1.00 0.00 O ATOM 1651 CB ALA B 88 1.051 -9.783 3.240 1.00 0.00 C ATOM 0 H ALA B 88 2.498 -9.370 0.954 1.00 0.00 H new ATOM 0 HA ALA B 88 1.064 -7.675 2.920 1.00 0.00 H new ATOM 0 HB1 ALA B 88 0.932 -9.698 4.320 1.00 0.00 H new ATOM 0 HB2 ALA B 88 0.073 -9.907 2.776 1.00 0.00 H new ATOM 0 HB3 ALA B 88 1.674 -10.647 3.011 1.00 0.00 H new ATOM 1657 N PHE B 89 3.084 -7.357 4.329 1.00 0.00 N ATOM 1658 CA PHE B 89 4.314 -7.044 5.044 1.00 0.00 C ATOM 1659 C PHE B 89 4.051 -6.849 6.532 1.00 0.00 C ATOM 1660 O PHE B 89 2.981 -6.394 6.931 1.00 0.00 O ATOM 1661 CB PHE B 89 4.980 -5.799 4.445 1.00 0.00 C ATOM 1662 CG PHE B 89 5.911 -6.124 3.316 1.00 0.00 C ATOM 1663 CD1 PHE B 89 7.203 -6.548 3.571 1.00 0.00 C ATOM 1664 CD2 PHE B 89 5.483 -6.039 2.002 1.00 0.00 C ATOM 1665 CE1 PHE B 89 8.060 -6.865 2.536 1.00 0.00 C ATOM 1666 CE2 PHE B 89 6.334 -6.354 0.962 1.00 0.00 C ATOM 1667 CZ PHE B 89 7.624 -6.769 1.229 1.00 0.00 C ATOM 0 H PHE B 89 2.275 -6.806 4.615 1.00 0.00 H new ATOM 0 HA PHE B 89 4.993 -7.889 4.933 1.00 0.00 H new ATOM 0 HB2 PHE B 89 4.209 -5.116 4.089 1.00 0.00 H new ATOM 0 HB3 PHE B 89 5.532 -5.277 5.226 1.00 0.00 H new ATOM 0 HD1 PHE B 89 7.545 -6.632 4.592 1.00 0.00 H new ATOM 0 HD2 PHE B 89 4.473 -5.723 1.789 1.00 0.00 H new ATOM 0 HE1 PHE B 89 9.069 -7.187 2.748 1.00 0.00 H new ATOM 0 HE2 PHE B 89 5.992 -6.276 -0.059 1.00 0.00 H new ATOM 0 HZ PHE B 89 8.291 -7.018 0.417 1.00 0.00 H new ATOM 1677 N LYS B 90 5.025 -7.230 7.352 1.00 0.00 N ATOM 1678 CA LYS B 90 4.894 -7.119 8.800 1.00 0.00 C ATOM 1679 C LYS B 90 5.946 -6.174 9.372 1.00 0.00 C ATOM 1680 O LYS B 90 7.139 -6.478 9.362 1.00 0.00 O ATOM 1681 CB LYS B 90 5.026 -8.502 9.444 1.00 0.00 C ATOM 1682 CG LYS B 90 3.888 -9.445 9.103 1.00 0.00 C ATOM 1683 CD LYS B 90 4.355 -10.890 9.092 1.00 0.00 C ATOM 1684 CE LYS B 90 4.434 -11.457 10.497 1.00 0.00 C ATOM 1685 NZ LYS B 90 3.641 -12.710 10.641 1.00 0.00 N ATOM 0 H LYS B 90 5.914 -7.619 7.038 1.00 0.00 H new ATOM 0 HA LYS B 90 3.909 -6.710 9.025 1.00 0.00 H new ATOM 0 HB2 LYS B 90 5.967 -8.952 9.127 1.00 0.00 H new ATOM 0 HB3 LYS B 90 5.077 -8.385 10.527 1.00 0.00 H new ATOM 0 HG2 LYS B 90 3.084 -9.326 9.829 1.00 0.00 H new ATOM 0 HG3 LYS B 90 3.478 -9.186 8.127 1.00 0.00 H new ATOM 0 HD2 LYS B 90 3.670 -11.491 8.494 1.00 0.00 H new ATOM 0 HD3 LYS B 90 5.334 -10.954 8.617 1.00 0.00 H new ATOM 0 HE2 LYS B 90 5.476 -11.657 10.749 1.00 0.00 H new ATOM 0 HE3 LYS B 90 4.071 -10.715 11.208 1.00 0.00 H new ATOM 0 HZ1 LYS B 90 2.954 -12.599 11.414 1.00 0.00 H new ATOM 0 HZ2 LYS B 90 3.135 -12.905 9.753 1.00 0.00 H new ATOM 0 HZ3 LYS B 90 4.280 -13.502 10.857 1.00 0.00 H new ATOM 1699 N CYS B 91 5.495 -5.025 9.869 1.00 0.00 N ATOM 1700 CA CYS B 91 6.399 -4.033 10.441 1.00 0.00 C ATOM 1701 C CYS B 91 5.743 -3.304 11.608 1.00 0.00 C ATOM 1702 O CYS B 91 4.537 -3.412 11.822 1.00 0.00 O ATOM 1703 CB CYS B 91 6.818 -3.022 9.372 1.00 0.00 C ATOM 1704 SG CYS B 91 5.439 -2.121 8.627 1.00 0.00 S ATOM 0 H CYS B 91 4.510 -4.759 9.887 1.00 0.00 H new ATOM 0 HA CYS B 91 7.281 -4.555 10.811 1.00 0.00 H new ATOM 0 HB2 CYS B 91 7.509 -2.305 9.816 1.00 0.00 H new ATOM 0 HB3 CYS B 91 7.363 -3.545 8.586 1.00 0.00 H new ATOM 0 HG CYS B 91 5.894 -1.289 7.738 1.00 0.00 H new ATOM 1710 N ALA B 92 6.547 -2.553 12.355 1.00 0.00 N ATOM 1711 CA ALA B 92 6.044 -1.795 13.494 1.00 0.00 C ATOM 1712 C ALA B 92 5.780 -0.341 13.111 1.00 0.00 C ATOM 1713 O ALA B 92 4.981 0.343 13.751 1.00 0.00 O ATOM 1714 CB ALA B 92 7.025 -1.868 14.654 1.00 0.00 C ATOM 0 H ALA B 92 7.549 -2.454 12.191 1.00 0.00 H new ATOM 0 HA ALA B 92 5.099 -2.240 13.806 1.00 0.00 H new ATOM 0 HB1 ALA B 92 6.635 -1.297 15.497 1.00 0.00 H new ATOM 0 HB2 ALA B 92 7.160 -2.908 14.952 1.00 0.00 H new ATOM 0 HB3 ALA B 92 7.984 -1.451 14.346 1.00 0.00 H new ATOM 1720 N ARG B 93 6.450 0.122 12.060 1.00 0.00 N ATOM 1721 CA ARG B 93 6.284 1.492 11.590 1.00 0.00 C ATOM 1722 C ARG B 93 5.247 1.563 10.474 1.00 0.00 C ATOM 1723 O ARG B 93 5.279 2.466 9.637 1.00 0.00 O ATOM 1724 CB ARG B 93 7.621 2.048 11.096 1.00 0.00 C ATOM 1725 CG ARG B 93 8.539 2.508 12.217 1.00 0.00 C ATOM 1726 CD ARG B 93 9.826 1.699 12.253 1.00 0.00 C ATOM 1727 NE ARG B 93 10.060 1.103 13.565 1.00 0.00 N ATOM 1728 CZ ARG B 93 11.048 0.252 13.822 1.00 0.00 C ATOM 1729 NH1 ARG B 93 11.890 -0.099 12.859 1.00 0.00 N ATOM 1730 NH2 ARG B 93 11.195 -0.249 15.041 1.00 0.00 N ATOM 0 H ARG B 93 7.113 -0.432 11.518 1.00 0.00 H new ATOM 0 HA ARG B 93 5.933 2.097 12.426 1.00 0.00 H new ATOM 0 HB2 ARG B 93 8.130 1.282 10.512 1.00 0.00 H new ATOM 0 HB3 ARG B 93 7.431 2.886 10.426 1.00 0.00 H new ATOM 0 HG2 ARG B 93 8.776 3.564 12.084 1.00 0.00 H new ATOM 0 HG3 ARG B 93 8.023 2.415 13.172 1.00 0.00 H new ATOM 0 HD2 ARG B 93 9.781 0.912 11.500 1.00 0.00 H new ATOM 0 HD3 ARG B 93 10.666 2.342 11.992 1.00 0.00 H new ATOM 0 HE ARG B 93 9.430 1.354 14.327 1.00 0.00 H new ATOM 0 HH11 ARG B 93 11.780 0.284 11.920 1.00 0.00 H new ATOM 0 HH12 ARG B 93 12.648 -0.752 13.057 1.00 0.00 H new ATOM 0 HH21 ARG B 93 10.549 0.019 15.784 1.00 0.00 H new ATOM 0 HH22 ARG B 93 11.954 -0.902 15.236 1.00 0.00 H new ATOM 1744 N ALA B 94 4.325 0.604 10.471 1.00 0.00 N ATOM 1745 CA ALA B 94 3.274 0.557 9.463 1.00 0.00 C ATOM 1746 C ALA B 94 2.578 1.908 9.340 1.00 0.00 C ATOM 1747 O ALA B 94 2.225 2.337 8.241 1.00 0.00 O ATOM 1748 CB ALA B 94 2.267 -0.531 9.801 1.00 0.00 C ATOM 0 H ALA B 94 4.286 -0.151 11.156 1.00 0.00 H new ATOM 0 HA ALA B 94 3.732 0.323 8.502 1.00 0.00 H new ATOM 0 HB1 ALA B 94 1.488 -0.555 9.039 1.00 0.00 H new ATOM 0 HB2 ALA B 94 2.772 -1.497 9.834 1.00 0.00 H new ATOM 0 HB3 ALA B 94 1.819 -0.323 10.773 1.00 0.00 H new ATOM 1754 N GLU B 95 2.390 2.577 10.473 1.00 0.00 N ATOM 1755 CA GLU B 95 1.747 3.885 10.487 1.00 0.00 C ATOM 1756 C GLU B 95 2.542 4.880 9.659 1.00 0.00 C ATOM 1757 O GLU B 95 2.021 5.485 8.729 1.00 0.00 O ATOM 1758 CB GLU B 95 1.595 4.393 11.922 1.00 0.00 C ATOM 1759 CG GLU B 95 0.185 4.849 12.261 1.00 0.00 C ATOM 1760 CD GLU B 95 -0.146 4.678 13.731 1.00 0.00 C ATOM 1761 OE1 GLU B 95 -0.037 3.542 14.236 1.00 0.00 O ATOM 1762 OE2 GLU B 95 -0.515 5.682 14.376 1.00 0.00 O ATOM 0 H GLU B 95 2.673 2.235 11.391 1.00 0.00 H new ATOM 0 HA GLU B 95 0.755 3.782 10.047 1.00 0.00 H new ATOM 0 HB2 GLU B 95 1.887 3.601 12.612 1.00 0.00 H new ATOM 0 HB3 GLU B 95 2.284 5.223 12.079 1.00 0.00 H new ATOM 0 HG2 GLU B 95 0.070 5.898 11.986 1.00 0.00 H new ATOM 0 HG3 GLU B 95 -0.529 4.283 11.663 1.00 0.00 H new ATOM 1769 N GLU B 96 3.815 5.023 9.989 1.00 0.00 N ATOM 1770 CA GLU B 96 4.713 5.908 9.257 1.00 0.00 C ATOM 1771 C GLU B 96 4.551 5.745 7.758 1.00 0.00 C ATOM 1772 O GLU B 96 4.176 6.679 7.057 1.00 0.00 O ATOM 1773 CB GLU B 96 6.145 5.562 9.624 1.00 0.00 C ATOM 1774 CG GLU B 96 6.440 5.670 11.111 1.00 0.00 C ATOM 1775 CD GLU B 96 5.896 6.948 11.720 1.00 0.00 C ATOM 1776 OE1 GLU B 96 4.659 7.064 11.849 1.00 0.00 O ATOM 1777 OE2 GLU B 96 6.706 7.834 12.062 1.00 0.00 O ATOM 0 H GLU B 96 4.256 4.533 10.767 1.00 0.00 H new ATOM 0 HA GLU B 96 4.472 6.937 9.524 1.00 0.00 H new ATOM 0 HB2 GLU B 96 6.360 4.546 9.293 1.00 0.00 H new ATOM 0 HB3 GLU B 96 6.820 6.223 9.080 1.00 0.00 H new ATOM 0 HG2 GLU B 96 6.008 4.813 11.627 1.00 0.00 H new ATOM 0 HG3 GLU B 96 7.518 5.626 11.268 1.00 0.00 H new ATOM 1784 N LEU B 97 4.868 4.553 7.270 1.00 0.00 N ATOM 1785 CA LEU B 97 4.769 4.259 5.848 1.00 0.00 C ATOM 1786 C LEU B 97 3.426 4.735 5.289 1.00 0.00 C ATOM 1787 O LEU B 97 3.379 5.653 4.472 1.00 0.00 O ATOM 1788 CB LEU B 97 4.954 2.761 5.615 1.00 0.00 C ATOM 1789 CG LEU B 97 4.779 2.307 4.170 1.00 0.00 C ATOM 1790 CD1 LEU B 97 5.542 1.016 3.916 1.00 0.00 C ATOM 1791 CD2 LEU B 97 3.306 2.134 3.866 1.00 0.00 C ATOM 0 H LEU B 97 5.196 3.773 7.840 1.00 0.00 H new ATOM 0 HA LEU B 97 5.558 4.795 5.321 1.00 0.00 H new ATOM 0 HB2 LEU B 97 5.951 2.477 5.951 1.00 0.00 H new ATOM 0 HB3 LEU B 97 4.242 2.221 6.239 1.00 0.00 H new ATOM 0 HG LEU B 97 5.187 3.069 3.506 1.00 0.00 H new ATOM 0 HD11 LEU B 97 5.404 0.710 2.879 1.00 0.00 H new ATOM 0 HD12 LEU B 97 6.603 1.176 4.109 1.00 0.00 H new ATOM 0 HD13 LEU B 97 5.167 0.235 4.578 1.00 0.00 H new ATOM 0 HD21 LEU B 97 3.183 1.810 2.833 1.00 0.00 H new ATOM 0 HD22 LEU B 97 2.882 1.385 4.534 1.00 0.00 H new ATOM 0 HD23 LEU B 97 2.790 3.083 4.012 1.00 0.00 H new ATOM 1803 N PHE B 98 2.334 4.158 5.788 1.00 0.00 N ATOM 1804 CA PHE B 98 1.000 4.549 5.360 1.00 0.00 C ATOM 1805 C PHE B 98 0.824 6.063 5.397 1.00 0.00 C ATOM 1806 O PHE B 98 0.731 6.712 4.354 1.00 0.00 O ATOM 1807 CB PHE B 98 -0.047 3.892 6.253 1.00 0.00 C ATOM 1808 CG PHE B 98 -1.219 3.392 5.481 1.00 0.00 C ATOM 1809 CD1 PHE B 98 -1.053 2.392 4.545 1.00 0.00 C ATOM 1810 CD2 PHE B 98 -2.473 3.952 5.651 1.00 0.00 C ATOM 1811 CE1 PHE B 98 -2.118 1.939 3.804 1.00 0.00 C ATOM 1812 CE2 PHE B 98 -3.547 3.500 4.915 1.00 0.00 C ATOM 1813 CZ PHE B 98 -3.371 2.492 3.989 1.00 0.00 C ATOM 0 H PHE B 98 2.351 3.418 6.490 1.00 0.00 H new ATOM 0 HA PHE B 98 0.869 4.215 4.331 1.00 0.00 H new ATOM 0 HB2 PHE B 98 0.409 3.063 6.793 1.00 0.00 H new ATOM 0 HB3 PHE B 98 -0.387 4.610 6.999 1.00 0.00 H new ATOM 0 HD1 PHE B 98 -0.075 1.960 4.393 1.00 0.00 H new ATOM 0 HD2 PHE B 98 -2.611 4.750 6.366 1.00 0.00 H new ATOM 0 HE1 PHE B 98 -1.976 1.152 3.078 1.00 0.00 H new ATOM 0 HE2 PHE B 98 -4.525 3.934 5.063 1.00 0.00 H new ATOM 0 HZ PHE B 98 -4.210 2.136 3.410 1.00 0.00 H new ATOM 1823 N ASN B 99 0.763 6.617 6.610 1.00 0.00 N ATOM 1824 CA ASN B 99 0.602 8.059 6.811 1.00 0.00 C ATOM 1825 C ASN B 99 1.409 8.850 5.789 1.00 0.00 C ATOM 1826 O ASN B 99 0.875 9.701 5.073 1.00 0.00 O ATOM 1827 CB ASN B 99 1.050 8.444 8.223 1.00 0.00 C ATOM 1828 CG ASN B 99 -0.029 9.175 8.997 1.00 0.00 C ATOM 1829 OD1 ASN B 99 -0.215 10.381 8.838 1.00 0.00 O ATOM 1830 ND2 ASN B 99 -0.747 8.446 9.844 1.00 0.00 N ATOM 0 H ASN B 99 0.823 6.082 7.476 1.00 0.00 H new ATOM 0 HA ASN B 99 -0.453 8.301 6.681 1.00 0.00 H new ATOM 0 HB2 ASN B 99 1.336 7.544 8.767 1.00 0.00 H new ATOM 0 HB3 ASN B 99 1.937 9.074 8.160 1.00 0.00 H new ATOM 0 HD21 ASN B 99 -1.486 8.884 10.394 1.00 0.00 H new ATOM 0 HD22 ASN B 99 -0.559 7.449 9.945 1.00 0.00 H new ATOM 1837 N MET B 100 2.693 8.529 5.702 1.00 0.00 N ATOM 1838 CA MET B 100 3.570 9.176 4.746 1.00 0.00 C ATOM 1839 C MET B 100 2.972 9.083 3.349 1.00 0.00 C ATOM 1840 O MET B 100 2.570 10.088 2.770 1.00 0.00 O ATOM 1841 CB MET B 100 4.957 8.535 4.761 1.00 0.00 C ATOM 1842 CG MET B 100 6.057 9.460 4.266 1.00 0.00 C ATOM 1843 SD MET B 100 7.650 9.112 5.030 1.00 0.00 S ATOM 1844 CE MET B 100 7.645 7.324 4.984 1.00 0.00 C ATOM 0 H MET B 100 3.147 7.824 6.283 1.00 0.00 H new ATOM 0 HA MET B 100 3.672 10.224 5.027 1.00 0.00 H new ATOM 0 HB2 MET B 100 5.191 8.217 5.777 1.00 0.00 H new ATOM 0 HB3 MET B 100 4.941 7.638 4.142 1.00 0.00 H new ATOM 0 HG2 MET B 100 6.148 9.364 3.184 1.00 0.00 H new ATOM 0 HG3 MET B 100 5.778 10.493 4.472 1.00 0.00 H new ATOM 0 HE1 MET B 100 8.642 6.951 5.221 1.00 0.00 H new ATOM 0 HE2 MET B 100 6.932 6.943 5.715 1.00 0.00 H new ATOM 0 HE3 MET B 100 7.358 6.986 3.988 1.00 0.00 H new ATOM 1854 N LEU B 101 2.856 7.851 2.848 1.00 0.00 N ATOM 1855 CA LEU B 101 2.283 7.592 1.526 1.00 0.00 C ATOM 1856 C LEU B 101 1.050 8.455 1.272 1.00 0.00 C ATOM 1857 O LEU B 101 0.974 9.163 0.268 1.00 0.00 O ATOM 1858 CB LEU B 101 1.920 6.114 1.391 1.00 0.00 C ATOM 1859 CG LEU B 101 2.413 5.445 0.106 1.00 0.00 C ATOM 1860 CD1 LEU B 101 3.932 5.431 0.054 1.00 0.00 C ATOM 1861 CD2 LEU B 101 1.868 4.033 0.002 1.00 0.00 C ATOM 0 H LEU B 101 3.154 7.011 3.343 1.00 0.00 H new ATOM 0 HA LEU B 101 3.035 7.851 0.781 1.00 0.00 H new ATOM 0 HB2 LEU B 101 2.330 5.575 2.245 1.00 0.00 H new ATOM 0 HB3 LEU B 101 0.836 6.015 1.442 1.00 0.00 H new ATOM 0 HG LEU B 101 2.047 6.024 -0.742 1.00 0.00 H new ATOM 0 HD11 LEU B 101 4.260 4.951 -0.868 1.00 0.00 H new ATOM 0 HD12 LEU B 101 4.307 6.454 0.083 1.00 0.00 H new ATOM 0 HD13 LEU B 101 4.320 4.878 0.909 1.00 0.00 H new ATOM 0 HD21 LEU B 101 2.228 3.571 -0.917 1.00 0.00 H new ATOM 0 HD22 LEU B 101 2.206 3.449 0.858 1.00 0.00 H new ATOM 0 HD23 LEU B 101 0.778 4.063 -0.010 1.00 0.00 H new ATOM 1873 N GLN B 102 0.088 8.400 2.192 1.00 0.00 N ATOM 1874 CA GLN B 102 -1.130 9.195 2.070 1.00 0.00 C ATOM 1875 C GLN B 102 -0.788 10.651 1.774 1.00 0.00 C ATOM 1876 O GLN B 102 -1.480 11.324 1.011 1.00 0.00 O ATOM 1877 CB GLN B 102 -1.957 9.106 3.354 1.00 0.00 C ATOM 1878 CG GLN B 102 -2.496 7.714 3.636 1.00 0.00 C ATOM 1879 CD GLN B 102 -3.501 7.698 4.771 1.00 0.00 C ATOM 1880 OE1 GLN B 102 -3.294 8.329 5.807 1.00 0.00 O ATOM 1881 NE2 GLN B 102 -4.597 6.973 4.581 1.00 0.00 N ATOM 0 H GLN B 102 0.129 7.815 3.027 1.00 0.00 H new ATOM 0 HA GLN B 102 -1.718 8.796 1.243 1.00 0.00 H new ATOM 0 HB2 GLN B 102 -1.342 9.425 4.195 1.00 0.00 H new ATOM 0 HB3 GLN B 102 -2.792 9.803 3.287 1.00 0.00 H new ATOM 0 HG2 GLN B 102 -2.965 7.320 2.734 1.00 0.00 H new ATOM 0 HG3 GLN B 102 -1.667 7.050 3.880 1.00 0.00 H new ATOM 0 HE21 GLN B 102 -4.727 6.466 3.706 1.00 0.00 H new ATOM 0 HE22 GLN B 102 -5.309 6.924 5.310 1.00 0.00 H new ATOM 1890 N GLU B 103 0.302 11.119 2.372 1.00 0.00 N ATOM 1891 CA GLU B 103 0.766 12.483 2.167 1.00 0.00 C ATOM 1892 C GLU B 103 1.493 12.600 0.823 1.00 0.00 C ATOM 1893 O GLU B 103 1.319 13.577 0.094 1.00 0.00 O ATOM 1894 CB GLU B 103 1.652 12.904 3.359 1.00 0.00 C ATOM 1895 CG GLU B 103 2.887 13.713 3.002 1.00 0.00 C ATOM 1896 CD GLU B 103 2.563 15.144 2.621 1.00 0.00 C ATOM 1897 OE1 GLU B 103 1.535 15.361 1.946 1.00 0.00 O ATOM 1898 OE2 GLU B 103 3.338 16.048 2.997 1.00 0.00 O ATOM 0 H GLU B 103 0.882 10.569 3.006 1.00 0.00 H new ATOM 0 HA GLU B 103 -0.082 13.167 2.125 1.00 0.00 H new ATOM 0 HB2 GLU B 103 1.045 13.487 4.052 1.00 0.00 H new ATOM 0 HB3 GLU B 103 1.968 12.006 3.889 1.00 0.00 H new ATOM 0 HG2 GLU B 103 3.572 13.714 3.850 1.00 0.00 H new ATOM 0 HG3 GLU B 103 3.405 13.230 2.174 1.00 0.00 H new ATOM 1905 N ILE B 104 2.321 11.608 0.515 1.00 0.00 N ATOM 1906 CA ILE B 104 3.079 11.602 -0.731 1.00 0.00 C ATOM 1907 C ILE B 104 2.145 11.642 -1.936 1.00 0.00 C ATOM 1908 O ILE B 104 2.533 12.072 -3.023 1.00 0.00 O ATOM 1909 CB ILE B 104 3.991 10.360 -0.847 1.00 0.00 C ATOM 1910 CG1 ILE B 104 4.584 10.000 0.523 1.00 0.00 C ATOM 1911 CG2 ILE B 104 5.092 10.607 -1.872 1.00 0.00 C ATOM 1912 CD1 ILE B 104 5.769 9.061 0.466 1.00 0.00 C ATOM 0 H ILE B 104 2.485 10.797 1.111 1.00 0.00 H new ATOM 0 HA ILE B 104 3.704 12.495 -0.718 1.00 0.00 H new ATOM 0 HB ILE B 104 3.392 9.515 -1.188 1.00 0.00 H new ATOM 0 HG12 ILE B 104 4.888 10.918 1.026 1.00 0.00 H new ATOM 0 HG13 ILE B 104 3.805 9.545 1.134 1.00 0.00 H new ATOM 0 HG21 ILE B 104 5.727 9.724 -1.944 1.00 0.00 H new ATOM 0 HG22 ILE B 104 4.644 10.812 -2.845 1.00 0.00 H new ATOM 0 HG23 ILE B 104 5.693 11.462 -1.562 1.00 0.00 H new ATOM 0 HD11 ILE B 104 6.124 8.861 1.477 1.00 0.00 H new ATOM 0 HD12 ILE B 104 5.469 8.125 -0.005 1.00 0.00 H new ATOM 0 HD13 ILE B 104 6.569 9.520 -0.115 1.00 0.00 H new ATOM 1924 N MET B 105 0.912 11.190 -1.734 1.00 0.00 N ATOM 1925 CA MET B 105 -0.080 11.159 -2.800 1.00 0.00 C ATOM 1926 C MET B 105 -0.701 12.536 -3.016 1.00 0.00 C ATOM 1927 O MET B 105 -0.918 12.959 -4.152 1.00 0.00 O ATOM 1928 CB MET B 105 -1.169 10.140 -2.464 1.00 0.00 C ATOM 1929 CG MET B 105 -0.622 8.758 -2.146 1.00 0.00 C ATOM 1930 SD MET B 105 -0.731 7.631 -3.547 1.00 0.00 S ATOM 1931 CE MET B 105 0.135 6.204 -2.901 1.00 0.00 C ATOM 0 H MET B 105 0.576 10.839 -0.837 1.00 0.00 H new ATOM 0 HA MET B 105 0.419 10.866 -3.723 1.00 0.00 H new ATOM 0 HB2 MET B 105 -1.744 10.501 -1.611 1.00 0.00 H new ATOM 0 HB3 MET B 105 -1.859 10.065 -3.305 1.00 0.00 H new ATOM 0 HG2 MET B 105 0.419 8.846 -1.835 1.00 0.00 H new ATOM 0 HG3 MET B 105 -1.172 8.339 -1.303 1.00 0.00 H new ATOM 0 HE1 MET B 105 0.402 5.538 -3.722 1.00 0.00 H new ATOM 0 HE2 MET B 105 1.040 6.529 -2.388 1.00 0.00 H new ATOM 0 HE3 MET B 105 -0.509 5.674 -2.199 1.00 0.00 H new ATOM 1941 N GLN B 106 -0.986 13.231 -1.920 1.00 0.00 N ATOM 1942 CA GLN B 106 -1.575 14.556 -1.985 1.00 0.00 C ATOM 1943 C GLN B 106 -0.617 15.544 -2.641 1.00 0.00 C ATOM 1944 O GLN B 106 -1.040 16.557 -3.199 1.00 0.00 O ATOM 1945 CB GLN B 106 -1.940 15.040 -0.580 1.00 0.00 C ATOM 1946 CG GLN B 106 -2.375 13.935 0.372 1.00 0.00 C ATOM 1947 CD GLN B 106 -3.483 14.372 1.309 1.00 0.00 C ATOM 1948 OE1 GLN B 106 -4.450 15.010 0.892 1.00 0.00 O ATOM 1949 NE2 GLN B 106 -3.347 14.030 2.585 1.00 0.00 N ATOM 0 H GLN B 106 -0.816 12.893 -0.973 1.00 0.00 H new ATOM 0 HA GLN B 106 -2.479 14.497 -2.591 1.00 0.00 H new ATOM 0 HB2 GLN B 106 -1.080 15.555 -0.151 1.00 0.00 H new ATOM 0 HB3 GLN B 106 -2.743 15.773 -0.658 1.00 0.00 H new ATOM 0 HG2 GLN B 106 -2.712 13.075 -0.206 1.00 0.00 H new ATOM 0 HG3 GLN B 106 -1.517 13.608 0.959 1.00 0.00 H new ATOM 0 HE21 GLN B 106 -2.529 13.501 2.887 1.00 0.00 H new ATOM 0 HE22 GLN B 106 -4.061 14.296 3.263 1.00 0.00 H new ATOM 1958 N ASN B 107 0.676 15.243 -2.571 1.00 0.00 N ATOM 1959 CA ASN B 107 1.695 16.107 -3.152 1.00 0.00 C ATOM 1960 C ASN B 107 1.691 16.014 -4.675 1.00 0.00 C ATOM 1961 O ASN B 107 2.006 16.983 -5.366 1.00 0.00 O ATOM 1962 CB ASN B 107 3.076 15.732 -2.612 1.00 0.00 C ATOM 1963 CG ASN B 107 3.824 16.929 -2.059 1.00 0.00 C ATOM 1964 OD1 ASN B 107 4.684 17.501 -2.728 1.00 0.00 O ATOM 1965 ND2 ASN B 107 3.499 17.315 -0.830 1.00 0.00 N ATOM 0 H ASN B 107 1.042 14.406 -2.117 1.00 0.00 H new ATOM 0 HA ASN B 107 1.465 17.135 -2.871 1.00 0.00 H new ATOM 0 HB2 ASN B 107 2.966 14.982 -1.829 1.00 0.00 H new ATOM 0 HB3 ASN B 107 3.663 15.276 -3.409 1.00 0.00 H new ATOM 0 HD21 ASN B 107 3.969 18.115 -0.406 1.00 0.00 H new ATOM 0 HD22 ASN B 107 2.780 16.812 -0.311 1.00 0.00 H new ATOM 1972 N ASN B 108 1.336 14.842 -5.193 1.00 0.00 N ATOM 1973 CA ASN B 108 1.297 14.626 -6.635 1.00 0.00 C ATOM 1974 C ASN B 108 -0.121 14.312 -7.109 1.00 0.00 C ATOM 1975 O ASN B 108 -0.312 13.735 -8.179 1.00 0.00 O ATOM 1976 CB ASN B 108 2.238 13.483 -7.022 1.00 0.00 C ATOM 1977 CG ASN B 108 3.085 13.818 -8.234 1.00 0.00 C ATOM 1978 OD1 ASN B 108 4.241 14.221 -8.106 1.00 0.00 O ATOM 1979 ND2 ASN B 108 2.510 13.655 -9.420 1.00 0.00 N ATOM 0 H ASN B 108 1.072 14.029 -4.637 1.00 0.00 H new ATOM 0 HA ASN B 108 1.624 15.545 -7.121 1.00 0.00 H new ATOM 0 HB2 ASN B 108 2.890 13.251 -6.179 1.00 0.00 H new ATOM 0 HB3 ASN B 108 1.652 12.587 -7.228 1.00 0.00 H new ATOM 0 HD21 ASN B 108 3.029 13.866 -10.272 1.00 0.00 H new ATOM 0 HD22 ASN B 108 1.549 13.318 -9.479 1.00 0.00 H new ATOM 1986 N SER B 109 -1.112 14.688 -6.304 1.00 0.00 N ATOM 1987 CA SER B 109 -2.508 14.448 -6.650 1.00 0.00 C ATOM 1988 C SER B 109 -2.734 12.991 -7.040 1.00 0.00 C ATOM 1989 O SER B 109 -3.672 12.672 -7.770 1.00 0.00 O ATOM 1990 CB SER B 109 -2.925 15.362 -7.800 1.00 0.00 C ATOM 1991 OG SER B 109 -3.652 16.482 -7.326 1.00 0.00 O ATOM 0 H SER B 109 -0.973 15.159 -5.410 1.00 0.00 H new ATOM 0 HA SER B 109 -3.117 14.666 -5.773 1.00 0.00 H new ATOM 0 HB2 SER B 109 -2.040 15.701 -8.338 1.00 0.00 H new ATOM 0 HB3 SER B 109 -3.535 14.803 -8.510 1.00 0.00 H new ATOM 0 HG SER B 109 -3.905 17.052 -8.082 1.00 0.00 H new ATOM 1997 N ILE B 110 -1.867 12.111 -6.552 1.00 0.00 N ATOM 1998 CA ILE B 110 -1.972 10.687 -6.849 1.00 0.00 C ATOM 1999 C ILE B 110 -3.340 10.144 -6.443 1.00 0.00 C ATOM 2000 O ILE B 110 -4.051 10.760 -5.648 1.00 0.00 O ATOM 2001 CB ILE B 110 -0.871 9.883 -6.131 1.00 0.00 C ATOM 2002 CG1 ILE B 110 0.508 10.461 -6.457 1.00 0.00 C ATOM 2003 CG2 ILE B 110 -0.940 8.417 -6.526 1.00 0.00 C ATOM 2004 CD1 ILE B 110 1.653 9.646 -5.897 1.00 0.00 C ATOM 0 H ILE B 110 -1.083 12.359 -5.948 1.00 0.00 H new ATOM 0 HA ILE B 110 -1.846 10.573 -7.926 1.00 0.00 H new ATOM 0 HB ILE B 110 -1.033 9.958 -5.056 1.00 0.00 H new ATOM 0 HG12 ILE B 110 0.617 10.530 -7.539 1.00 0.00 H new ATOM 0 HG13 ILE B 110 0.569 11.476 -6.065 1.00 0.00 H new ATOM 0 HG21 ILE B 110 -0.155 7.864 -6.010 1.00 0.00 H new ATOM 0 HG22 ILE B 110 -1.913 8.011 -6.249 1.00 0.00 H new ATOM 0 HG23 ILE B 110 -0.801 8.323 -7.603 1.00 0.00 H new ATOM 0 HD11 ILE B 110 2.599 10.115 -6.167 1.00 0.00 H new ATOM 0 HD12 ILE B 110 1.569 9.598 -4.811 1.00 0.00 H new ATOM 0 HD13 ILE B 110 1.617 8.637 -6.309 1.00 0.00 H new ATOM 2016 N ASN B 111 -3.700 8.983 -6.983 1.00 0.00 N ATOM 2017 CA ASN B 111 -4.992 8.373 -6.689 1.00 0.00 C ATOM 2018 C ASN B 111 -4.913 7.464 -5.468 1.00 0.00 C ATOM 2019 O ASN B 111 -4.088 6.553 -5.411 1.00 0.00 O ATOM 2020 CB ASN B 111 -5.488 7.560 -7.890 1.00 0.00 C ATOM 2021 CG ASN B 111 -5.139 8.205 -9.217 1.00 0.00 C ATOM 2022 OD1 ASN B 111 -4.276 7.720 -9.949 1.00 0.00 O ATOM 2023 ND2 ASN B 111 -5.810 9.307 -9.535 1.00 0.00 N ATOM 0 H ASN B 111 -3.116 8.447 -7.625 1.00 0.00 H new ATOM 0 HA ASN B 111 -5.692 9.181 -6.479 1.00 0.00 H new ATOM 0 HB2 ASN B 111 -5.054 6.561 -7.851 1.00 0.00 H new ATOM 0 HB3 ASN B 111 -6.569 7.441 -7.822 1.00 0.00 H new ATOM 0 HD21 ASN B 111 -5.618 9.785 -10.415 1.00 0.00 H new ATOM 0 HD22 ASN B 111 -6.517 9.675 -8.899 1.00 0.00 H new ATOM 2030 N VAL B 112 -5.793 7.711 -4.505 1.00 0.00 N ATOM 2031 CA VAL B 112 -5.883 6.883 -3.309 1.00 0.00 C ATOM 2032 C VAL B 112 -7.333 6.758 -2.874 1.00 0.00 C ATOM 2033 O VAL B 112 -7.682 7.058 -1.732 1.00 0.00 O ATOM 2034 CB VAL B 112 -5.046 7.429 -2.139 1.00 0.00 C ATOM 2035 CG1 VAL B 112 -3.566 7.185 -2.373 1.00 0.00 C ATOM 2036 CG2 VAL B 112 -5.320 8.897 -1.908 1.00 0.00 C ATOM 0 H VAL B 112 -6.459 8.484 -4.530 1.00 0.00 H new ATOM 0 HA VAL B 112 -5.478 5.906 -3.572 1.00 0.00 H new ATOM 0 HB VAL B 112 -5.341 6.890 -1.239 1.00 0.00 H new ATOM 0 HG11 VAL B 112 -2.995 7.580 -1.533 1.00 0.00 H new ATOM 0 HG12 VAL B 112 -3.384 6.114 -2.465 1.00 0.00 H new ATOM 0 HG13 VAL B 112 -3.255 7.686 -3.290 1.00 0.00 H new ATOM 0 HG21 VAL B 112 -4.714 9.254 -1.075 1.00 0.00 H new ATOM 0 HG22 VAL B 112 -5.069 9.460 -2.807 1.00 0.00 H new ATOM 0 HG23 VAL B 112 -6.375 9.038 -1.675 1.00 0.00 H new ATOM 2046 N VAL B 113 -8.179 6.320 -3.803 1.00 0.00 N ATOM 2047 CA VAL B 113 -9.604 6.171 -3.537 1.00 0.00 C ATOM 2048 C VAL B 113 -9.853 5.512 -2.183 1.00 0.00 C ATOM 2049 O VAL B 113 -9.739 4.297 -2.030 1.00 0.00 O ATOM 2050 CB VAL B 113 -10.304 5.361 -4.641 1.00 0.00 C ATOM 2051 CG1 VAL B 113 -10.280 6.120 -5.957 1.00 0.00 C ATOM 2052 CG2 VAL B 113 -9.653 4.005 -4.809 1.00 0.00 C ATOM 0 H VAL B 113 -7.899 6.062 -4.749 1.00 0.00 H new ATOM 0 HA VAL B 113 -10.026 7.176 -3.521 1.00 0.00 H new ATOM 0 HB VAL B 113 -11.342 5.211 -4.343 1.00 0.00 H new ATOM 0 HG11 VAL B 113 -10.780 5.531 -6.726 1.00 0.00 H new ATOM 0 HG12 VAL B 113 -10.796 7.073 -5.837 1.00 0.00 H new ATOM 0 HG13 VAL B 113 -9.247 6.302 -6.253 1.00 0.00 H new ATOM 0 HG21 VAL B 113 -10.165 3.450 -5.595 1.00 0.00 H new ATOM 0 HG22 VAL B 113 -8.605 4.135 -5.080 1.00 0.00 H new ATOM 0 HG23 VAL B 113 -9.719 3.451 -3.872 1.00 0.00 H new ATOM 2062 N GLU B 114 -10.160 6.334 -1.194 1.00 0.00 N ATOM 2063 CA GLU B 114 -10.417 5.838 0.149 1.00 0.00 C ATOM 2064 C GLU B 114 -11.894 5.518 0.316 1.00 0.00 C ATOM 2065 O GLU B 114 -12.758 6.337 0.003 1.00 0.00 O ATOM 2066 CB GLU B 114 -9.958 6.851 1.202 1.00 0.00 C ATOM 2067 CG GLU B 114 -8.758 7.681 0.773 1.00 0.00 C ATOM 2068 CD GLU B 114 -8.415 8.769 1.771 1.00 0.00 C ATOM 2069 OE1 GLU B 114 -8.507 8.508 2.989 1.00 0.00 O ATOM 2070 OE2 GLU B 114 -8.052 9.882 1.335 1.00 0.00 O ATOM 0 H GLU B 114 -10.237 7.346 -1.294 1.00 0.00 H new ATOM 0 HA GLU B 114 -9.844 4.922 0.295 1.00 0.00 H new ATOM 0 HB2 GLU B 114 -10.786 7.520 1.434 1.00 0.00 H new ATOM 0 HB3 GLU B 114 -9.710 6.319 2.121 1.00 0.00 H new ATOM 0 HG2 GLU B 114 -7.896 7.027 0.644 1.00 0.00 H new ATOM 0 HG3 GLU B 114 -8.962 8.134 -0.197 1.00 0.00 H new ATOM 2077 N GLU B 115 -12.176 4.316 0.801 1.00 0.00 N ATOM 2078 CA GLU B 115 -13.551 3.866 0.955 1.00 0.00 C ATOM 2079 C GLU B 115 -14.116 4.269 2.318 1.00 0.00 C ATOM 2080 O GLU B 115 -15.018 5.103 2.394 1.00 0.00 O ATOM 2081 CB GLU B 115 -13.639 2.352 0.738 1.00 0.00 C ATOM 2082 CG GLU B 115 -13.600 1.950 -0.729 1.00 0.00 C ATOM 2083 CD GLU B 115 -14.372 0.675 -1.006 1.00 0.00 C ATOM 2084 OE1 GLU B 115 -14.304 -0.253 -0.172 1.00 0.00 O ATOM 2085 OE2 GLU B 115 -15.045 0.604 -2.056 1.00 0.00 O ATOM 0 H GLU B 115 -11.473 3.638 1.093 1.00 0.00 H new ATOM 0 HA GLU B 115 -14.162 4.356 0.196 1.00 0.00 H new ATOM 0 HB2 GLU B 115 -12.814 1.869 1.262 1.00 0.00 H new ATOM 0 HB3 GLU B 115 -14.562 1.981 1.185 1.00 0.00 H new ATOM 0 HG2 GLU B 115 -14.011 2.758 -1.334 1.00 0.00 H new ATOM 0 HG3 GLU B 115 -12.563 1.817 -1.038 1.00 0.00 H new ATOM 2092 N PRO B 116 -13.574 3.722 3.417 1.00 0.00 N ATOM 2093 CA PRO B 116 -14.014 4.077 4.767 1.00 0.00 C ATOM 2094 C PRO B 116 -13.689 5.515 5.112 1.00 0.00 C ATOM 2095 O PRO B 116 -12.526 5.913 5.175 1.00 0.00 O ATOM 2096 CB PRO B 116 -13.240 3.130 5.668 1.00 0.00 C ATOM 2097 CG PRO B 116 -12.037 2.766 4.873 1.00 0.00 C ATOM 2098 CD PRO B 116 -12.485 2.741 3.439 1.00 0.00 C ATOM 0 HA PRO B 116 -15.095 3.989 4.874 1.00 0.00 H new ATOM 0 HB2 PRO B 116 -12.966 3.610 6.607 1.00 0.00 H new ATOM 0 HB3 PRO B 116 -13.831 2.250 5.921 1.00 0.00 H new ATOM 0 HG2 PRO B 116 -11.237 3.492 5.020 1.00 0.00 H new ATOM 0 HG3 PRO B 116 -11.646 1.795 5.177 1.00 0.00 H new ATOM 0 HD2 PRO B 116 -11.679 3.017 2.759 1.00 0.00 H new ATOM 0 HD3 PRO B 116 -12.828 1.750 3.140 1.00 0.00 H new ATOM 2106 N VAL B 117 -14.734 6.284 5.320 1.00 0.00 N ATOM 2107 CA VAL B 117 -14.603 7.687 5.670 1.00 0.00 C ATOM 2108 C VAL B 117 -15.738 8.081 6.597 1.00 0.00 C ATOM 2109 O VAL B 117 -16.278 9.185 6.525 1.00 0.00 O ATOM 2110 CB VAL B 117 -14.610 8.601 4.426 1.00 0.00 C ATOM 2111 CG1 VAL B 117 -13.779 9.848 4.679 1.00 0.00 C ATOM 2112 CG2 VAL B 117 -14.100 7.868 3.190 1.00 0.00 C ATOM 0 H VAL B 117 -15.698 5.959 5.252 1.00 0.00 H new ATOM 0 HA VAL B 117 -13.642 7.818 6.167 1.00 0.00 H new ATOM 0 HB VAL B 117 -15.643 8.895 4.237 1.00 0.00 H new ATOM 0 HG11 VAL B 117 -13.794 10.482 3.792 1.00 0.00 H new ATOM 0 HG12 VAL B 117 -14.194 10.397 5.524 1.00 0.00 H new ATOM 0 HG13 VAL B 117 -12.751 9.561 4.902 1.00 0.00 H new ATOM 0 HG21 VAL B 117 -14.119 8.542 2.334 1.00 0.00 H new ATOM 0 HG22 VAL B 117 -13.078 7.530 3.363 1.00 0.00 H new ATOM 0 HG23 VAL B 117 -14.738 7.007 2.988 1.00 0.00 H new ATOM 2122 N VAL B 118 -16.117 7.128 7.437 1.00 0.00 N ATOM 2123 CA VAL B 118 -17.200 7.305 8.398 1.00 0.00 C ATOM 2124 C VAL B 118 -18.381 8.060 7.787 1.00 0.00 C ATOM 2125 O VAL B 118 -18.391 9.290 7.750 1.00 0.00 O ATOM 2126 CB VAL B 118 -16.744 8.031 9.686 1.00 0.00 C ATOM 2127 CG1 VAL B 118 -16.735 7.066 10.862 1.00 0.00 C ATOM 2128 CG2 VAL B 118 -15.379 8.678 9.514 1.00 0.00 C ATOM 0 H VAL B 118 -15.681 6.206 7.472 1.00 0.00 H new ATOM 0 HA VAL B 118 -17.517 6.298 8.668 1.00 0.00 H new ATOM 0 HB VAL B 118 -17.460 8.828 9.889 1.00 0.00 H new ATOM 0 HG11 VAL B 118 -16.412 7.591 11.761 1.00 0.00 H new ATOM 0 HG12 VAL B 118 -17.739 6.669 11.014 1.00 0.00 H new ATOM 0 HG13 VAL B 118 -16.048 6.246 10.654 1.00 0.00 H new ATOM 0 HG21 VAL B 118 -15.094 9.178 10.440 1.00 0.00 H new ATOM 0 HG22 VAL B 118 -14.641 7.913 9.273 1.00 0.00 H new ATOM 0 HG23 VAL B 118 -15.422 9.408 8.706 1.00 0.00 H new ATOM 2138 N GLU B 119 -19.373 7.313 7.315 1.00 0.00 N ATOM 2139 CA GLU B 119 -20.559 7.908 6.709 1.00 0.00 C ATOM 2140 C GLU B 119 -21.689 8.024 7.727 1.00 0.00 C ATOM 2141 O GLU B 119 -21.524 7.674 8.895 1.00 0.00 O ATOM 2142 CB GLU B 119 -21.020 7.071 5.514 1.00 0.00 C ATOM 2143 CG GLU B 119 -20.322 7.431 4.213 1.00 0.00 C ATOM 2144 CD GLU B 119 -19.422 6.321 3.707 1.00 0.00 C ATOM 2145 OE1 GLU B 119 -18.299 6.179 4.236 1.00 0.00 O ATOM 2146 OE2 GLU B 119 -19.840 5.593 2.782 1.00 0.00 O ATOM 0 H GLU B 119 -19.380 6.293 7.340 1.00 0.00 H new ATOM 0 HA GLU B 119 -20.298 8.909 6.365 1.00 0.00 H new ATOM 0 HB2 GLU B 119 -20.846 6.017 5.730 1.00 0.00 H new ATOM 0 HB3 GLU B 119 -22.095 7.197 5.386 1.00 0.00 H new ATOM 0 HG2 GLU B 119 -21.071 7.660 3.455 1.00 0.00 H new ATOM 0 HG3 GLU B 119 -19.730 8.335 4.360 1.00 0.00 H new ATOM 2153 N ARG B 120 -22.838 8.519 7.276 1.00 0.00 N ATOM 2154 CA ARG B 120 -23.995 8.680 8.148 1.00 0.00 C ATOM 2155 C ARG B 120 -25.289 8.380 7.400 1.00 0.00 C ATOM 2156 O ARG B 120 -25.530 8.914 6.317 1.00 0.00 O ATOM 2157 CB ARG B 120 -24.040 10.100 8.715 1.00 0.00 C ATOM 2158 CG ARG B 120 -22.991 10.363 9.783 1.00 0.00 C ATOM 2159 CD ARG B 120 -22.648 11.841 9.876 1.00 0.00 C ATOM 2160 NE ARG B 120 -21.296 12.058 10.379 1.00 0.00 N ATOM 2161 CZ ARG B 120 -20.639 13.206 10.252 1.00 0.00 C ATOM 2162 NH1 ARG B 120 -21.209 14.234 9.639 1.00 0.00 N ATOM 2163 NH2 ARG B 120 -19.410 13.326 10.737 1.00 0.00 N ATOM 0 H ARG B 120 -22.992 8.815 6.312 1.00 0.00 H new ATOM 0 HA ARG B 120 -23.898 7.970 8.969 1.00 0.00 H new ATOM 0 HB2 ARG B 120 -23.904 10.812 7.901 1.00 0.00 H new ATOM 0 HB3 ARG B 120 -25.029 10.283 9.136 1.00 0.00 H new ATOM 0 HG2 ARG B 120 -23.357 10.012 10.748 1.00 0.00 H new ATOM 0 HG3 ARG B 120 -22.090 9.793 9.557 1.00 0.00 H new ATOM 0 HD2 ARG B 120 -22.746 12.299 8.892 1.00 0.00 H new ATOM 0 HD3 ARG B 120 -23.363 12.338 10.531 1.00 0.00 H new ATOM 0 HE ARG B 120 -20.829 11.286 10.855 1.00 0.00 H new ATOM 0 HH11 ARG B 120 -22.153 14.144 9.264 1.00 0.00 H new ATOM 0 HH12 ARG B 120 -20.703 15.115 9.542 1.00 0.00 H new ATOM 0 HH21 ARG B 120 -18.968 12.536 11.208 1.00 0.00 H new ATOM 0 HH22 ARG B 120 -18.907 14.208 10.639 1.00 0.00 H new ATOM 2177 N ASN B 121 -26.121 7.525 7.986 1.00 0.00 N ATOM 2178 CA ASN B 121 -27.392 7.155 7.375 1.00 0.00 C ATOM 2179 C ASN B 121 -27.172 6.469 6.031 1.00 0.00 C ATOM 2180 O ASN B 121 -27.213 5.243 5.934 1.00 0.00 O ATOM 2181 CB ASN B 121 -28.272 8.392 7.190 1.00 0.00 C ATOM 2182 CG ASN B 121 -28.907 8.851 8.489 1.00 0.00 C ATOM 2183 OD1 ASN B 121 -28.225 9.353 9.383 1.00 0.00 O ATOM 2184 ND2 ASN B 121 -30.219 8.683 8.598 1.00 0.00 N ATOM 0 H ASN B 121 -25.938 7.076 8.883 1.00 0.00 H new ATOM 0 HA ASN B 121 -27.896 6.455 8.042 1.00 0.00 H new ATOM 0 HB2 ASN B 121 -27.672 9.202 6.776 1.00 0.00 H new ATOM 0 HB3 ASN B 121 -29.055 8.172 6.464 1.00 0.00 H new ATOM 0 HD21 ASN B 121 -30.702 8.975 9.448 1.00 0.00 H new ATOM 0 HD22 ASN B 121 -30.745 8.262 7.832 1.00 0.00 H new ATOM 2191 N ASN B 122 -26.941 7.269 4.995 1.00 0.00 N ATOM 2192 CA ASN B 122 -26.716 6.738 3.656 1.00 0.00 C ATOM 2193 C ASN B 122 -26.490 7.863 2.652 1.00 0.00 C ATOM 2194 O ASN B 122 -27.355 8.717 2.456 1.00 0.00 O ATOM 2195 CB ASN B 122 -27.907 5.882 3.219 1.00 0.00 C ATOM 2196 CG ASN B 122 -27.486 4.682 2.393 1.00 0.00 C ATOM 2197 OD1 ASN B 122 -26.398 4.136 2.581 1.00 0.00 O ATOM 2198 ND2 ASN B 122 -28.347 4.265 1.473 1.00 0.00 N ATOM 0 H ASN B 122 -26.905 8.286 5.057 1.00 0.00 H new ATOM 0 HA ASN B 122 -25.820 6.118 3.685 1.00 0.00 H new ATOM 0 HB2 ASN B 122 -28.448 5.540 4.101 1.00 0.00 H new ATOM 0 HB3 ASN B 122 -28.597 6.494 2.639 1.00 0.00 H new ATOM 0 HD21 ASN B 122 -28.118 3.462 0.887 1.00 0.00 H new ATOM 0 HD22 ASN B 122 -29.237 4.748 1.352 1.00 0.00 H new ATOM 2205 N HIS B 123 -25.321 7.858 2.019 1.00 0.00 N ATOM 2206 CA HIS B 123 -24.981 8.879 1.035 1.00 0.00 C ATOM 2207 C HIS B 123 -25.498 8.496 -0.348 1.00 0.00 C ATOM 2208 O HIS B 123 -26.150 9.295 -1.020 1.00 0.00 O ATOM 2209 CB HIS B 123 -23.465 9.082 0.985 1.00 0.00 C ATOM 2210 CG HIS B 123 -23.054 10.380 0.362 1.00 0.00 C ATOM 2211 ND1 HIS B 123 -23.236 11.602 0.978 1.00 0.00 N ATOM 2212 CD2 HIS B 123 -22.466 10.645 -0.829 1.00 0.00 C ATOM 2213 CE1 HIS B 123 -22.778 12.561 0.192 1.00 0.00 C ATOM 2214 NE2 HIS B 123 -22.306 12.007 -0.909 1.00 0.00 N ATOM 0 H HIS B 123 -24.594 7.159 2.170 1.00 0.00 H new ATOM 0 HA HIS B 123 -25.458 9.812 1.336 1.00 0.00 H new ATOM 0 HB2 HIS B 123 -23.067 9.033 1.998 1.00 0.00 H new ATOM 0 HB3 HIS B 123 -23.015 8.262 0.426 1.00 0.00 H new ATOM 0 HD2 HIS B 123 -22.177 9.921 -1.576 1.00 0.00 H new ATOM 0 HE1 HIS B 123 -22.788 13.618 0.413 1.00 0.00 H new ATOM 0 HE2 HIS B 123 -21.890 12.509 -1.693 1.00 0.00 H new ATOM 2223 N GLN B 124 -25.202 7.271 -0.767 1.00 0.00 N ATOM 2224 CA GLN B 124 -25.636 6.784 -2.071 1.00 0.00 C ATOM 2225 C GLN B 124 -27.098 6.349 -2.033 1.00 0.00 C ATOM 2226 O GLN B 124 -27.678 6.181 -0.960 1.00 0.00 O ATOM 2227 CB GLN B 124 -24.758 5.613 -2.519 1.00 0.00 C ATOM 2228 CG GLN B 124 -23.420 6.042 -3.098 1.00 0.00 C ATOM 2229 CD GLN B 124 -22.278 5.155 -2.644 1.00 0.00 C ATOM 2230 OE1 GLN B 124 -22.070 4.068 -3.181 1.00 0.00 O ATOM 2231 NE2 GLN B 124 -21.531 5.616 -1.647 1.00 0.00 N ATOM 0 H GLN B 124 -24.663 6.597 -0.223 1.00 0.00 H new ATOM 0 HA GLN B 124 -25.537 7.601 -2.786 1.00 0.00 H new ATOM 0 HB2 GLN B 124 -24.582 4.955 -1.668 1.00 0.00 H new ATOM 0 HB3 GLN B 124 -25.297 5.030 -3.266 1.00 0.00 H new ATOM 0 HG2 GLN B 124 -23.477 6.026 -4.186 1.00 0.00 H new ATOM 0 HG3 GLN B 124 -23.214 7.071 -2.805 1.00 0.00 H new ATOM 0 HE21 GLN B 124 -21.740 6.524 -1.231 1.00 0.00 H new ATOM 0 HE22 GLN B 124 -20.749 5.062 -1.298 1.00 0.00 H new ATOM 2240 N THR B 125 -27.687 6.168 -3.211 1.00 0.00 N ATOM 2241 CA THR B 125 -29.079 5.748 -3.313 1.00 0.00 C ATOM 2242 C THR B 125 -29.216 4.535 -4.227 1.00 0.00 C ATOM 2243 O THR B 125 -28.555 4.449 -5.262 1.00 0.00 O ATOM 2244 CB THR B 125 -29.945 6.895 -3.838 1.00 0.00 C ATOM 2245 OG1 THR B 125 -29.398 7.428 -5.032 1.00 0.00 O ATOM 2246 CG2 THR B 125 -30.097 8.032 -2.852 1.00 0.00 C ATOM 0 H THR B 125 -27.221 6.306 -4.108 1.00 0.00 H new ATOM 0 HA THR B 125 -29.421 5.471 -2.316 1.00 0.00 H new ATOM 0 HB THR B 125 -30.928 6.458 -4.014 1.00 0.00 H new ATOM 0 HG1 THR B 125 -29.966 8.159 -5.354 1.00 0.00 H new ATOM 0 HG21 THR B 125 -30.722 8.811 -3.288 1.00 0.00 H new ATOM 0 HG22 THR B 125 -30.563 7.662 -1.939 1.00 0.00 H new ATOM 0 HG23 THR B 125 -29.115 8.444 -2.617 1.00 0.00 H new ATOM 2254 N GLU B 126 -30.077 3.601 -3.839 1.00 0.00 N ATOM 2255 CA GLU B 126 -30.303 2.396 -4.627 1.00 0.00 C ATOM 2256 C GLU B 126 -31.671 2.437 -5.300 1.00 0.00 C ATOM 2257 O GLU B 126 -32.553 3.191 -4.890 1.00 0.00 O ATOM 2258 CB GLU B 126 -30.194 1.153 -3.741 1.00 0.00 C ATOM 2259 CG GLU B 126 -28.809 0.527 -3.738 1.00 0.00 C ATOM 2260 CD GLU B 126 -27.873 1.184 -2.743 1.00 0.00 C ATOM 2261 OE1 GLU B 126 -27.524 2.366 -2.949 1.00 0.00 O ATOM 2262 OE2 GLU B 126 -27.488 0.518 -1.760 1.00 0.00 O ATOM 0 H GLU B 126 -30.630 3.655 -2.984 1.00 0.00 H new ATOM 0 HA GLU B 126 -29.537 2.349 -5.401 1.00 0.00 H new ATOM 0 HB2 GLU B 126 -30.465 1.420 -2.720 1.00 0.00 H new ATOM 0 HB3 GLU B 126 -30.918 0.412 -4.079 1.00 0.00 H new ATOM 0 HG2 GLU B 126 -28.895 -0.534 -3.504 1.00 0.00 H new ATOM 0 HG3 GLU B 126 -28.380 0.599 -4.737 1.00 0.00 H new ATOM 2269 N LEU B 127 -31.840 1.622 -6.335 1.00 0.00 N ATOM 2270 CA LEU B 127 -33.101 1.565 -7.064 1.00 0.00 C ATOM 2271 C LEU B 127 -34.166 0.836 -6.251 1.00 0.00 C ATOM 2272 O LEU B 127 -34.042 -0.358 -5.977 1.00 0.00 O ATOM 2273 CB LEU B 127 -32.904 0.867 -8.411 1.00 0.00 C ATOM 2274 CG LEU B 127 -33.428 1.642 -9.622 1.00 0.00 C ATOM 2275 CD1 LEU B 127 -34.934 1.825 -9.524 1.00 0.00 C ATOM 2276 CD2 LEU B 127 -32.730 2.988 -9.735 1.00 0.00 C ATOM 0 H LEU B 127 -31.120 0.992 -6.688 1.00 0.00 H new ATOM 0 HA LEU B 127 -33.438 2.587 -7.238 1.00 0.00 H new ATOM 0 HB2 LEU B 127 -31.840 0.677 -8.553 1.00 0.00 H new ATOM 0 HB3 LEU B 127 -33.400 -0.103 -8.377 1.00 0.00 H new ATOM 0 HG LEU B 127 -33.210 1.067 -10.522 1.00 0.00 H new ATOM 0 HD11 LEU B 127 -35.291 2.378 -10.393 1.00 0.00 H new ATOM 0 HD12 LEU B 127 -35.418 0.849 -9.492 1.00 0.00 H new ATOM 0 HD13 LEU B 127 -35.175 2.380 -8.617 1.00 0.00 H new ATOM 0 HD21 LEU B 127 -33.115 3.526 -10.602 1.00 0.00 H new ATOM 0 HD22 LEU B 127 -32.917 3.572 -8.833 1.00 0.00 H new ATOM 0 HD23 LEU B 127 -31.657 2.833 -9.851 1.00 0.00 H new ATOM 2288 N GLU B 128 -35.210 1.562 -5.866 1.00 0.00 N ATOM 2289 CA GLU B 128 -36.295 0.983 -5.083 1.00 0.00 C ATOM 2290 C GLU B 128 -37.508 1.907 -5.061 1.00 0.00 C ATOM 2291 O GLU B 128 -38.633 1.475 -5.314 1.00 0.00 O ATOM 2292 CB GLU B 128 -35.826 0.708 -3.653 1.00 0.00 C ATOM 2293 CG GLU B 128 -36.082 -0.718 -3.193 1.00 0.00 C ATOM 2294 CD GLU B 128 -34.803 -1.471 -2.885 1.00 0.00 C ATOM 2295 OE1 GLU B 128 -34.207 -1.216 -1.817 1.00 0.00 O ATOM 2296 OE2 GLU B 128 -34.397 -2.315 -3.711 1.00 0.00 O ATOM 0 H GLU B 128 -35.328 2.552 -6.083 1.00 0.00 H new ATOM 0 HA GLU B 128 -36.586 0.044 -5.553 1.00 0.00 H new ATOM 0 HB2 GLU B 128 -34.759 0.918 -3.583 1.00 0.00 H new ATOM 0 HB3 GLU B 128 -36.331 1.396 -2.975 1.00 0.00 H new ATOM 0 HG2 GLU B 128 -36.712 -0.701 -2.304 1.00 0.00 H new ATOM 0 HG3 GLU B 128 -36.636 -1.251 -3.966 1.00 0.00 H new ATOM 2303 N VAL B 129 -37.274 3.179 -4.754 1.00 0.00 N ATOM 2304 CA VAL B 129 -38.351 4.160 -4.695 1.00 0.00 C ATOM 2305 C VAL B 129 -38.656 4.728 -6.082 1.00 0.00 C ATOM 2306 O VAL B 129 -37.793 4.728 -6.960 1.00 0.00 O ATOM 2307 CB VAL B 129 -38.004 5.318 -3.741 1.00 0.00 C ATOM 2308 CG1 VAL B 129 -38.115 4.867 -2.292 1.00 0.00 C ATOM 2309 CG2 VAL B 129 -36.612 5.855 -4.036 1.00 0.00 C ATOM 0 H VAL B 129 -36.349 3.554 -4.543 1.00 0.00 H new ATOM 0 HA VAL B 129 -39.232 3.641 -4.317 1.00 0.00 H new ATOM 0 HB VAL B 129 -38.720 6.124 -3.902 1.00 0.00 H new ATOM 0 HG11 VAL B 129 -37.866 5.698 -1.632 1.00 0.00 H new ATOM 0 HG12 VAL B 129 -39.134 4.536 -2.091 1.00 0.00 H new ATOM 0 HG13 VAL B 129 -37.424 4.043 -2.114 1.00 0.00 H new ATOM 0 HG21 VAL B 129 -36.385 6.673 -3.352 1.00 0.00 H new ATOM 0 HG22 VAL B 129 -35.880 5.058 -3.905 1.00 0.00 H new ATOM 0 HG23 VAL B 129 -36.573 6.219 -5.063 1.00 0.00 H new ATOM 2319 N PRO B 130 -39.893 5.219 -6.307 1.00 0.00 N ATOM 2320 CA PRO B 130 -40.954 5.242 -5.290 1.00 0.00 C ATOM 2321 C PRO B 130 -41.543 3.860 -5.030 1.00 0.00 C ATOM 2322 O PRO B 130 -41.524 2.991 -5.902 1.00 0.00 O ATOM 2323 CB PRO B 130 -42.008 6.162 -5.905 1.00 0.00 C ATOM 2324 CG PRO B 130 -41.819 6.016 -7.375 1.00 0.00 C ATOM 2325 CD PRO B 130 -40.344 5.803 -7.584 1.00 0.00 C ATOM 0 HA PRO B 130 -40.583 5.578 -4.322 1.00 0.00 H new ATOM 0 HB2 PRO B 130 -43.014 5.870 -5.603 1.00 0.00 H new ATOM 0 HB3 PRO B 130 -41.867 7.195 -5.587 1.00 0.00 H new ATOM 0 HG2 PRO B 130 -42.393 5.174 -7.761 1.00 0.00 H new ATOM 0 HG3 PRO B 130 -42.164 6.905 -7.903 1.00 0.00 H new ATOM 0 HD2 PRO B 130 -40.151 5.133 -8.422 1.00 0.00 H new ATOM 0 HD3 PRO B 130 -39.830 6.740 -7.800 1.00 0.00 H new ATOM 2333 N ARG B 131 -42.068 3.664 -3.824 1.00 0.00 N ATOM 2334 CA ARG B 131 -42.667 2.388 -3.450 1.00 0.00 C ATOM 2335 C ARG B 131 -44.125 2.325 -3.891 1.00 0.00 C ATOM 2336 O ARG B 131 -44.631 3.247 -4.530 1.00 0.00 O ATOM 2337 CB ARG B 131 -42.570 2.180 -1.937 1.00 0.00 C ATOM 2338 CG ARG B 131 -43.328 3.221 -1.130 1.00 0.00 C ATOM 2339 CD ARG B 131 -42.653 3.493 0.205 1.00 0.00 C ATOM 2340 NE ARG B 131 -43.459 3.029 1.331 1.00 0.00 N ATOM 2341 CZ ARG B 131 -44.513 3.688 1.802 1.00 0.00 C ATOM 2342 NH1 ARG B 131 -44.882 4.834 1.247 1.00 0.00 N ATOM 2343 NH2 ARG B 131 -45.197 3.202 2.829 1.00 0.00 N ATOM 0 H ARG B 131 -42.091 4.372 -3.090 1.00 0.00 H new ATOM 0 HA ARG B 131 -42.118 1.593 -3.955 1.00 0.00 H new ATOM 0 HB2 ARG B 131 -42.954 1.190 -1.689 1.00 0.00 H new ATOM 0 HB3 ARG B 131 -41.521 2.198 -1.643 1.00 0.00 H new ATOM 0 HG2 ARG B 131 -43.394 4.147 -1.701 1.00 0.00 H new ATOM 0 HG3 ARG B 131 -44.348 2.878 -0.959 1.00 0.00 H new ATOM 0 HD2 ARG B 131 -41.681 2.999 0.227 1.00 0.00 H new ATOM 0 HD3 ARG B 131 -42.470 4.563 0.307 1.00 0.00 H new ATOM 0 HE ARG B 131 -43.199 2.151 1.781 1.00 0.00 H new ATOM 0 HH11 ARG B 131 -44.357 5.211 0.458 1.00 0.00 H new ATOM 0 HH12 ARG B 131 -45.691 5.339 1.609 1.00 0.00 H new ATOM 0 HH21 ARG B 131 -44.915 2.321 3.259 1.00 0.00 H new ATOM 0 HH22 ARG B 131 -46.005 3.709 3.189 1.00 0.00 H new ATOM 2357 N THR B 132 -44.796 1.231 -3.547 1.00 0.00 N ATOM 2358 CA THR B 132 -46.196 1.050 -3.908 1.00 0.00 C ATOM 2359 C THR B 132 -46.868 0.030 -2.992 1.00 0.00 C ATOM 2360 O THR B 132 -46.255 -0.963 -2.600 1.00 0.00 O ATOM 2361 CB THR B 132 -46.314 0.601 -5.366 1.00 0.00 C ATOM 2362 OG1 THR B 132 -47.634 0.176 -5.654 1.00 0.00 O ATOM 2363 CG2 THR B 132 -45.376 -0.532 -5.722 1.00 0.00 C ATOM 0 H THR B 132 -44.393 0.457 -3.019 1.00 0.00 H new ATOM 0 HA THR B 132 -46.703 2.007 -3.788 1.00 0.00 H new ATOM 0 HB THR B 132 -46.042 1.474 -5.960 1.00 0.00 H new ATOM 0 HG1 THR B 132 -47.690 -0.106 -6.591 1.00 0.00 H new ATOM 0 HG21 THR B 132 -45.511 -0.801 -6.770 1.00 0.00 H new ATOM 0 HG22 THR B 132 -44.346 -0.216 -5.559 1.00 0.00 H new ATOM 0 HG23 THR B 132 -45.594 -1.396 -5.094 1.00 0.00 H new ATOM 2371 N PRO B 133 -48.142 0.265 -2.635 1.00 0.00 N ATOM 2372 CA PRO B 133 -48.895 -0.637 -1.758 1.00 0.00 C ATOM 2373 C PRO B 133 -49.288 -1.932 -2.458 1.00 0.00 C ATOM 2374 O PRO B 133 -49.793 -1.914 -3.581 1.00 0.00 O ATOM 2375 CB PRO B 133 -50.139 0.177 -1.401 1.00 0.00 C ATOM 2376 CG PRO B 133 -50.329 1.098 -2.557 1.00 0.00 C ATOM 2377 CD PRO B 133 -48.948 1.428 -3.056 1.00 0.00 C ATOM 0 HA PRO B 133 -48.309 -0.949 -0.893 1.00 0.00 H new ATOM 0 HB2 PRO B 133 -51.007 -0.467 -1.260 1.00 0.00 H new ATOM 0 HB3 PRO B 133 -49.998 0.730 -0.472 1.00 0.00 H new ATOM 0 HG2 PRO B 133 -50.924 0.625 -3.339 1.00 0.00 H new ATOM 0 HG3 PRO B 133 -50.860 2.000 -2.254 1.00 0.00 H new ATOM 0 HD2 PRO B 133 -48.932 1.556 -4.138 1.00 0.00 H new ATOM 0 HD3 PRO B 133 -48.574 2.354 -2.620 1.00 0.00 H new ATOM 2385 N ARG B 134 -49.054 -3.055 -1.788 1.00 0.00 N ATOM 2386 CA ARG B 134 -49.388 -4.360 -2.344 1.00 0.00 C ATOM 2387 C ARG B 134 -50.857 -4.692 -2.108 1.00 0.00 C ATOM 2388 O ARG B 134 -51.500 -5.337 -2.937 1.00 0.00 O ATOM 2389 CB ARG B 134 -48.502 -5.443 -1.724 1.00 0.00 C ATOM 2390 CG ARG B 134 -47.014 -5.154 -1.843 1.00 0.00 C ATOM 2391 CD ARG B 134 -46.179 -6.251 -1.202 1.00 0.00 C ATOM 2392 NE ARG B 134 -44.836 -5.791 -0.862 1.00 0.00 N ATOM 2393 CZ ARG B 134 -44.558 -5.064 0.216 1.00 0.00 C ATOM 2394 NH1 ARG B 134 -45.526 -4.715 1.052 1.00 0.00 N ATOM 2395 NH2 ARG B 134 -43.310 -4.685 0.459 1.00 0.00 N ATOM 0 H ARG B 134 -48.634 -3.087 -0.859 1.00 0.00 H new ATOM 0 HA ARG B 134 -49.210 -4.326 -3.419 1.00 0.00 H new ATOM 0 HB2 ARG B 134 -48.759 -5.552 -0.670 1.00 0.00 H new ATOM 0 HB3 ARG B 134 -48.718 -6.397 -2.205 1.00 0.00 H new ATOM 0 HG2 ARG B 134 -46.744 -5.058 -2.895 1.00 0.00 H new ATOM 0 HG3 ARG B 134 -46.789 -4.199 -1.368 1.00 0.00 H new ATOM 0 HD2 ARG B 134 -46.679 -6.607 -0.301 1.00 0.00 H new ATOM 0 HD3 ARG B 134 -46.110 -7.099 -1.884 1.00 0.00 H new ATOM 0 HE ARG B 134 -44.069 -6.041 -1.486 1.00 0.00 H new ATOM 0 HH11 ARG B 134 -46.487 -5.004 0.869 1.00 0.00 H new ATOM 0 HH12 ARG B 134 -45.310 -4.157 1.878 1.00 0.00 H new ATOM 0 HH21 ARG B 134 -42.562 -4.951 -0.182 1.00 0.00 H new ATOM 0 HH22 ARG B 134 -43.098 -4.127 1.286 1.00 0.00 H new ATOM 2409 N THR B 135 -51.384 -4.244 -0.973 1.00 0.00 N ATOM 2410 CA THR B 135 -52.779 -4.491 -0.626 1.00 0.00 C ATOM 2411 C THR B 135 -53.027 -5.980 -0.396 1.00 0.00 C ATOM 2412 O THR B 135 -53.551 -6.672 -1.268 1.00 0.00 O ATOM 2413 CB THR B 135 -53.700 -3.974 -1.732 1.00 0.00 C ATOM 2414 OG1 THR B 135 -53.204 -2.760 -2.268 1.00 0.00 O ATOM 2415 CG2 THR B 135 -55.117 -3.726 -1.265 1.00 0.00 C ATOM 0 H THR B 135 -50.866 -3.708 -0.277 1.00 0.00 H new ATOM 0 HA THR B 135 -52.998 -3.957 0.299 1.00 0.00 H new ATOM 0 HB THR B 135 -53.718 -4.761 -2.486 1.00 0.00 H new ATOM 0 HG1 THR B 135 -53.805 -2.445 -2.975 1.00 0.00 H new ATOM 0 HG21 THR B 135 -55.716 -3.361 -2.099 1.00 0.00 H new ATOM 0 HG22 THR B 135 -55.545 -4.656 -0.891 1.00 0.00 H new ATOM 0 HG23 THR B 135 -55.113 -2.982 -0.468 1.00 0.00 H new ATOM 2423 N PRO B 136 -52.654 -6.492 0.789 1.00 0.00 N ATOM 2424 CA PRO B 136 -52.836 -7.905 1.131 1.00 0.00 C ATOM 2425 C PRO B 136 -54.288 -8.241 1.452 1.00 0.00 C ATOM 2426 O PRO B 136 -55.069 -8.454 0.501 1.00 0.00 O ATOM 2427 CB PRO B 136 -51.960 -8.079 2.371 1.00 0.00 C ATOM 2428 CG PRO B 136 -51.945 -6.734 3.010 1.00 0.00 C ATOM 2429 CD PRO B 136 -52.019 -5.735 1.886 1.00 0.00 C ATOM 2430 OXT PRO B 136 -54.633 -8.287 2.652 1.00 0.00 O ATOM 0 HA PRO B 136 -52.569 -8.565 0.305 1.00 0.00 H new ATOM 0 HB2 PRO B 136 -52.369 -8.833 3.043 1.00 0.00 H new ATOM 0 HB3 PRO B 136 -50.954 -8.403 2.104 1.00 0.00 H new ATOM 0 HG2 PRO B 136 -52.788 -6.617 3.691 1.00 0.00 H new ATOM 0 HG3 PRO B 136 -51.038 -6.592 3.598 1.00 0.00 H new ATOM 0 HD2 PRO B 136 -52.609 -4.862 2.164 1.00 0.00 H new ATOM 0 HD3 PRO B 136 -51.030 -5.375 1.604 1.00 0.00 H new TER 2438 PRO B 136 END