USER MOD reduce.3.24.130724 H: found=0, std=0, add=1504, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1496 hydrogens (40 hets) HEADER TRANSFERASE 24-JAN-01 1HZE TITLE SOLUTION STRUCTURE OF THE N-TERMINAL DOMAIN OF RIBOFLAVIN SYNTHASE TITLE 2 FROM E. COLI COMPND MOL_ID: 1; COMPND 2 MOLECULE: RIBOFLAVIN SYNTHASE ALPHA CHAIN; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: N-TERMINAL DOMAIN, RESIDUES 1-97; COMPND 5 EC: 2.5.1.9; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; SOURCE 3 ORGANISM_TAXID: 562; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS GREEK-KEY-BARREL, TRANSFERASE EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR V.TRUFFAULT,M.COLES,T.DIERCKS,K.ABELMANN,S.EBERHARDT,H.LUETTGEN, AUTHOR 2 A.BACHER,H.KESSLER REVDAT 4 13-JUL-11 1HZE 1 VERSN REVDAT 3 24-FEB-09 1HZE 1 VERSN REVDAT 2 01-APR-03 1HZE 1 JRNL REVDAT 1 05-SEP-01 1HZE 0 JRNL AUTH V.TRUFFAULT,M.COLES,T.DIERCKS,K.ABELMANN,S.EBERHARDT, JRNL AUTH 2 H.LUTTGEN,A.BACHER,H.KESSLER JRNL TITL THE SOLUTION STRUCTURE OF THE N-TERMINAL DOMAIN OF JRNL TITL 2 RIBOFLAVIN SYNTHASE. JRNL REF J.MOL.BIOL. V. 309 949 2001 JRNL REFN ISSN 0022-2836 JRNL PMID 11399071 JRNL DOI 10.1006/JMBI.2001.4683 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: REMARK 3 STRUCTURES BASED ON 2569 NOE RESTRAINTS REMARK 3 (353*2 INTRARES., 365*2 SEQUENTIAL, 159*2 MEDIUM-RANGE, 372*2 LONG- REMARK 3 RANGE, 71 INTERMOLECULAR) REMARK 3 56*2 DIHEDRAL RESTRAINTS, REMARK 3 42*2 H-BONDS REMARK 4 REMARK 4 1HZE COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 25-JAN-01. REMARK 100 THE RCSB ID CODE IS RCSB012713. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 300; 300; 300 REMARK 210 PH : 7.3; 7.3; 7.3 REMARK 210 IONIC STRENGTH : 50 MM; 50 MM; 50 MM REMARK 210 PRESSURE : AMBIENT; AMBIENT; AMBIENT REMARK 210 SAMPLE CONTENTS : 1 MM U-15N,13C ; EXCESS REMARK 210 RIBOFLAVIN; 1 MM U-15N ; EXCESS REMARK 210 RIBOFLAVIN; 1 MM U-15N ; EXCESS U REMARK 210 -15N,13C RIBOFLAVIN 50 MM REMARK 210 PHOSPHATE BUFFER 50 MM HCL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_13C-SEPARATED_NOESY; NCH- REMARK 210 NOESY; CCH-NOESY; CNH-NOESY; 3D_ REMARK 210 15N-SEPARATED_NOESY; NNH-NOESY; REMARK 210 2D 12C-FILTERED, 13C EDITED REMARK 210 NOESY; HNHA REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ; 750 MHZ REMARK 210 SPECTROMETER MODEL : DMX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : XWINNMR, AURELIA, X-PLOR REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL 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 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 H ASN A 45 O ASN A 83 1.40 REMARK 500 H ASN B 45 O ASN B 83 1.40 REMARK 500 O HIS B 24 H PHE B 61 1.58 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 THR A 3 -38.04 -133.92 REMARK 500 ASN A 45 16.07 53.02 REMARK 500 ASN A 55 65.52 -105.55 REMARK 500 THR B 3 -38.05 -133.97 REMARK 500 ASN B 45 16.06 53.11 REMARK 500 ASN B 55 65.51 -105.59 REMARK 500 GLU B 93 47.87 -99.67 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE RBF A 98 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE RBF B 99 DBREF 1HZE A 1 97 UNP P29015 RISA_ECOLI 1 97 DBREF 1HZE B 1 97 UNP P29015 RISA_ECOLI 1 97 SEQRES 1 A 97 MET PHE THR GLY ILE VAL GLN GLY THR ALA LYS LEU VAL SEQRES 2 A 97 SER ILE ASP GLU LYS PRO ASN PHE ARG THR HIS VAL VAL SEQRES 3 A 97 GLU LEU PRO ASP HIS MET LEU ASP GLY LEU GLU THR GLY SEQRES 4 A 97 ALA SER VAL ALA HIS ASN GLY CYS CYS LEU THR VAL THR SEQRES 5 A 97 GLU ILE ASN GLY ASN HIS VAL SER PHE ASP LEU MET LYS SEQRES 6 A 97 GLU THR LEU ARG ILE THR ASN LEU GLY ASP LEU LYS VAL SEQRES 7 A 97 GLY ASP TRP VAL ASN VAL GLU ARG ALA ALA LYS PHE SER SEQRES 8 A 97 ASP GLU ILE GLY GLY HIS SEQRES 1 B 97 MET PHE THR GLY ILE VAL GLN GLY THR ALA LYS LEU VAL SEQRES 2 B 97 SER ILE ASP GLU LYS PRO ASN PHE ARG THR HIS VAL VAL SEQRES 3 B 97 GLU LEU PRO ASP HIS MET LEU ASP GLY LEU GLU THR GLY SEQRES 4 B 97 ALA SER VAL ALA HIS ASN GLY CYS CYS LEU THR VAL THR SEQRES 5 B 97 GLU ILE ASN GLY ASN HIS VAL SER PHE ASP LEU MET LYS SEQRES 6 B 97 GLU THR LEU ARG ILE THR ASN LEU GLY ASP LEU LYS VAL SEQRES 7 B 97 GLY ASP TRP VAL ASN VAL GLU ARG ALA ALA LYS PHE SER SEQRES 8 B 97 ASP GLU ILE GLY GLY HIS HET RBF A 98 47 HET RBF B 99 47 HETNAM RBF RIBOFLAVIN HETSYN RBF RIBOFLAVINE; VITAMIN B2 FORMUL 3 RBF 2(C17 H20 N4 O6) HELIX 1 1 PRO A 29 ASP A 34 1 6 HELIX 2 2 MET A 64 THR A 71 1 8 HELIX 3 3 ASN A 72 LEU A 76 5 5 HELIX 4 4 PRO B 29 ASP B 34 1 6 HELIX 5 5 MET B 64 THR B 71 1 8 HELIX 6 6 ASN B 72 LEU B 76 5 5 SHEET 1 A 7 GLY A 8 GLU A 17 0 SHEET 2 A 7 ARG A 22 GLU A 27 -1 N THR A 23 O ASP A 16 SHEET 3 A 7 HIS A 58 LEU A 63 -1 N VAL A 59 O VAL A 26 SHEET 4 A 7 CYS A 47 ASN A 55 -1 O THR A 50 N ASP A 62 SHEET 5 A 7 SER A 41 HIS A 44 -1 O VAL A 42 N LEU A 49 SHEET 6 A 7 TRP A 81 ALA A 87 -1 O GLU A 85 N ALA A 43 SHEET 7 A 7 GLY A 8 GLU A 17 -1 O GLY A 8 N VAL A 84 SHEET 1 B 7 GLY B 8 GLU B 17 0 SHEET 2 B 7 ARG B 22 GLU B 27 -1 N THR B 23 O ASP B 16 SHEET 3 B 7 HIS B 58 LEU B 63 -1 N VAL B 59 O VAL B 26 SHEET 4 B 7 CYS B 47 ASN B 55 -1 O THR B 50 N ASP B 62 SHEET 5 B 7 SER B 41 HIS B 44 -1 O VAL B 42 N LEU B 49 SHEET 6 B 7 TRP B 81 ALA B 87 -1 O GLU B 85 N ALA B 43 SHEET 7 B 7 GLY B 8 GLU B 17 -1 O GLY B 8 N VAL B 84 SITE *** AC1 8 CYS A 48 LEU A 49 THR A 50 ASP A 62 SITE *** AC1 8 LEU A 63 MET A 64 THR A 67 ILE B 5 SITE *** AC2 8 ILE A 5 CYS B 48 LEU B 49 THR B 50 SITE *** AC2 8 ASP B 62 LEU B 63 MET B 64 THR B 67 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 45 ASN : amide:sc= -4.8! C(o=-11!,f=-11!) USER MOD Set 1.2: B 72 ASN : amide:sc= -6.61! C(o=-11!,f=-13!) USER MOD Set 2.1: B 55 ASN : amide:sc= -0.0306 X(o=-4.2,f=-3.8) USER MOD Set 2.2: B 60 SER OG : rot 180:sc= -4.14! USER MOD Set 3.1: A 72 ASN : amide:sc= -6.73! C(o=-12!,f=-13!) USER MOD Set 3.2: B 45 ASN : amide:sc= -4.93! C(o=-12!,f=-11!) USER MOD Set 4.1: A 55 ASN : amide:sc= -0.0252 X(o=-4,f=-3.7) USER MOD Set 4.2: A 60 SER OG : rot 180:sc= -3.96! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -155:sc= -0.0645 (180deg=-0.677) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.0571 USER MOD Single : A 7 GLN : amide:sc= -0.281 K(o=-0.28,f=-2.9!) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 ASN : amide:sc= -0.208 X(o=-0.21,f=-0.15) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 HIS : no HE2:sc= -14.7! C(o=-15!,f=-20!) USER MOD Single : A 31 HIS : no HD1:sc= -7.25! C(o=-7.2!,f=-11!) USER MOD Single : A 32 MET CE :methyl -157:sc= -0.125 (180deg=-0.913) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.434 USER MOD Single : A 41 SER OG : rot 43:sc= -1.6! USER MOD Single : A 44 HIS : no HE2:sc= -15! C(o=-15!,f=-15!) USER MOD Single : A 47 CYS SG : rot -70:sc= -2.14! USER MOD Single : A 48 CYS SG : rot -117:sc= -0.381 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -46:sc= -0.0148 USER MOD Single : A 57 ASN : amide:sc= -7.47! K(o=-7.5!,f=-2.3) USER MOD Single : A 58 HIS : no HE2:sc= -15.1! C(o=-15!,f=-14!) USER MOD Single : A 64 MET CE :methyl -158:sc= -0.057 (180deg=-0.693) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot -179:sc= -1.33! USER MOD Single : A 71 THR OG1 : rot -77:sc= 0.209 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= -6.42! C(o=-6.4!,f=-15!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 97 HIS : no HD1:sc= -3.22! K(o=-3.2!,f=-1.7) USER MOD Single : A 98 RBF O2' : rot 180:sc= -1.54! USER MOD Single : A 98 RBF O3' : rot 150:sc= -0.341 USER MOD Single : A 98 RBF O4' : rot -89:sc= -0.139 USER MOD Single : A 98 RBF O5' : rot 180:sc= -0.0179 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -158:sc= -0.0616 (180deg=-0.607) USER MOD Single : B 3 THR OG1 : rot 180:sc= -0.0639 USER MOD Single : B 7 GLN : amide:sc= -0.278 K(o=-0.28,f=-2.8!) USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 ASN : amide:sc= -0.2 X(o=-0.2,f=-0.17) USER MOD Single : B 23 THR OG1 : rot 180:sc= 0 USER MOD Single : B 24 HIS : no HE2:sc= -14.5! C(o=-14!,f=-19!) USER MOD Single : B 31 HIS : no HD1:sc= -7.3! C(o=-7.3!,f=-11!) USER MOD Single : B 32 MET CE :methyl -154:sc= -0.112 (180deg=-0.949) USER MOD Single : B 38 THR OG1 : rot 180:sc= -0.374 USER MOD Single : B 41 SER OG : rot 44:sc= -1.76! USER MOD Single : B 44 HIS : no HE2:sc= -15.1! C(o=-15!,f=-16!) USER MOD Single : B 47 CYS SG : rot 160:sc= -2.24! USER MOD Single : B 48 CYS SG : rot -89:sc= -0.675! USER MOD Single : B 50 THR OG1 : rot 180:sc= 0 USER MOD Single : B 52 THR OG1 : rot -39:sc= -0.0898 USER MOD Single : B 57 ASN : amide:sc= -7.49! K(o=-7.5!,f=-2.3) USER MOD Single : B 58 HIS : no HE2:sc= -15.2! C(o=-15!,f=-14!) USER MOD Single : B 64 MET CE :methyl -158:sc= -0.0781 (180deg=-0.694) USER MOD Single : B 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 THR OG1 : rot -170:sc= -1.53! USER MOD Single : B 71 THR OG1 : rot -77:sc= 0.216 USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 ASN : amide:sc= -5.97! C(o=-6!,f=-14!) USER MOD Single : B 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 SER OG : rot 180:sc= 0 USER MOD Single : B 97 HIS : no HD1:sc= -0.238 X(o=-0.24,f=-0.18) USER MOD Single : B 99 RBF O2' : rot 180:sc= -1.67 USER MOD Single : B 99 RBF O3' : rot 160:sc= -0.354 USER MOD Single : B 99 RBF O4' : rot -90:sc= -0.0991 USER MOD Single : B 99 RBF O5' : rot 180:sc=-0.00795 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.262 1.846 12.973 1.00 0.00 N ATOM 2 CA MET A 1 -3.456 2.767 12.121 1.00 0.00 C ATOM 3 C MET A 1 -3.855 2.617 10.650 1.00 0.00 C ATOM 4 O MET A 1 -3.959 1.522 10.134 1.00 0.00 O ATOM 5 CB MET A 1 -2.005 2.332 12.328 1.00 0.00 C ATOM 6 CG MET A 1 -1.555 2.696 13.744 1.00 0.00 C ATOM 7 SD MET A 1 0.161 2.173 13.984 1.00 0.00 S ATOM 8 CE MET A 1 0.355 2.792 15.673 1.00 0.00 C ATOM 0 H1 MET A 1 -4.312 2.223 13.941 1.00 0.00 H new ATOM 0 H2 MET A 1 -5.223 1.764 12.583 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.814 0.907 12.990 1.00 0.00 H new ATOM 0 HA MET A 1 -3.611 3.813 12.386 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.911 1.257 12.171 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.361 2.818 11.595 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.644 3.771 13.900 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.200 2.213 14.478 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.362 2.572 16.028 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.193 3.870 15.686 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.373 2.307 16.324 1.00 0.00 H new ATOM 20 N PHE A 2 -3.949 3.709 9.943 1.00 0.00 N ATOM 21 CA PHE A 2 -4.187 3.639 8.482 1.00 0.00 C ATOM 22 C PHE A 2 -3.998 5.028 7.884 1.00 0.00 C ATOM 23 O PHE A 2 -4.364 6.024 8.477 1.00 0.00 O ATOM 24 CB PHE A 2 -5.633 3.156 8.310 1.00 0.00 C ATOM 25 CG PHE A 2 -6.616 4.248 8.689 1.00 0.00 C ATOM 26 CD1 PHE A 2 -6.767 5.374 7.864 1.00 0.00 C ATOM 27 CD2 PHE A 2 -7.385 4.132 9.860 1.00 0.00 C ATOM 28 CE1 PHE A 2 -7.676 6.382 8.211 1.00 0.00 C ATOM 29 CE2 PHE A 2 -8.292 5.142 10.203 1.00 0.00 C ATOM 30 CZ PHE A 2 -8.436 6.267 9.382 1.00 0.00 C ATOM 0 H PHE A 2 -3.870 4.653 10.322 1.00 0.00 H new ATOM 0 HA PHE A 2 -3.497 2.963 7.977 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -5.799 2.854 7.276 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -5.803 2.276 8.930 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -6.182 5.463 6.961 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -7.276 3.265 10.494 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -7.791 7.248 7.576 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -8.882 5.053 11.103 1.00 0.00 H new ATOM 0 HZ PHE A 2 -9.133 7.046 9.652 1.00 0.00 H new ATOM 40 N THR A 3 -3.388 5.113 6.744 1.00 0.00 N ATOM 41 CA THR A 3 -3.135 6.444 6.145 1.00 0.00 C ATOM 42 C THR A 3 -3.515 6.416 4.673 1.00 0.00 C ATOM 43 O THR A 3 -3.999 7.385 4.122 1.00 0.00 O ATOM 44 CB THR A 3 -1.633 6.660 6.313 1.00 0.00 C ATOM 45 OG1 THR A 3 -0.933 5.592 5.689 1.00 0.00 O ATOM 46 CG2 THR A 3 -1.287 6.696 7.801 1.00 0.00 C ATOM 0 H THR A 3 -3.053 4.318 6.200 1.00 0.00 H new ATOM 0 HA THR A 3 -3.714 7.241 6.611 1.00 0.00 H new ATOM 0 HB THR A 3 -1.345 7.605 5.852 1.00 0.00 H new ATOM 0 HG1 THR A 3 0.032 5.728 5.793 1.00 0.00 H new ATOM 0 HG21 THR A 3 -0.215 6.850 7.922 1.00 0.00 H new ATOM 0 HG22 THR A 3 -1.827 7.512 8.281 1.00 0.00 H new ATOM 0 HG23 THR A 3 -1.572 5.751 8.264 1.00 0.00 H new ATOM 54 N GLY A 4 -3.242 5.324 4.015 1.00 0.00 N ATOM 55 CA GLY A 4 -3.524 5.251 2.562 1.00 0.00 C ATOM 56 C GLY A 4 -2.862 6.438 1.866 1.00 0.00 C ATOM 57 O GLY A 4 -3.261 6.838 0.791 1.00 0.00 O ATOM 0 H GLY A 4 -2.836 4.482 4.423 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -3.145 4.315 2.152 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -4.600 5.264 2.386 1.00 0.00 H new ATOM 61 N ILE A 5 -1.897 7.053 2.500 1.00 0.00 N ATOM 62 CA ILE A 5 -1.277 8.265 1.890 1.00 0.00 C ATOM 63 C ILE A 5 -0.278 7.845 0.804 1.00 0.00 C ATOM 64 O ILE A 5 0.487 6.918 0.981 1.00 0.00 O ATOM 65 CB ILE A 5 -0.575 8.975 3.050 1.00 0.00 C ATOM 66 CG1 ILE A 5 -1.601 9.310 4.133 1.00 0.00 C ATOM 67 CG2 ILE A 5 0.060 10.273 2.552 1.00 0.00 C ATOM 68 CD1 ILE A 5 -0.880 9.831 5.378 1.00 0.00 C ATOM 0 H ILE A 5 -1.516 6.772 3.403 1.00 0.00 H new ATOM 0 HA ILE A 5 -2.005 8.918 1.409 1.00 0.00 H new ATOM 0 HB ILE A 5 0.197 8.321 3.456 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -2.301 10.060 3.765 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -2.185 8.424 4.382 1.00 0.00 H new ATOM 0 HG21 ILE A 5 0.559 10.775 3.381 1.00 0.00 H new ATOM 0 HG22 ILE A 5 0.789 10.046 1.774 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -0.714 10.924 2.146 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -1.612 10.070 6.149 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -0.197 9.067 5.750 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -0.316 10.728 5.123 1.00 0.00 H new ATOM 80 N VAL A 6 -0.399 8.405 -0.372 1.00 0.00 N ATOM 81 CA VAL A 6 0.410 7.903 -1.524 1.00 0.00 C ATOM 82 C VAL A 6 1.712 8.699 -1.663 1.00 0.00 C ATOM 83 O VAL A 6 1.729 9.912 -1.593 1.00 0.00 O ATOM 84 CB VAL A 6 -0.499 8.087 -2.752 1.00 0.00 C ATOM 85 CG1 VAL A 6 0.332 8.307 -4.021 1.00 0.00 C ATOM 86 CG2 VAL A 6 -1.341 6.827 -2.936 1.00 0.00 C ATOM 0 H VAL A 6 -1.020 9.185 -0.585 1.00 0.00 H new ATOM 0 HA VAL A 6 0.711 6.863 -1.398 1.00 0.00 H new ATOM 0 HB VAL A 6 -1.132 8.959 -2.588 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -0.334 8.434 -4.874 1.00 0.00 H new ATOM 0 HG12 VAL A 6 0.946 9.200 -3.904 1.00 0.00 H new ATOM 0 HG13 VAL A 6 0.976 7.443 -4.189 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -1.989 6.946 -3.804 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -0.685 5.970 -3.088 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -1.951 6.664 -2.047 1.00 0.00 H new ATOM 96 N GLN A 7 2.795 8.013 -1.900 1.00 0.00 N ATOM 97 CA GLN A 7 4.098 8.703 -2.095 1.00 0.00 C ATOM 98 C GLN A 7 4.147 9.436 -3.442 1.00 0.00 C ATOM 99 O GLN A 7 4.910 10.368 -3.606 1.00 0.00 O ATOM 100 CB GLN A 7 5.146 7.592 -2.047 1.00 0.00 C ATOM 101 CG GLN A 7 5.248 7.055 -0.618 1.00 0.00 C ATOM 102 CD GLN A 7 6.134 5.809 -0.599 1.00 0.00 C ATOM 103 OE1 GLN A 7 6.338 5.178 -1.617 1.00 0.00 O ATOM 104 NE2 GLN A 7 6.673 5.425 0.526 1.00 0.00 N ATOM 0 H GLN A 7 2.832 6.996 -1.967 1.00 0.00 H new ATOM 0 HA GLN A 7 4.267 9.463 -1.332 1.00 0.00 H new ATOM 0 HB2 GLN A 7 4.873 6.789 -2.731 1.00 0.00 H new ATOM 0 HB3 GLN A 7 6.113 7.974 -2.374 1.00 0.00 H new ATOM 0 HG2 GLN A 7 5.664 7.819 0.039 1.00 0.00 H new ATOM 0 HG3 GLN A 7 4.255 6.813 -0.238 1.00 0.00 H new ATOM 0 HE21 GLN A 7 6.502 5.955 1.381 1.00 0.00 H new ATOM 0 HE22 GLN A 7 7.266 4.595 0.551 1.00 0.00 H new ATOM 113 N GLY A 8 3.469 8.946 -4.456 1.00 0.00 N ATOM 114 CA GLY A 8 3.661 9.562 -5.803 1.00 0.00 C ATOM 115 C GLY A 8 2.435 9.319 -6.683 1.00 0.00 C ATOM 116 O GLY A 8 1.481 8.691 -6.280 1.00 0.00 O ATOM 0 H GLY A 8 2.810 8.169 -4.410 1.00 0.00 H new ATOM 0 HA2 GLY A 8 3.834 10.633 -5.698 1.00 0.00 H new ATOM 0 HA3 GLY A 8 4.547 9.141 -6.279 1.00 0.00 H new ATOM 120 N THR A 9 2.453 9.821 -7.887 1.00 0.00 N ATOM 121 CA THR A 9 1.284 9.630 -8.791 1.00 0.00 C ATOM 122 C THR A 9 1.733 9.061 -10.141 1.00 0.00 C ATOM 123 O THR A 9 2.909 8.944 -10.423 1.00 0.00 O ATOM 124 CB THR A 9 0.681 11.025 -8.966 1.00 0.00 C ATOM 125 OG1 THR A 9 1.708 11.942 -9.317 1.00 0.00 O ATOM 126 CG2 THR A 9 0.018 11.465 -7.659 1.00 0.00 C ATOM 0 H THR A 9 3.226 10.355 -8.284 1.00 0.00 H new ATOM 0 HA THR A 9 0.562 8.924 -8.380 1.00 0.00 H new ATOM 0 HB THR A 9 -0.069 11.002 -9.757 1.00 0.00 H new ATOM 0 HG1 THR A 9 1.323 12.836 -9.431 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.411 12.459 -7.785 1.00 0.00 H new ATOM 0 HG22 THR A 9 -0.771 10.760 -7.396 1.00 0.00 H new ATOM 0 HG23 THR A 9 0.763 11.490 -6.864 1.00 0.00 H new ATOM 134 N ALA A 10 0.795 8.658 -10.951 1.00 0.00 N ATOM 135 CA ALA A 10 1.135 8.033 -12.263 1.00 0.00 C ATOM 136 C ALA A 10 0.209 8.579 -13.343 1.00 0.00 C ATOM 137 O ALA A 10 -0.930 8.893 -13.091 1.00 0.00 O ATOM 138 CB ALA A 10 0.895 6.536 -12.063 1.00 0.00 C ATOM 0 H ALA A 10 -0.204 8.735 -10.760 1.00 0.00 H new ATOM 0 HA ALA A 10 2.159 8.241 -12.574 1.00 0.00 H new ATOM 0 HB1 ALA A 10 1.123 6.004 -12.987 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.538 6.168 -11.264 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -0.148 6.367 -11.796 1.00 0.00 H new ATOM 144 N LYS A 11 0.673 8.669 -14.548 1.00 0.00 N ATOM 145 CA LYS A 11 -0.214 9.164 -15.634 1.00 0.00 C ATOM 146 C LYS A 11 -0.687 7.999 -16.497 1.00 0.00 C ATOM 147 O LYS A 11 0.071 7.444 -17.263 1.00 0.00 O ATOM 148 CB LYS A 11 0.646 10.108 -16.464 1.00 0.00 C ATOM 149 CG LYS A 11 -0.196 10.672 -17.609 1.00 0.00 C ATOM 150 CD LYS A 11 0.606 11.727 -18.369 1.00 0.00 C ATOM 151 CE LYS A 11 0.358 11.566 -19.871 1.00 0.00 C ATOM 152 NZ LYS A 11 1.307 12.510 -20.523 1.00 0.00 N ATOM 0 H LYS A 11 1.622 8.424 -14.832 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.100 9.661 -15.238 1.00 0.00 H new ATOM 0 HB2 LYS A 11 1.025 10.918 -15.841 1.00 0.00 H new ATOM 0 HB3 LYS A 11 1.513 9.578 -16.860 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -0.491 9.870 -18.285 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -1.113 11.112 -17.216 1.00 0.00 H new ATOM 0 HD2 LYS A 11 0.313 12.726 -18.045 1.00 0.00 H new ATOM 0 HD3 LYS A 11 1.669 11.620 -18.151 1.00 0.00 H new ATOM 0 HE2 LYS A 11 0.538 10.540 -20.193 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.674 11.804 -20.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 1.196 12.456 -21.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 1.107 13.479 -20.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 2.282 12.255 -20.266 1.00 0.00 H new ATOM 166 N LEU A 12 -1.956 7.731 -16.505 1.00 0.00 N ATOM 167 CA LEU A 12 -2.476 6.730 -17.468 1.00 0.00 C ATOM 168 C LEU A 12 -2.158 7.205 -18.878 1.00 0.00 C ATOM 169 O LEU A 12 -2.417 8.335 -19.237 1.00 0.00 O ATOM 170 CB LEU A 12 -3.984 6.706 -17.243 1.00 0.00 C ATOM 171 CG LEU A 12 -4.573 5.398 -17.771 1.00 0.00 C ATOM 172 CD1 LEU A 12 -3.802 4.216 -17.179 1.00 0.00 C ATOM 173 CD2 LEU A 12 -6.042 5.302 -17.353 1.00 0.00 C ATOM 0 H LEU A 12 -2.652 8.157 -15.893 1.00 0.00 H new ATOM 0 HA LEU A 12 -2.039 5.740 -17.336 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.203 6.809 -16.180 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -4.448 7.553 -17.748 1.00 0.00 H new ATOM 0 HG LEU A 12 -4.496 5.376 -18.858 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -4.222 3.283 -17.555 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.753 4.285 -17.467 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.881 4.237 -16.092 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.467 4.371 -17.727 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -6.113 5.322 -16.265 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -6.594 6.145 -17.768 1.00 0.00 H new ATOM 185 N VAL A 13 -1.542 6.377 -19.655 1.00 0.00 N ATOM 186 CA VAL A 13 -1.138 6.811 -21.016 1.00 0.00 C ATOM 187 C VAL A 13 -1.608 5.799 -22.049 1.00 0.00 C ATOM 188 O VAL A 13 -1.906 6.139 -23.177 1.00 0.00 O ATOM 189 CB VAL A 13 0.391 6.892 -20.978 1.00 0.00 C ATOM 190 CG1 VAL A 13 0.989 5.677 -20.261 1.00 0.00 C ATOM 191 CG2 VAL A 13 0.931 6.950 -22.408 1.00 0.00 C ATOM 0 H VAL A 13 -1.298 5.417 -19.412 1.00 0.00 H new ATOM 0 HA VAL A 13 -1.579 7.768 -21.293 1.00 0.00 H new ATOM 0 HB VAL A 13 0.675 7.791 -20.431 1.00 0.00 H new ATOM 0 HG11 VAL A 13 2.076 5.760 -20.249 1.00 0.00 H new ATOM 0 HG12 VAL A 13 0.616 5.639 -19.237 1.00 0.00 H new ATOM 0 HG13 VAL A 13 0.701 4.766 -20.786 1.00 0.00 H new ATOM 0 HG21 VAL A 13 2.019 7.008 -22.384 1.00 0.00 H new ATOM 0 HG22 VAL A 13 0.627 6.053 -22.948 1.00 0.00 H new ATOM 0 HG23 VAL A 13 0.532 7.830 -22.912 1.00 0.00 H new ATOM 201 N SER A 14 -1.664 4.555 -21.680 1.00 0.00 N ATOM 202 CA SER A 14 -2.103 3.525 -22.666 1.00 0.00 C ATOM 203 C SER A 14 -2.899 2.413 -21.981 1.00 0.00 C ATOM 204 O SER A 14 -2.523 1.924 -20.938 1.00 0.00 O ATOM 205 CB SER A 14 -0.806 2.970 -23.245 1.00 0.00 C ATOM 206 OG SER A 14 -0.941 2.830 -24.653 1.00 0.00 O ATOM 0 H SER A 14 -1.429 4.205 -20.751 1.00 0.00 H new ATOM 0 HA SER A 14 -2.757 3.945 -23.430 1.00 0.00 H new ATOM 0 HB2 SER A 14 0.024 3.637 -23.012 1.00 0.00 H new ATOM 0 HB3 SER A 14 -0.576 2.005 -22.793 1.00 0.00 H new ATOM 0 HG SER A 14 -0.108 2.475 -25.028 1.00 0.00 H new ATOM 212 N ILE A 15 -3.924 1.922 -22.626 1.00 0.00 N ATOM 213 CA ILE A 15 -4.646 0.738 -22.071 1.00 0.00 C ATOM 214 C ILE A 15 -4.369 -0.497 -22.922 1.00 0.00 C ATOM 215 O ILE A 15 -4.529 -0.486 -24.126 1.00 0.00 O ATOM 216 CB ILE A 15 -6.133 1.077 -22.130 1.00 0.00 C ATOM 217 CG1 ILE A 15 -6.342 2.484 -21.589 1.00 0.00 C ATOM 218 CG2 ILE A 15 -6.910 0.068 -21.280 1.00 0.00 C ATOM 219 CD1 ILE A 15 -7.840 2.785 -21.474 1.00 0.00 C ATOM 0 H ILE A 15 -4.291 2.285 -23.506 1.00 0.00 H new ATOM 0 HA ILE A 15 -4.321 0.522 -21.053 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.490 1.030 -23.159 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -5.867 2.581 -20.613 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -5.866 3.210 -22.248 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.974 0.304 -21.317 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -6.747 -0.937 -21.669 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -6.563 0.118 -20.248 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -7.980 3.794 -21.086 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -8.303 2.707 -22.458 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -8.304 2.068 -20.796 1.00 0.00 H new ATOM 231 N ASP A 16 -4.089 -1.592 -22.288 1.00 0.00 N ATOM 232 CA ASP A 16 -3.956 -2.872 -23.033 1.00 0.00 C ATOM 233 C ASP A 16 -5.137 -3.786 -22.708 1.00 0.00 C ATOM 234 O ASP A 16 -5.348 -4.155 -21.577 1.00 0.00 O ATOM 235 CB ASP A 16 -2.645 -3.481 -22.542 1.00 0.00 C ATOM 236 CG ASP A 16 -1.471 -2.814 -23.260 1.00 0.00 C ATOM 237 OD1 ASP A 16 -1.712 -2.143 -24.250 1.00 0.00 O ATOM 238 OD2 ASP A 16 -0.351 -2.984 -22.807 1.00 0.00 O ATOM 0 H ASP A 16 -3.945 -1.660 -21.280 1.00 0.00 H new ATOM 0 HA ASP A 16 -3.952 -2.730 -24.114 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -2.550 -3.346 -21.465 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -2.638 -4.555 -22.730 1.00 0.00 H new ATOM 243 N GLU A 17 -5.957 -4.082 -23.677 1.00 0.00 N ATOM 244 CA GLU A 17 -7.177 -4.888 -23.390 1.00 0.00 C ATOM 245 C GLU A 17 -6.999 -6.328 -23.877 1.00 0.00 C ATOM 246 O GLU A 17 -6.995 -6.595 -25.063 1.00 0.00 O ATOM 247 CB GLU A 17 -8.298 -4.198 -24.169 1.00 0.00 C ATOM 248 CG GLU A 17 -9.612 -4.949 -23.946 1.00 0.00 C ATOM 249 CD GLU A 17 -10.733 -4.258 -24.725 1.00 0.00 C ATOM 250 OE1 GLU A 17 -10.498 -3.170 -25.224 1.00 0.00 O ATOM 251 OE2 GLU A 17 -11.806 -4.832 -24.814 1.00 0.00 O ATOM 0 H GLU A 17 -5.837 -3.803 -24.651 1.00 0.00 H new ATOM 0 HA GLU A 17 -7.389 -4.942 -22.322 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -8.398 -3.163 -23.842 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -8.056 -4.175 -25.232 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -9.512 -5.984 -24.273 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -9.854 -4.973 -22.883 1.00 0.00 H new ATOM 258 N LYS A 18 -6.960 -7.268 -22.972 1.00 0.00 N ATOM 259 CA LYS A 18 -6.910 -8.700 -23.385 1.00 0.00 C ATOM 260 C LYS A 18 -8.206 -9.387 -22.953 1.00 0.00 C ATOM 261 O LYS A 18 -8.569 -9.337 -21.796 1.00 0.00 O ATOM 262 CB LYS A 18 -5.713 -9.310 -22.640 1.00 0.00 C ATOM 263 CG LYS A 18 -4.573 -8.291 -22.532 1.00 0.00 C ATOM 264 CD LYS A 18 -3.246 -8.967 -22.881 1.00 0.00 C ATOM 265 CE LYS A 18 -2.923 -10.030 -21.829 1.00 0.00 C ATOM 266 NZ LYS A 18 -1.438 -10.019 -21.715 1.00 0.00 N ATOM 0 H LYS A 18 -6.961 -7.107 -21.965 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.805 -8.818 -24.464 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.021 -9.628 -21.644 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -5.365 -10.200 -23.165 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -4.755 -7.454 -23.206 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -4.531 -7.883 -21.522 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -3.307 -9.424 -23.869 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -2.448 -8.226 -22.922 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -3.394 -9.797 -20.874 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -3.288 -11.011 -22.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -1.139 -10.723 -21.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -1.017 -10.251 -22.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -1.120 -9.075 -21.417 1.00 0.00 H new ATOM 280 N PRO A 19 -8.861 -10.011 -23.891 1.00 0.00 N ATOM 281 CA PRO A 19 -10.132 -10.708 -23.588 1.00 0.00 C ATOM 282 C PRO A 19 -9.946 -11.647 -22.394 1.00 0.00 C ATOM 283 O PRO A 19 -10.874 -11.925 -21.660 1.00 0.00 O ATOM 284 CB PRO A 19 -10.449 -11.485 -24.872 1.00 0.00 C ATOM 285 CG PRO A 19 -9.217 -11.387 -25.721 1.00 0.00 C ATOM 286 CD PRO A 19 -8.488 -10.142 -25.296 1.00 0.00 C ATOM 0 HA PRO A 19 -10.940 -10.029 -23.315 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -10.690 -12.525 -24.651 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -11.312 -11.059 -25.384 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -8.587 -12.267 -25.589 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -9.480 -11.338 -26.778 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -7.410 -10.243 -25.420 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -8.796 -9.274 -25.879 1.00 0.00 H new ATOM 294 N ASN A 20 -8.734 -12.052 -22.135 1.00 0.00 N ATOM 295 CA ASN A 20 -8.467 -12.874 -20.920 1.00 0.00 C ATOM 296 C ASN A 20 -8.383 -11.971 -19.686 1.00 0.00 C ATOM 297 O ASN A 20 -8.879 -12.298 -18.627 1.00 0.00 O ATOM 298 CB ASN A 20 -7.112 -13.537 -21.179 1.00 0.00 C ATOM 299 CG ASN A 20 -7.062 -14.066 -22.613 1.00 0.00 C ATOM 300 OD1 ASN A 20 -7.730 -15.026 -22.944 1.00 0.00 O ATOM 301 ND2 ASN A 20 -6.297 -13.469 -23.485 1.00 0.00 N ATOM 0 H ASN A 20 -7.917 -11.850 -22.711 1.00 0.00 H new ATOM 0 HA ASN A 20 -9.254 -13.606 -20.736 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -6.308 -12.819 -21.018 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -6.955 -14.354 -20.474 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -6.259 -13.808 -24.446 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -5.737 -12.664 -23.205 1.00 0.00 H new ATOM 308 N PHE A 21 -7.735 -10.845 -19.816 1.00 0.00 N ATOM 309 CA PHE A 21 -7.581 -9.924 -18.653 1.00 0.00 C ATOM 310 C PHE A 21 -7.333 -8.495 -19.145 1.00 0.00 C ATOM 311 O PHE A 21 -6.762 -8.279 -20.197 1.00 0.00 O ATOM 312 CB PHE A 21 -6.365 -10.449 -17.888 1.00 0.00 C ATOM 313 CG PHE A 21 -6.600 -11.890 -17.507 1.00 0.00 C ATOM 314 CD1 PHE A 21 -7.332 -12.200 -16.352 1.00 0.00 C ATOM 315 CD2 PHE A 21 -6.090 -12.920 -18.311 1.00 0.00 C ATOM 316 CE1 PHE A 21 -7.554 -13.540 -16.001 1.00 0.00 C ATOM 317 CE2 PHE A 21 -6.311 -14.259 -17.959 1.00 0.00 C ATOM 318 CZ PHE A 21 -7.044 -14.569 -16.804 1.00 0.00 C ATOM 0 H PHE A 21 -7.304 -10.522 -20.682 1.00 0.00 H new ATOM 0 HA PHE A 21 -8.472 -9.895 -18.026 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -5.469 -10.365 -18.504 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -6.195 -9.848 -16.995 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -7.725 -11.407 -15.733 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -5.527 -12.682 -19.201 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.118 -13.779 -15.112 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -5.917 -15.052 -18.577 1.00 0.00 H new ATOM 0 HZ PHE A 21 -7.215 -15.600 -16.534 1.00 0.00 H new ATOM 328 N ARG A 22 -7.745 -7.512 -18.396 1.00 0.00 N ATOM 329 CA ARG A 22 -7.507 -6.109 -18.834 1.00 0.00 C ATOM 330 C ARG A 22 -6.181 -5.599 -18.275 1.00 0.00 C ATOM 331 O ARG A 22 -5.759 -5.972 -17.202 1.00 0.00 O ATOM 332 CB ARG A 22 -8.676 -5.296 -18.283 1.00 0.00 C ATOM 333 CG ARG A 22 -8.577 -3.856 -18.792 1.00 0.00 C ATOM 334 CD ARG A 22 -9.772 -3.049 -18.281 1.00 0.00 C ATOM 335 NE ARG A 22 -9.572 -1.679 -18.832 1.00 0.00 N ATOM 336 CZ ARG A 22 -10.589 -0.870 -18.977 1.00 0.00 C ATOM 337 NH1 ARG A 22 -11.788 -1.246 -18.619 1.00 0.00 N ATOM 338 NH2 ARG A 22 -10.405 0.322 -19.476 1.00 0.00 N ATOM 0 H ARG A 22 -8.233 -7.617 -17.506 1.00 0.00 H new ATOM 0 HA ARG A 22 -7.446 -6.028 -19.919 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -9.621 -5.740 -18.595 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -8.662 -5.310 -17.193 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -7.646 -3.402 -18.452 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -8.557 -3.845 -19.882 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -10.714 -3.479 -18.622 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -9.803 -3.036 -17.192 1.00 0.00 H new ATOM 0 HE ARG A 22 -8.637 -1.371 -19.097 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -11.935 -2.175 -18.224 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -12.577 -0.611 -18.734 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -9.470 0.621 -19.752 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -11.197 0.955 -19.590 1.00 0.00 H new ATOM 352 N THR A 23 -5.501 -4.793 -19.030 1.00 0.00 N ATOM 353 CA THR A 23 -4.166 -4.294 -18.601 1.00 0.00 C ATOM 354 C THR A 23 -4.115 -2.774 -18.744 1.00 0.00 C ATOM 355 O THR A 23 -4.569 -2.227 -19.723 1.00 0.00 O ATOM 356 CB THR A 23 -3.180 -4.946 -19.570 1.00 0.00 C ATOM 357 OG1 THR A 23 -3.249 -6.359 -19.434 1.00 0.00 O ATOM 358 CG2 THR A 23 -1.760 -4.469 -19.257 1.00 0.00 C ATOM 0 H THR A 23 -5.814 -4.452 -19.939 1.00 0.00 H new ATOM 0 HA THR A 23 -3.942 -4.533 -17.561 1.00 0.00 H new ATOM 0 HB THR A 23 -3.436 -4.666 -20.592 1.00 0.00 H new ATOM 0 HG1 THR A 23 -2.618 -6.779 -20.056 1.00 0.00 H new ATOM 0 HG21 THR A 23 -1.059 -4.935 -19.949 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.708 -3.385 -19.363 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.500 -4.746 -18.235 1.00 0.00 H new ATOM 366 N HIS A 24 -3.551 -2.086 -17.796 1.00 0.00 N ATOM 367 CA HIS A 24 -3.464 -0.605 -17.926 1.00 0.00 C ATOM 368 C HIS A 24 -2.038 -0.112 -17.692 1.00 0.00 C ATOM 369 O HIS A 24 -1.324 -0.624 -16.866 1.00 0.00 O ATOM 370 CB HIS A 24 -4.406 -0.062 -16.863 1.00 0.00 C ATOM 371 CG HIS A 24 -5.637 0.455 -17.550 1.00 0.00 C ATOM 372 ND1 HIS A 24 -6.917 0.106 -17.151 1.00 0.00 N ATOM 373 CD2 HIS A 24 -5.794 1.271 -18.642 1.00 0.00 C ATOM 374 CE1 HIS A 24 -7.780 0.704 -17.996 1.00 0.00 C ATOM 375 NE2 HIS A 24 -7.146 1.427 -18.922 1.00 0.00 N ATOM 0 H HIS A 24 -3.150 -2.478 -16.944 1.00 0.00 H new ATOM 0 HA HIS A 24 -3.737 -0.270 -18.927 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -4.668 -0.845 -16.151 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -3.923 0.735 -16.297 1.00 0.00 H new ATOM 0 HD1 HIS A 24 -7.161 -0.493 -16.363 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -4.988 1.724 -19.200 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -8.854 0.610 -17.932 1.00 0.00 H new ATOM 383 N VAL A 25 -1.599 0.844 -18.460 1.00 0.00 N ATOM 384 CA VAL A 25 -0.194 1.317 -18.327 1.00 0.00 C ATOM 385 C VAL A 25 -0.160 2.797 -17.966 1.00 0.00 C ATOM 386 O VAL A 25 -0.877 3.608 -18.524 1.00 0.00 O ATOM 387 CB VAL A 25 0.433 1.095 -19.696 1.00 0.00 C ATOM 388 CG1 VAL A 25 1.951 1.257 -19.598 1.00 0.00 C ATOM 389 CG2 VAL A 25 0.095 -0.311 -20.195 1.00 0.00 C ATOM 0 H VAL A 25 -2.152 1.318 -19.174 1.00 0.00 H new ATOM 0 HA VAL A 25 0.340 0.785 -17.539 1.00 0.00 H new ATOM 0 HB VAL A 25 0.037 1.830 -20.397 1.00 0.00 H new ATOM 0 HG11 VAL A 25 2.398 1.098 -20.579 1.00 0.00 H new ATOM 0 HG12 VAL A 25 2.188 2.263 -19.250 1.00 0.00 H new ATOM 0 HG13 VAL A 25 2.350 0.526 -18.894 1.00 0.00 H new ATOM 0 HG21 VAL A 25 0.545 -0.467 -21.175 1.00 0.00 H new ATOM 0 HG22 VAL A 25 0.485 -1.049 -19.495 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -0.987 -0.420 -20.271 1.00 0.00 H new ATOM 399 N VAL A 26 0.653 3.138 -17.012 1.00 0.00 N ATOM 400 CA VAL A 26 0.731 4.549 -16.553 1.00 0.00 C ATOM 401 C VAL A 26 2.146 5.095 -16.765 1.00 0.00 C ATOM 402 O VAL A 26 3.058 4.363 -17.073 1.00 0.00 O ATOM 403 CB VAL A 26 0.407 4.484 -15.061 1.00 0.00 C ATOM 404 CG1 VAL A 26 -0.906 3.725 -14.850 1.00 0.00 C ATOM 405 CG2 VAL A 26 1.538 3.757 -14.323 1.00 0.00 C ATOM 0 H VAL A 26 1.274 2.493 -16.524 1.00 0.00 H new ATOM 0 HA VAL A 26 0.051 5.204 -17.098 1.00 0.00 H new ATOM 0 HB VAL A 26 0.307 5.497 -14.671 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -1.134 3.681 -13.785 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -1.712 4.240 -15.372 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -0.808 2.713 -15.242 1.00 0.00 H new ATOM 0 HG21 VAL A 26 1.307 3.711 -13.259 1.00 0.00 H new ATOM 0 HG22 VAL A 26 1.638 2.746 -14.717 1.00 0.00 H new ATOM 0 HG23 VAL A 26 2.473 4.297 -14.468 1.00 0.00 H new ATOM 415 N GLU A 27 2.329 6.375 -16.599 1.00 0.00 N ATOM 416 CA GLU A 27 3.671 6.981 -16.787 1.00 0.00 C ATOM 417 C GLU A 27 4.280 7.270 -15.419 1.00 0.00 C ATOM 418 O GLU A 27 3.693 7.957 -14.607 1.00 0.00 O ATOM 419 CB GLU A 27 3.381 8.280 -17.528 1.00 0.00 C ATOM 420 CG GLU A 27 4.526 8.621 -18.482 1.00 0.00 C ATOM 421 CD GLU A 27 4.067 9.699 -19.465 1.00 0.00 C ATOM 422 OE1 GLU A 27 2.894 10.035 -19.440 1.00 0.00 O ATOM 423 OE2 GLU A 27 4.896 10.172 -20.225 1.00 0.00 O ATOM 0 H GLU A 27 1.595 7.033 -16.338 1.00 0.00 H new ATOM 0 HA GLU A 27 4.370 6.343 -17.328 1.00 0.00 H new ATOM 0 HB2 GLU A 27 2.450 8.186 -18.087 1.00 0.00 H new ATOM 0 HB3 GLU A 27 3.243 9.090 -16.812 1.00 0.00 H new ATOM 0 HG2 GLU A 27 5.391 8.972 -17.919 1.00 0.00 H new ATOM 0 HG3 GLU A 27 4.840 7.729 -19.024 1.00 0.00 H new ATOM 430 N LEU A 28 5.378 6.649 -15.112 1.00 0.00 N ATOM 431 CA LEU A 28 5.942 6.774 -13.742 1.00 0.00 C ATOM 432 C LEU A 28 6.780 8.056 -13.630 1.00 0.00 C ATOM 433 O LEU A 28 7.623 8.320 -14.465 1.00 0.00 O ATOM 434 CB LEU A 28 6.810 5.529 -13.580 1.00 0.00 C ATOM 435 CG LEU A 28 6.849 5.115 -12.107 1.00 0.00 C ATOM 436 CD1 LEU A 28 5.421 4.917 -11.593 1.00 0.00 C ATOM 437 CD2 LEU A 28 7.618 3.799 -11.970 1.00 0.00 C ATOM 0 H LEU A 28 5.912 6.059 -15.750 1.00 0.00 H new ATOM 0 HA LEU A 28 5.177 6.842 -12.969 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.412 4.715 -14.186 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.820 5.729 -13.938 1.00 0.00 H new ATOM 0 HG LEU A 28 7.343 5.893 -11.525 1.00 0.00 H new ATOM 0 HD11 LEU A 28 5.449 4.622 -10.544 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.866 5.850 -11.693 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.929 4.138 -12.176 1.00 0.00 H new ATOM 0 HD21 LEU A 28 7.647 3.502 -10.922 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.120 3.024 -12.553 1.00 0.00 H new ATOM 0 HD23 LEU A 28 8.635 3.932 -12.338 1.00 0.00 H new ATOM 449 N PRO A 29 6.509 8.816 -12.600 1.00 0.00 N ATOM 450 CA PRO A 29 7.236 10.093 -12.377 1.00 0.00 C ATOM 451 C PRO A 29 8.705 9.836 -12.031 1.00 0.00 C ATOM 452 O PRO A 29 9.155 8.710 -11.978 1.00 0.00 O ATOM 453 CB PRO A 29 6.509 10.730 -11.200 1.00 0.00 C ATOM 454 CG PRO A 29 5.800 9.606 -10.515 1.00 0.00 C ATOM 455 CD PRO A 29 5.512 8.561 -11.558 1.00 0.00 C ATOM 0 HA PRO A 29 7.243 10.728 -13.263 1.00 0.00 H new ATOM 0 HB2 PRO A 29 7.210 11.222 -10.525 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.805 11.490 -11.538 1.00 0.00 H new ATOM 0 HG2 PRO A 29 6.416 9.193 -9.716 1.00 0.00 H new ATOM 0 HG3 PRO A 29 4.876 9.957 -10.056 1.00 0.00 H new ATOM 0 HD2 PRO A 29 5.608 7.554 -11.151 1.00 0.00 H new ATOM 0 HD3 PRO A 29 4.497 8.653 -11.945 1.00 0.00 H new ATOM 463 N ASP A 30 9.474 10.880 -11.892 1.00 0.00 N ATOM 464 CA ASP A 30 10.939 10.711 -11.666 1.00 0.00 C ATOM 465 C ASP A 30 11.213 9.916 -10.385 1.00 0.00 C ATOM 466 O ASP A 30 12.163 9.163 -10.311 1.00 0.00 O ATOM 467 CB ASP A 30 11.485 12.132 -11.536 1.00 0.00 C ATOM 468 CG ASP A 30 12.995 12.078 -11.300 1.00 0.00 C ATOM 469 OD1 ASP A 30 13.484 11.012 -10.963 1.00 0.00 O ATOM 470 OD2 ASP A 30 13.637 13.103 -11.459 1.00 0.00 O ATOM 0 H ASP A 30 9.151 11.847 -11.925 1.00 0.00 H new ATOM 0 HA ASP A 30 11.410 10.157 -12.478 1.00 0.00 H new ATOM 0 HB2 ASP A 30 11.268 12.701 -12.440 1.00 0.00 H new ATOM 0 HB3 ASP A 30 10.995 12.647 -10.710 1.00 0.00 H new ATOM 475 N HIS A 31 10.468 10.157 -9.339 1.00 0.00 N ATOM 476 CA HIS A 31 10.797 9.496 -8.043 1.00 0.00 C ATOM 477 C HIS A 31 10.072 8.153 -7.918 1.00 0.00 C ATOM 478 O HIS A 31 10.330 7.387 -7.011 1.00 0.00 O ATOM 479 CB HIS A 31 10.354 10.475 -6.950 1.00 0.00 C ATOM 480 CG HIS A 31 8.858 10.635 -6.947 1.00 0.00 C ATOM 481 ND1 HIS A 31 8.051 10.198 -7.986 1.00 0.00 N ATOM 482 CD2 HIS A 31 8.011 11.199 -6.027 1.00 0.00 C ATOM 483 CE1 HIS A 31 6.779 10.506 -7.665 1.00 0.00 C ATOM 484 NE2 HIS A 31 6.700 11.117 -6.481 1.00 0.00 N ATOM 0 H HIS A 31 9.656 10.775 -9.325 1.00 0.00 H new ATOM 0 HA HIS A 31 11.861 9.274 -7.963 1.00 0.00 H new ATOM 0 HB2 HIS A 31 10.687 10.115 -5.977 1.00 0.00 H new ATOM 0 HB3 HIS A 31 10.827 11.444 -7.110 1.00 0.00 H new ATOM 0 HD2 HIS A 31 8.317 11.641 -5.090 1.00 0.00 H new ATOM 0 HE1 HIS A 31 5.927 10.285 -8.290 1.00 0.00 H new ATOM 0 HE2 HIS A 31 5.859 11.452 -6.011 1.00 0.00 H new ATOM 492 N MET A 32 9.317 7.781 -8.915 1.00 0.00 N ATOM 493 CA MET A 32 8.763 6.397 -8.942 1.00 0.00 C ATOM 494 C MET A 32 9.434 5.594 -10.059 1.00 0.00 C ATOM 495 O MET A 32 9.422 4.379 -10.059 1.00 0.00 O ATOM 496 CB MET A 32 7.269 6.563 -9.218 1.00 0.00 C ATOM 497 CG MET A 32 6.601 7.229 -8.015 1.00 0.00 C ATOM 498 SD MET A 32 6.832 6.197 -6.546 1.00 0.00 S ATOM 499 CE MET A 32 5.741 4.841 -7.041 1.00 0.00 C ATOM 0 H MET A 32 9.061 8.370 -9.707 1.00 0.00 H new ATOM 0 HA MET A 32 8.938 5.861 -8.009 1.00 0.00 H new ATOM 0 HB2 MET A 32 7.118 7.168 -10.112 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.813 5.592 -9.409 1.00 0.00 H new ATOM 0 HG2 MET A 32 7.030 8.217 -7.849 1.00 0.00 H new ATOM 0 HG3 MET A 32 5.538 7.371 -8.209 1.00 0.00 H new ATOM 0 HE1 MET A 32 5.408 4.300 -6.155 1.00 0.00 H new ATOM 0 HE2 MET A 32 4.876 5.244 -7.567 1.00 0.00 H new ATOM 0 HE3 MET A 32 6.282 4.161 -7.699 1.00 0.00 H new ATOM 509 N LEU A 33 10.090 6.266 -10.965 1.00 0.00 N ATOM 510 CA LEU A 33 10.845 5.549 -12.033 1.00 0.00 C ATOM 511 C LEU A 33 12.047 4.818 -11.430 1.00 0.00 C ATOM 512 O LEU A 33 12.429 3.756 -11.880 1.00 0.00 O ATOM 513 CB LEU A 33 11.304 6.645 -12.996 1.00 0.00 C ATOM 514 CG LEU A 33 10.150 7.031 -13.926 1.00 0.00 C ATOM 515 CD1 LEU A 33 10.476 8.350 -14.627 1.00 0.00 C ATOM 516 CD2 LEU A 33 9.965 5.935 -14.972 1.00 0.00 C ATOM 0 H LEU A 33 10.136 7.284 -11.012 1.00 0.00 H new ATOM 0 HA LEU A 33 10.239 4.796 -12.536 1.00 0.00 H new ATOM 0 HB2 LEU A 33 11.640 7.518 -12.436 1.00 0.00 H new ATOM 0 HB3 LEU A 33 12.154 6.295 -13.581 1.00 0.00 H new ATOM 0 HG LEU A 33 9.235 7.147 -13.345 1.00 0.00 H new ATOM 0 HD11 LEU A 33 9.654 8.623 -15.288 1.00 0.00 H new ATOM 0 HD12 LEU A 33 10.618 9.133 -13.882 1.00 0.00 H new ATOM 0 HD13 LEU A 33 11.389 8.236 -15.211 1.00 0.00 H new ATOM 0 HD21 LEU A 33 9.145 6.203 -15.638 1.00 0.00 H new ATOM 0 HD22 LEU A 33 10.882 5.826 -15.551 1.00 0.00 H new ATOM 0 HD23 LEU A 33 9.736 4.992 -14.475 1.00 0.00 H new ATOM 528 N ASP A 34 12.649 5.382 -10.421 1.00 0.00 N ATOM 529 CA ASP A 34 13.831 4.725 -9.793 1.00 0.00 C ATOM 530 C ASP A 34 13.382 3.787 -8.668 1.00 0.00 C ATOM 531 O ASP A 34 12.957 4.225 -7.617 1.00 0.00 O ATOM 532 CB ASP A 34 14.665 5.876 -9.230 1.00 0.00 C ATOM 533 CG ASP A 34 15.919 5.319 -8.554 1.00 0.00 C ATOM 534 OD1 ASP A 34 15.929 4.137 -8.252 1.00 0.00 O ATOM 535 OD2 ASP A 34 16.847 6.084 -8.348 1.00 0.00 O ATOM 0 H ASP A 34 12.374 6.271 -10.003 1.00 0.00 H new ATOM 0 HA ASP A 34 14.394 4.119 -10.503 1.00 0.00 H new ATOM 0 HB2 ASP A 34 14.945 6.561 -10.030 1.00 0.00 H new ATOM 0 HB3 ASP A 34 14.076 6.448 -8.513 1.00 0.00 H new ATOM 540 N GLY A 35 13.538 2.503 -8.851 1.00 0.00 N ATOM 541 CA GLY A 35 13.190 1.550 -7.756 1.00 0.00 C ATOM 542 C GLY A 35 12.103 0.575 -8.224 1.00 0.00 C ATOM 543 O GLY A 35 12.221 -0.622 -8.049 1.00 0.00 O ATOM 0 H GLY A 35 13.890 2.074 -9.707 1.00 0.00 H new ATOM 0 HA2 GLY A 35 14.078 0.996 -7.451 1.00 0.00 H new ATOM 0 HA3 GLY A 35 12.842 2.101 -6.882 1.00 0.00 H new ATOM 547 N LEU A 36 11.001 1.076 -8.717 1.00 0.00 N ATOM 548 CA LEU A 36 9.866 0.173 -9.071 1.00 0.00 C ATOM 549 C LEU A 36 10.292 -0.845 -10.134 1.00 0.00 C ATOM 550 O LEU A 36 11.124 -0.572 -10.977 1.00 0.00 O ATOM 551 CB LEU A 36 8.774 1.090 -9.619 1.00 0.00 C ATOM 552 CG LEU A 36 7.478 0.293 -9.779 1.00 0.00 C ATOM 553 CD1 LEU A 36 6.279 1.235 -9.654 1.00 0.00 C ATOM 554 CD2 LEU A 36 7.456 -0.380 -11.154 1.00 0.00 C ATOM 0 H LEU A 36 10.838 2.068 -8.889 1.00 0.00 H new ATOM 0 HA LEU A 36 9.524 -0.399 -8.209 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.616 1.931 -8.944 1.00 0.00 H new ATOM 0 HB3 LEU A 36 9.080 1.505 -10.579 1.00 0.00 H new ATOM 0 HG LEU A 36 7.424 -0.469 -9.001 1.00 0.00 H new ATOM 0 HD11 LEU A 36 5.356 0.666 -9.768 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.292 1.713 -8.674 1.00 0.00 H new ATOM 0 HD13 LEU A 36 6.333 1.998 -10.430 1.00 0.00 H new ATOM 0 HD21 LEU A 36 6.532 -0.947 -11.267 1.00 0.00 H new ATOM 0 HD22 LEU A 36 7.512 0.381 -11.932 1.00 0.00 H new ATOM 0 HD23 LEU A 36 8.309 -1.053 -11.243 1.00 0.00 H new ATOM 566 N GLU A 37 9.724 -2.020 -10.092 1.00 0.00 N ATOM 567 CA GLU A 37 10.082 -3.070 -11.088 1.00 0.00 C ATOM 568 C GLU A 37 8.835 -3.881 -11.455 1.00 0.00 C ATOM 569 O GLU A 37 7.820 -3.803 -10.794 1.00 0.00 O ATOM 570 CB GLU A 37 11.106 -3.955 -10.376 1.00 0.00 C ATOM 571 CG GLU A 37 10.418 -4.724 -9.245 1.00 0.00 C ATOM 572 CD GLU A 37 11.440 -5.611 -8.531 1.00 0.00 C ATOM 573 OE1 GLU A 37 12.543 -5.735 -9.038 1.00 0.00 O ATOM 574 OE2 GLU A 37 11.102 -6.151 -7.491 1.00 0.00 O ATOM 0 H GLU A 37 9.023 -2.299 -9.406 1.00 0.00 H new ATOM 0 HA GLU A 37 10.480 -2.652 -12.013 1.00 0.00 H new ATOM 0 HB2 GLU A 37 11.554 -4.652 -11.084 1.00 0.00 H new ATOM 0 HB3 GLU A 37 11.914 -3.344 -9.975 1.00 0.00 H new ATOM 0 HG2 GLU A 37 9.970 -4.026 -8.537 1.00 0.00 H new ATOM 0 HG3 GLU A 37 9.609 -5.335 -9.646 1.00 0.00 H new ATOM 581 N THR A 38 8.902 -4.664 -12.496 1.00 0.00 N ATOM 582 CA THR A 38 7.716 -5.480 -12.886 1.00 0.00 C ATOM 583 C THR A 38 7.475 -6.589 -11.851 1.00 0.00 C ATOM 584 O THR A 38 8.362 -6.960 -11.109 1.00 0.00 O ATOM 585 CB THR A 38 8.070 -6.079 -14.247 1.00 0.00 C ATOM 586 OG1 THR A 38 9.464 -5.940 -14.482 1.00 0.00 O ATOM 587 CG2 THR A 38 7.285 -5.361 -15.345 1.00 0.00 C ATOM 0 H THR A 38 9.723 -4.775 -13.092 1.00 0.00 H new ATOM 0 HA THR A 38 6.804 -4.885 -12.933 1.00 0.00 H new ATOM 0 HB THR A 38 7.809 -7.137 -14.254 1.00 0.00 H new ATOM 0 HG1 THR A 38 9.689 -6.326 -15.354 1.00 0.00 H new ATOM 0 HG21 THR A 38 7.539 -5.790 -16.314 1.00 0.00 H new ATOM 0 HG22 THR A 38 6.216 -5.479 -15.165 1.00 0.00 H new ATOM 0 HG23 THR A 38 7.539 -4.301 -15.340 1.00 0.00 H new ATOM 595 N GLY A 39 6.258 -7.055 -11.736 1.00 0.00 N ATOM 596 CA GLY A 39 5.931 -8.060 -10.683 1.00 0.00 C ATOM 597 C GLY A 39 5.867 -7.370 -9.317 1.00 0.00 C ATOM 598 O GLY A 39 5.554 -7.984 -8.317 1.00 0.00 O ATOM 0 H GLY A 39 5.474 -6.781 -12.329 1.00 0.00 H new ATOM 0 HA2 GLY A 39 4.977 -8.538 -10.906 1.00 0.00 H new ATOM 0 HA3 GLY A 39 6.686 -8.846 -10.670 1.00 0.00 H new ATOM 602 N ALA A 40 6.087 -6.083 -9.280 1.00 0.00 N ATOM 603 CA ALA A 40 5.957 -5.337 -7.998 1.00 0.00 C ATOM 604 C ALA A 40 4.482 -5.065 -7.717 1.00 0.00 C ATOM 605 O ALA A 40 3.670 -5.058 -8.622 1.00 0.00 O ATOM 606 CB ALA A 40 6.705 -4.028 -8.238 1.00 0.00 C ATOM 0 H ALA A 40 6.352 -5.516 -10.085 1.00 0.00 H new ATOM 0 HA ALA A 40 6.356 -5.884 -7.144 1.00 0.00 H new ATOM 0 HB1 ALA A 40 6.660 -3.413 -7.339 1.00 0.00 H new ATOM 0 HB2 ALA A 40 7.746 -4.243 -8.479 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.244 -3.492 -9.068 1.00 0.00 H new ATOM 612 N SER A 41 4.123 -4.786 -6.491 1.00 0.00 N ATOM 613 CA SER A 41 2.699 -4.458 -6.216 1.00 0.00 C ATOM 614 C SER A 41 2.520 -2.943 -6.151 1.00 0.00 C ATOM 615 O SER A 41 2.940 -2.299 -5.213 1.00 0.00 O ATOM 616 CB SER A 41 2.387 -5.099 -4.866 1.00 0.00 C ATOM 617 OG SER A 41 3.583 -5.201 -4.105 1.00 0.00 O ATOM 0 H SER A 41 4.745 -4.772 -5.683 1.00 0.00 H new ATOM 0 HA SER A 41 2.031 -4.827 -6.995 1.00 0.00 H new ATOM 0 HB2 SER A 41 1.651 -4.501 -4.329 1.00 0.00 H new ATOM 0 HB3 SER A 41 1.950 -6.087 -5.012 1.00 0.00 H new ATOM 0 HG SER A 41 4.095 -4.369 -4.187 1.00 0.00 H new ATOM 623 N VAL A 42 1.826 -2.385 -7.099 1.00 0.00 N ATOM 624 CA VAL A 42 1.529 -0.929 -7.045 1.00 0.00 C ATOM 625 C VAL A 42 0.090 -0.728 -6.575 1.00 0.00 C ATOM 626 O VAL A 42 -0.843 -1.202 -7.189 1.00 0.00 O ATOM 627 CB VAL A 42 1.733 -0.423 -8.488 1.00 0.00 C ATOM 628 CG1 VAL A 42 0.753 0.694 -8.832 1.00 0.00 C ATOM 629 CG2 VAL A 42 3.136 0.142 -8.628 1.00 0.00 C ATOM 0 H VAL A 42 1.450 -2.875 -7.911 1.00 0.00 H new ATOM 0 HA VAL A 42 2.168 -0.385 -6.350 1.00 0.00 H new ATOM 0 HB VAL A 42 1.571 -1.266 -9.159 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.925 1.027 -9.856 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -0.268 0.324 -8.737 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.901 1.531 -8.149 1.00 0.00 H new ATOM 0 HG21 VAL A 42 3.284 0.501 -9.647 1.00 0.00 H new ATOM 0 HG22 VAL A 42 3.267 0.969 -7.930 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.866 -0.637 -8.408 1.00 0.00 H new ATOM 639 N ALA A 43 -0.102 0.077 -5.577 1.00 0.00 N ATOM 640 CA ALA A 43 -1.487 0.424 -5.183 1.00 0.00 C ATOM 641 C ALA A 43 -1.906 1.707 -5.896 1.00 0.00 C ATOM 642 O ALA A 43 -1.321 2.754 -5.696 1.00 0.00 O ATOM 643 CB ALA A 43 -1.437 0.640 -3.671 1.00 0.00 C ATOM 0 H ALA A 43 0.635 0.508 -5.019 1.00 0.00 H new ATOM 0 HA ALA A 43 -2.206 -0.351 -5.449 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -2.431 0.901 -3.308 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -1.101 -0.275 -3.184 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -0.743 1.449 -3.442 1.00 0.00 H new ATOM 649 N HIS A 44 -2.939 1.644 -6.687 1.00 0.00 N ATOM 650 CA HIS A 44 -3.428 2.876 -7.362 1.00 0.00 C ATOM 651 C HIS A 44 -4.467 3.553 -6.466 1.00 0.00 C ATOM 652 O HIS A 44 -5.491 2.983 -6.145 1.00 0.00 O ATOM 653 CB HIS A 44 -4.056 2.399 -8.672 1.00 0.00 C ATOM 654 CG HIS A 44 -3.008 2.335 -9.754 1.00 0.00 C ATOM 655 ND1 HIS A 44 -1.723 1.841 -9.533 1.00 0.00 N ATOM 656 CD2 HIS A 44 -3.048 2.692 -11.080 1.00 0.00 C ATOM 657 CE1 HIS A 44 -1.056 1.918 -10.702 1.00 0.00 C ATOM 658 NE2 HIS A 44 -1.819 2.427 -11.667 1.00 0.00 N ATOM 0 H HIS A 44 -3.465 0.795 -6.895 1.00 0.00 H new ATOM 0 HA HIS A 44 -2.637 3.601 -7.552 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -4.506 1.416 -8.532 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -4.856 3.077 -8.969 1.00 0.00 H new ATOM 0 HD1 HIS A 44 -1.355 1.487 -8.650 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -3.903 3.114 -11.587 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -0.031 1.606 -10.839 1.00 0.00 H new ATOM 667 N ASN A 45 -4.091 4.650 -5.882 1.00 0.00 N ATOM 668 CA ASN A 45 -4.904 5.260 -4.797 1.00 0.00 C ATOM 669 C ASN A 45 -5.201 4.239 -3.697 1.00 0.00 C ATOM 670 O ASN A 45 -5.956 4.515 -2.789 1.00 0.00 O ATOM 671 CB ASN A 45 -6.196 5.729 -5.462 1.00 0.00 C ATOM 672 CG ASN A 45 -6.643 7.029 -4.794 1.00 0.00 C ATOM 673 OD1 ASN A 45 -7.229 7.009 -3.730 1.00 0.00 O ATOM 674 ND2 ASN A 45 -6.391 8.167 -5.379 1.00 0.00 N ATOM 0 H ASN A 45 -3.239 5.160 -6.114 1.00 0.00 H new ATOM 0 HA ASN A 45 -4.376 6.085 -4.319 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -6.037 5.887 -6.529 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -6.970 4.968 -5.364 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -6.686 9.041 -4.943 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -5.899 8.183 -6.272 1.00 0.00 H new ATOM 681 N GLY A 46 -4.485 3.145 -3.666 1.00 0.00 N ATOM 682 CA GLY A 46 -4.608 2.221 -2.506 1.00 0.00 C ATOM 683 C GLY A 46 -5.170 0.863 -2.945 1.00 0.00 C ATOM 684 O GLY A 46 -5.305 -0.035 -2.143 1.00 0.00 O ATOM 0 H GLY A 46 -3.826 2.855 -4.389 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -3.632 2.082 -2.042 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -5.260 2.662 -1.752 1.00 0.00 H new ATOM 688 N CYS A 47 -5.406 0.656 -4.216 1.00 0.00 N ATOM 689 CA CYS A 47 -5.838 -0.702 -4.662 1.00 0.00 C ATOM 690 C CYS A 47 -4.632 -1.456 -5.224 1.00 0.00 C ATOM 691 O CYS A 47 -4.010 -1.013 -6.164 1.00 0.00 O ATOM 692 CB CYS A 47 -6.882 -0.470 -5.757 1.00 0.00 C ATOM 693 SG CYS A 47 -7.693 -2.040 -6.143 1.00 0.00 S ATOM 0 H CYS A 47 -5.320 1.356 -4.953 1.00 0.00 H new ATOM 0 HA CYS A 47 -6.250 -1.294 -3.845 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -7.618 0.262 -5.426 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -6.407 -0.063 -6.649 1.00 0.00 H new ATOM 0 HG CYS A 47 -6.855 -2.822 -6.756 1.00 0.00 H new ATOM 699 N CYS A 48 -4.188 -2.480 -4.547 1.00 0.00 N ATOM 700 CA CYS A 48 -2.894 -3.114 -4.935 1.00 0.00 C ATOM 701 C CYS A 48 -3.065 -4.024 -6.154 1.00 0.00 C ATOM 702 O CYS A 48 -3.758 -5.021 -6.105 1.00 0.00 O ATOM 703 CB CYS A 48 -2.472 -3.936 -3.717 1.00 0.00 C ATOM 704 SG CYS A 48 -3.762 -5.144 -3.328 1.00 0.00 S ATOM 0 H CYS A 48 -4.660 -2.903 -3.748 1.00 0.00 H new ATOM 0 HA CYS A 48 -2.151 -2.366 -5.210 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -1.530 -4.446 -3.918 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -2.304 -3.280 -2.863 1.00 0.00 H new ATOM 0 HG CYS A 48 -4.244 -4.898 -2.146 1.00 0.00 H new ATOM 710 N LEU A 49 -2.283 -3.793 -7.172 1.00 0.00 N ATOM 711 CA LEU A 49 -2.220 -4.758 -8.307 1.00 0.00 C ATOM 712 C LEU A 49 -0.757 -4.985 -8.700 1.00 0.00 C ATOM 713 O LEU A 49 0.135 -4.357 -8.171 1.00 0.00 O ATOM 714 CB LEU A 49 -2.998 -4.111 -9.456 1.00 0.00 C ATOM 715 CG LEU A 49 -2.708 -2.610 -9.516 1.00 0.00 C ATOM 716 CD1 LEU A 49 -2.954 -2.116 -10.941 1.00 0.00 C ATOM 717 CD2 LEU A 49 -3.642 -1.869 -8.552 1.00 0.00 C ATOM 0 H LEU A 49 -1.682 -2.974 -7.268 1.00 0.00 H new ATOM 0 HA LEU A 49 -2.646 -5.728 -8.048 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.721 -4.580 -10.400 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -4.067 -4.276 -9.319 1.00 0.00 H new ATOM 0 HG LEU A 49 -1.673 -2.422 -9.231 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.750 -1.047 -10.996 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -2.295 -2.646 -11.629 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -3.992 -2.302 -11.216 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -3.435 -0.800 -8.595 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -4.678 -2.050 -8.838 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -3.478 -2.230 -7.537 1.00 0.00 H new ATOM 729 N THR A 50 -0.489 -5.939 -9.548 1.00 0.00 N ATOM 730 CA THR A 50 0.935 -6.261 -9.869 1.00 0.00 C ATOM 731 C THR A 50 1.330 -5.679 -11.225 1.00 0.00 C ATOM 732 O THR A 50 0.510 -5.519 -12.111 1.00 0.00 O ATOM 733 CB THR A 50 1.013 -7.790 -9.906 1.00 0.00 C ATOM 734 OG1 THR A 50 0.507 -8.318 -8.689 1.00 0.00 O ATOM 735 CG2 THR A 50 2.472 -8.226 -10.092 1.00 0.00 C ATOM 0 H THR A 50 -1.186 -6.507 -10.030 1.00 0.00 H new ATOM 0 HA THR A 50 1.615 -5.836 -9.131 1.00 0.00 H new ATOM 0 HB THR A 50 0.417 -8.165 -10.738 1.00 0.00 H new ATOM 0 HG1 THR A 50 0.555 -9.297 -8.712 1.00 0.00 H new ATOM 0 HG21 THR A 50 2.526 -9.314 -10.118 1.00 0.00 H new ATOM 0 HG22 THR A 50 2.856 -7.821 -11.028 1.00 0.00 H new ATOM 0 HG23 THR A 50 3.072 -7.853 -9.262 1.00 0.00 H new ATOM 743 N VAL A 51 2.585 -5.364 -11.387 1.00 0.00 N ATOM 744 CA VAL A 51 3.056 -4.795 -12.680 1.00 0.00 C ATOM 745 C VAL A 51 3.206 -5.907 -13.721 1.00 0.00 C ATOM 746 O VAL A 51 4.095 -6.728 -13.637 1.00 0.00 O ATOM 747 CB VAL A 51 4.419 -4.180 -12.359 1.00 0.00 C ATOM 748 CG1 VAL A 51 4.904 -3.358 -13.548 1.00 0.00 C ATOM 749 CG2 VAL A 51 4.297 -3.286 -11.130 1.00 0.00 C ATOM 0 H VAL A 51 3.308 -5.477 -10.676 1.00 0.00 H new ATOM 0 HA VAL A 51 2.360 -4.064 -13.092 1.00 0.00 H new ATOM 0 HB VAL A 51 5.137 -4.975 -12.157 1.00 0.00 H new ATOM 0 HG11 VAL A 51 5.875 -2.921 -13.316 1.00 0.00 H new ATOM 0 HG12 VAL A 51 4.995 -4.002 -14.423 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.189 -2.562 -13.756 1.00 0.00 H new ATOM 0 HG21 VAL A 51 5.268 -2.848 -10.901 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.578 -2.491 -11.328 1.00 0.00 H new ATOM 0 HG23 VAL A 51 3.957 -3.879 -10.281 1.00 0.00 H new ATOM 759 N THR A 52 2.387 -5.899 -14.734 1.00 0.00 N ATOM 760 CA THR A 52 2.533 -6.912 -15.815 1.00 0.00 C ATOM 761 C THR A 52 3.802 -6.637 -16.613 1.00 0.00 C ATOM 762 O THR A 52 4.504 -7.543 -17.016 1.00 0.00 O ATOM 763 CB THR A 52 1.304 -6.726 -16.705 1.00 0.00 C ATOM 764 OG1 THR A 52 1.384 -5.469 -17.363 1.00 0.00 O ATOM 765 CG2 THR A 52 0.044 -6.775 -15.847 1.00 0.00 C ATOM 0 H THR A 52 1.623 -5.235 -14.860 1.00 0.00 H new ATOM 0 HA THR A 52 2.605 -7.927 -15.423 1.00 0.00 H new ATOM 0 HB THR A 52 1.267 -7.523 -17.448 1.00 0.00 H new ATOM 0 HG1 THR A 52 1.636 -4.777 -16.717 1.00 0.00 H new ATOM 0 HG21 THR A 52 -0.833 -6.642 -16.481 1.00 0.00 H new ATOM 0 HG22 THR A 52 -0.015 -7.739 -15.342 1.00 0.00 H new ATOM 0 HG23 THR A 52 0.079 -5.978 -15.104 1.00 0.00 H new ATOM 773 N GLU A 53 4.088 -5.392 -16.871 1.00 0.00 N ATOM 774 CA GLU A 53 5.300 -5.072 -17.677 1.00 0.00 C ATOM 775 C GLU A 53 5.652 -3.590 -17.563 1.00 0.00 C ATOM 776 O GLU A 53 4.793 -2.749 -17.451 1.00 0.00 O ATOM 777 CB GLU A 53 4.918 -5.419 -19.116 1.00 0.00 C ATOM 778 CG GLU A 53 6.099 -5.127 -20.044 1.00 0.00 C ATOM 779 CD GLU A 53 5.716 -5.475 -21.484 1.00 0.00 C ATOM 780 OE1 GLU A 53 4.672 -6.079 -21.669 1.00 0.00 O ATOM 781 OE2 GLU A 53 6.472 -5.130 -22.377 1.00 0.00 O ATOM 0 H GLU A 53 3.541 -4.588 -16.562 1.00 0.00 H new ATOM 0 HA GLU A 53 6.174 -5.627 -17.335 1.00 0.00 H new ATOM 0 HB2 GLU A 53 4.639 -6.470 -19.186 1.00 0.00 H new ATOM 0 HB3 GLU A 53 4.049 -4.837 -19.423 1.00 0.00 H new ATOM 0 HG2 GLU A 53 6.378 -4.076 -19.975 1.00 0.00 H new ATOM 0 HG3 GLU A 53 6.968 -5.708 -19.737 1.00 0.00 H new ATOM 788 N ILE A 54 6.903 -3.261 -17.705 1.00 0.00 N ATOM 789 CA ILE A 54 7.299 -1.824 -17.733 1.00 0.00 C ATOM 790 C ILE A 54 7.666 -1.412 -19.152 1.00 0.00 C ATOM 791 O ILE A 54 8.435 -2.067 -19.828 1.00 0.00 O ATOM 792 CB ILE A 54 8.513 -1.727 -16.814 1.00 0.00 C ATOM 793 CG1 ILE A 54 8.070 -1.958 -15.370 1.00 0.00 C ATOM 794 CG2 ILE A 54 9.118 -0.331 -16.940 1.00 0.00 C ATOM 795 CD1 ILE A 54 9.135 -2.764 -14.618 1.00 0.00 C ATOM 0 H ILE A 54 7.671 -3.925 -17.803 1.00 0.00 H new ATOM 0 HA ILE A 54 6.493 -1.166 -17.408 1.00 0.00 H new ATOM 0 HB ILE A 54 9.252 -2.478 -17.093 1.00 0.00 H new ATOM 0 HG12 ILE A 54 7.908 -1.001 -14.873 1.00 0.00 H new ATOM 0 HG13 ILE A 54 7.119 -2.491 -15.353 1.00 0.00 H new ATOM 0 HG21 ILE A 54 9.987 -0.251 -16.287 1.00 0.00 H new ATOM 0 HG22 ILE A 54 9.423 -0.158 -17.972 1.00 0.00 H new ATOM 0 HG23 ILE A 54 8.377 0.414 -16.651 1.00 0.00 H new ATOM 0 HD11 ILE A 54 8.811 -2.924 -13.590 1.00 0.00 H new ATOM 0 HD12 ILE A 54 9.276 -3.727 -15.108 1.00 0.00 H new ATOM 0 HD13 ILE A 54 10.076 -2.215 -14.621 1.00 0.00 H new ATOM 807 N ASN A 55 7.133 -0.316 -19.595 1.00 0.00 N ATOM 808 CA ASN A 55 7.457 0.172 -20.962 1.00 0.00 C ATOM 809 C ASN A 55 8.401 1.367 -20.867 1.00 0.00 C ATOM 810 O ASN A 55 8.015 2.500 -21.092 1.00 0.00 O ATOM 811 CB ASN A 55 6.114 0.579 -21.569 1.00 0.00 C ATOM 812 CG ASN A 55 5.362 -0.676 -22.015 1.00 0.00 C ATOM 813 OD1 ASN A 55 5.683 -1.261 -23.030 1.00 0.00 O ATOM 814 ND2 ASN A 55 4.371 -1.120 -21.292 1.00 0.00 N ATOM 0 H ASN A 55 6.483 0.268 -19.069 1.00 0.00 H new ATOM 0 HA ASN A 55 7.956 -0.581 -21.572 1.00 0.00 H new ATOM 0 HB2 ASN A 55 5.523 1.131 -20.838 1.00 0.00 H new ATOM 0 HB3 ASN A 55 6.272 1.244 -22.418 1.00 0.00 H new ATOM 0 HD21 ASN A 55 3.866 -1.958 -21.579 1.00 0.00 H new ATOM 0 HD22 ASN A 55 4.101 -0.629 -20.440 1.00 0.00 H new ATOM 821 N GLY A 56 9.590 1.143 -20.387 1.00 0.00 N ATOM 822 CA GLY A 56 10.502 2.285 -20.117 1.00 0.00 C ATOM 823 C GLY A 56 10.059 2.970 -18.831 1.00 0.00 C ATOM 824 O GLY A 56 10.037 2.366 -17.777 1.00 0.00 O ATOM 0 H GLY A 56 9.969 0.221 -20.171 1.00 0.00 H new ATOM 0 HA2 GLY A 56 11.530 1.934 -20.023 1.00 0.00 H new ATOM 0 HA3 GLY A 56 10.480 2.990 -20.948 1.00 0.00 H new ATOM 828 N ASN A 57 9.627 4.196 -18.911 1.00 0.00 N ATOM 829 CA ASN A 57 9.103 4.855 -17.690 1.00 0.00 C ATOM 830 C ASN A 57 7.656 4.394 -17.447 1.00 0.00 C ATOM 831 O ASN A 57 7.125 4.526 -16.362 1.00 0.00 O ATOM 832 CB ASN A 57 9.212 6.369 -17.968 1.00 0.00 C ATOM 833 CG ASN A 57 7.837 6.987 -18.212 1.00 0.00 C ATOM 834 OD1 ASN A 57 7.507 7.393 -19.309 1.00 0.00 O ATOM 835 ND2 ASN A 57 7.032 7.065 -17.202 1.00 0.00 N ATOM 0 H ASN A 57 9.615 4.763 -19.759 1.00 0.00 H new ATOM 0 HA ASN A 57 9.656 4.601 -16.786 1.00 0.00 H new ATOM 0 HB2 ASN A 57 9.691 6.863 -17.122 1.00 0.00 H new ATOM 0 HB3 ASN A 57 9.848 6.537 -18.837 1.00 0.00 H new ATOM 0 HD21 ASN A 57 6.104 7.472 -17.320 1.00 0.00 H new ATOM 0 HD22 ASN A 57 7.325 6.719 -16.288 1.00 0.00 H new ATOM 842 N HIS A 58 6.999 3.904 -18.468 1.00 0.00 N ATOM 843 CA HIS A 58 5.575 3.493 -18.302 1.00 0.00 C ATOM 844 C HIS A 58 5.499 2.175 -17.552 1.00 0.00 C ATOM 845 O HIS A 58 6.415 1.384 -17.586 1.00 0.00 O ATOM 846 CB HIS A 58 5.034 3.297 -19.712 1.00 0.00 C ATOM 847 CG HIS A 58 4.566 4.617 -20.266 1.00 0.00 C ATOM 848 ND1 HIS A 58 4.883 5.032 -21.549 1.00 0.00 N ATOM 849 CD2 HIS A 58 3.786 5.617 -19.730 1.00 0.00 C ATOM 850 CE1 HIS A 58 4.301 6.231 -21.742 1.00 0.00 C ATOM 851 NE2 HIS A 58 3.623 6.633 -20.665 1.00 0.00 N ATOM 0 H HIS A 58 7.385 3.772 -19.403 1.00 0.00 H new ATOM 0 HA HIS A 58 5.008 4.237 -17.742 1.00 0.00 H new ATOM 0 HB2 HIS A 58 5.809 2.877 -20.354 1.00 0.00 H new ATOM 0 HB3 HIS A 58 4.209 2.584 -19.699 1.00 0.00 H new ATOM 0 HD1 HIS A 58 5.453 4.523 -22.224 1.00 0.00 H new ATOM 0 HD2 HIS A 58 3.365 5.613 -18.735 1.00 0.00 H new ATOM 0 HE1 HIS A 58 4.374 6.799 -22.658 1.00 0.00 H new ATOM 859 N VAL A 59 4.381 1.883 -16.963 1.00 0.00 N ATOM 860 CA VAL A 59 4.230 0.558 -16.321 1.00 0.00 C ATOM 861 C VAL A 59 2.818 0.004 -16.531 1.00 0.00 C ATOM 862 O VAL A 59 1.840 0.582 -16.105 1.00 0.00 O ATOM 863 CB VAL A 59 4.523 0.821 -14.852 1.00 0.00 C ATOM 864 CG1 VAL A 59 4.278 -0.452 -14.057 1.00 0.00 C ATOM 865 CG2 VAL A 59 5.989 1.233 -14.717 1.00 0.00 C ATOM 0 H VAL A 59 3.571 2.499 -16.898 1.00 0.00 H new ATOM 0 HA VAL A 59 4.898 -0.194 -16.741 1.00 0.00 H new ATOM 0 HB VAL A 59 3.876 1.612 -14.473 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.487 -0.269 -13.003 1.00 0.00 H new ATOM 0 HG12 VAL A 59 3.239 -0.759 -14.173 1.00 0.00 H new ATOM 0 HG13 VAL A 59 4.933 -1.242 -14.424 1.00 0.00 H new ATOM 0 HG21 VAL A 59 6.218 1.426 -13.669 1.00 0.00 H new ATOM 0 HG22 VAL A 59 6.628 0.431 -15.086 1.00 0.00 H new ATOM 0 HG23 VAL A 59 6.168 2.137 -15.300 1.00 0.00 H new ATOM 875 N SER A 60 2.722 -1.135 -17.157 1.00 0.00 N ATOM 876 CA SER A 60 1.393 -1.780 -17.373 1.00 0.00 C ATOM 877 C SER A 60 1.035 -2.649 -16.164 1.00 0.00 C ATOM 878 O SER A 60 1.797 -3.508 -15.772 1.00 0.00 O ATOM 879 CB SER A 60 1.586 -2.657 -18.610 1.00 0.00 C ATOM 880 OG SER A 60 2.080 -1.861 -19.679 1.00 0.00 O ATOM 0 H SER A 60 3.515 -1.654 -17.533 1.00 0.00 H new ATOM 0 HA SER A 60 0.591 -1.053 -17.501 1.00 0.00 H new ATOM 0 HB2 SER A 60 2.284 -3.466 -18.391 1.00 0.00 H new ATOM 0 HB3 SER A 60 0.640 -3.120 -18.893 1.00 0.00 H new ATOM 0 HG SER A 60 2.206 -2.421 -20.473 1.00 0.00 H new ATOM 886 N PHE A 61 -0.131 -2.478 -15.598 1.00 0.00 N ATOM 887 CA PHE A 61 -0.530 -3.349 -14.455 1.00 0.00 C ATOM 888 C PHE A 61 -1.709 -4.243 -14.862 1.00 0.00 C ATOM 889 O PHE A 61 -2.392 -3.976 -15.828 1.00 0.00 O ATOM 890 CB PHE A 61 -0.961 -2.391 -13.343 1.00 0.00 C ATOM 891 CG PHE A 61 0.205 -1.534 -12.910 1.00 0.00 C ATOM 892 CD1 PHE A 61 0.443 -0.304 -13.540 1.00 0.00 C ATOM 893 CD2 PHE A 61 1.042 -1.962 -11.869 1.00 0.00 C ATOM 894 CE1 PHE A 61 1.517 0.498 -13.129 1.00 0.00 C ATOM 895 CE2 PHE A 61 2.117 -1.160 -11.460 1.00 0.00 C ATOM 896 CZ PHE A 61 2.353 0.070 -12.089 1.00 0.00 C ATOM 0 H PHE A 61 -0.819 -1.778 -15.876 1.00 0.00 H new ATOM 0 HA PHE A 61 0.284 -4.002 -14.138 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -1.776 -1.758 -13.694 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.341 -2.957 -12.493 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -0.201 0.026 -14.342 1.00 0.00 H new ATOM 0 HD2 PHE A 61 0.859 -2.909 -11.383 1.00 0.00 H new ATOM 0 HE1 PHE A 61 1.700 1.446 -13.614 1.00 0.00 H new ATOM 0 HE2 PHE A 61 2.763 -1.490 -10.660 1.00 0.00 H new ATOM 0 HZ PHE A 61 3.180 0.688 -11.772 1.00 0.00 H new ATOM 906 N ASP A 62 -1.929 -5.321 -14.156 1.00 0.00 N ATOM 907 CA ASP A 62 -3.041 -6.246 -14.543 1.00 0.00 C ATOM 908 C ASP A 62 -4.323 -5.921 -13.790 1.00 0.00 C ATOM 909 O ASP A 62 -4.312 -5.433 -12.678 1.00 0.00 O ATOM 910 CB ASP A 62 -2.556 -7.650 -14.179 1.00 0.00 C ATOM 911 CG ASP A 62 -2.228 -7.705 -12.686 1.00 0.00 C ATOM 912 OD1 ASP A 62 -2.032 -6.651 -12.103 1.00 0.00 O ATOM 913 OD2 ASP A 62 -2.181 -8.800 -12.150 1.00 0.00 O ATOM 0 H ASP A 62 -1.393 -5.601 -13.335 1.00 0.00 H new ATOM 0 HA ASP A 62 -3.274 -6.153 -15.604 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -3.323 -8.385 -14.421 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -1.674 -7.905 -14.766 1.00 0.00 H new ATOM 918 N LEU A 63 -5.431 -6.137 -14.433 1.00 0.00 N ATOM 919 CA LEU A 63 -6.736 -5.788 -13.826 1.00 0.00 C ATOM 920 C LEU A 63 -7.828 -6.663 -14.442 1.00 0.00 C ATOM 921 O LEU A 63 -8.126 -6.554 -15.614 1.00 0.00 O ATOM 922 CB LEU A 63 -6.936 -4.327 -14.217 1.00 0.00 C ATOM 923 CG LEU A 63 -6.969 -3.445 -12.968 1.00 0.00 C ATOM 924 CD1 LEU A 63 -5.867 -2.389 -13.085 1.00 0.00 C ATOM 925 CD2 LEU A 63 -8.337 -2.755 -12.855 1.00 0.00 C ATOM 0 H LEU A 63 -5.487 -6.546 -15.366 1.00 0.00 H new ATOM 0 HA LEU A 63 -6.772 -5.939 -12.747 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -6.130 -4.006 -14.876 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -7.866 -4.216 -14.774 1.00 0.00 H new ATOM 0 HG LEU A 63 -6.807 -4.055 -12.079 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -5.878 -1.752 -12.201 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.898 -2.882 -13.165 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -6.039 -1.780 -13.973 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -8.356 -2.128 -11.964 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -8.507 -2.137 -13.737 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -9.120 -3.510 -12.784 1.00 0.00 H new ATOM 937 N MET A 64 -8.452 -7.510 -13.673 1.00 0.00 N ATOM 938 CA MET A 64 -9.542 -8.344 -14.254 1.00 0.00 C ATOM 939 C MET A 64 -10.752 -7.461 -14.552 1.00 0.00 C ATOM 940 O MET A 64 -11.065 -6.562 -13.806 1.00 0.00 O ATOM 941 CB MET A 64 -9.881 -9.389 -13.190 1.00 0.00 C ATOM 942 CG MET A 64 -10.814 -10.442 -13.792 1.00 0.00 C ATOM 943 SD MET A 64 -11.409 -11.542 -12.484 1.00 0.00 S ATOM 944 CE MET A 64 -9.841 -12.385 -12.163 1.00 0.00 C ATOM 0 H MET A 64 -8.260 -7.661 -12.683 1.00 0.00 H new ATOM 0 HA MET A 64 -9.246 -8.821 -15.188 1.00 0.00 H new ATOM 0 HB2 MET A 64 -8.969 -9.861 -12.825 1.00 0.00 H new ATOM 0 HB3 MET A 64 -10.358 -8.911 -12.334 1.00 0.00 H new ATOM 0 HG2 MET A 64 -11.657 -9.957 -14.285 1.00 0.00 H new ATOM 0 HG3 MET A 64 -10.287 -11.017 -14.553 1.00 0.00 H new ATOM 0 HE1 MET A 64 -10.036 -13.347 -11.690 1.00 0.00 H new ATOM 0 HE2 MET A 64 -9.314 -12.543 -13.104 1.00 0.00 H new ATOM 0 HE3 MET A 64 -9.228 -11.773 -11.502 1.00 0.00 H new ATOM 954 N LYS A 65 -11.404 -7.672 -15.659 1.00 0.00 N ATOM 955 CA LYS A 65 -12.555 -6.797 -16.017 1.00 0.00 C ATOM 956 C LYS A 65 -13.636 -6.883 -14.940 1.00 0.00 C ATOM 957 O LYS A 65 -14.191 -5.887 -14.520 1.00 0.00 O ATOM 958 CB LYS A 65 -13.075 -7.350 -17.344 1.00 0.00 C ATOM 959 CG LYS A 65 -14.271 -6.517 -17.809 1.00 0.00 C ATOM 960 CD LYS A 65 -14.791 -7.070 -19.137 1.00 0.00 C ATOM 961 CE LYS A 65 -15.986 -6.237 -19.606 1.00 0.00 C ATOM 962 NZ LYS A 65 -17.098 -7.214 -19.761 1.00 0.00 N ATOM 0 H LYS A 65 -11.192 -8.410 -16.330 1.00 0.00 H new ATOM 0 HA LYS A 65 -12.269 -5.748 -16.097 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -12.286 -7.324 -18.095 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -13.368 -8.393 -17.226 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -15.060 -6.543 -17.058 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -13.978 -5.474 -17.927 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -14.001 -7.046 -19.887 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -15.086 -8.113 -19.018 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -16.238 -5.464 -18.880 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -15.770 -5.732 -20.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -17.954 -6.718 -20.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -16.832 -7.934 -20.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -17.286 -7.674 -18.847 1.00 0.00 H new ATOM 976 N GLU A 66 -13.918 -8.058 -14.458 1.00 0.00 N ATOM 977 CA GLU A 66 -14.936 -8.178 -13.381 1.00 0.00 C ATOM 978 C GLU A 66 -14.397 -7.578 -12.084 1.00 0.00 C ATOM 979 O GLU A 66 -15.067 -6.814 -11.428 1.00 0.00 O ATOM 980 CB GLU A 66 -15.184 -9.679 -13.226 1.00 0.00 C ATOM 981 CG GLU A 66 -16.227 -9.915 -12.132 1.00 0.00 C ATOM 982 CD GLU A 66 -16.473 -11.417 -11.980 1.00 0.00 C ATOM 983 OE1 GLU A 66 -15.973 -12.165 -12.803 1.00 0.00 O ATOM 984 OE2 GLU A 66 -17.155 -11.793 -11.041 1.00 0.00 O ATOM 0 H GLU A 66 -13.492 -8.934 -14.760 1.00 0.00 H new ATOM 0 HA GLU A 66 -15.856 -7.644 -13.619 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -15.530 -10.100 -14.170 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -14.254 -10.187 -12.972 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -15.881 -9.495 -11.188 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -17.157 -9.407 -12.385 1.00 0.00 H new ATOM 991 N THR A 67 -13.145 -7.797 -11.786 1.00 0.00 N ATOM 992 CA THR A 67 -12.534 -7.094 -10.622 1.00 0.00 C ATOM 993 C THR A 67 -12.587 -5.587 -10.860 1.00 0.00 C ATOM 994 O THR A 67 -12.766 -4.811 -9.954 1.00 0.00 O ATOM 995 CB THR A 67 -11.084 -7.573 -10.557 1.00 0.00 C ATOM 996 OG1 THR A 67 -11.059 -8.982 -10.379 1.00 0.00 O ATOM 997 CG2 THR A 67 -10.379 -6.898 -9.380 1.00 0.00 C ATOM 0 H THR A 67 -12.523 -8.427 -12.293 1.00 0.00 H new ATOM 0 HA THR A 67 -13.059 -7.305 -9.690 1.00 0.00 H new ATOM 0 HB THR A 67 -10.573 -7.315 -11.484 1.00 0.00 H new ATOM 0 HG1 THR A 67 -10.130 -9.288 -10.323 1.00 0.00 H new ATOM 0 HG21 THR A 67 -9.345 -7.238 -9.332 1.00 0.00 H new ATOM 0 HG22 THR A 67 -10.399 -5.817 -9.515 1.00 0.00 H new ATOM 0 HG23 THR A 67 -10.890 -7.157 -8.453 1.00 0.00 H new ATOM 1005 N LEU A 68 -12.430 -5.170 -12.081 1.00 0.00 N ATOM 1006 CA LEU A 68 -12.470 -3.722 -12.386 1.00 0.00 C ATOM 1007 C LEU A 68 -13.832 -3.161 -11.974 1.00 0.00 C ATOM 1008 O LEU A 68 -13.922 -2.159 -11.293 1.00 0.00 O ATOM 1009 CB LEU A 68 -12.281 -3.667 -13.900 1.00 0.00 C ATOM 1010 CG LEU A 68 -12.095 -2.224 -14.351 1.00 0.00 C ATOM 1011 CD1 LEU A 68 -10.736 -1.709 -13.872 1.00 0.00 C ATOM 1012 CD2 LEU A 68 -12.151 -2.182 -15.875 1.00 0.00 C ATOM 0 H LEU A 68 -12.275 -5.777 -12.886 1.00 0.00 H new ATOM 0 HA LEU A 68 -11.716 -3.136 -11.860 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -11.414 -4.261 -14.188 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -13.146 -4.104 -14.399 1.00 0.00 H new ATOM 0 HG LEU A 68 -12.881 -1.596 -13.931 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -10.604 -0.676 -14.195 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -10.692 -1.757 -12.784 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.943 -2.326 -14.295 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -12.019 -1.155 -16.216 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -11.357 -2.805 -16.286 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -13.117 -2.556 -16.214 1.00 0.00 H new ATOM 1024 N ARG A 69 -14.886 -3.873 -12.276 1.00 0.00 N ATOM 1025 CA ARG A 69 -16.232 -3.460 -11.781 1.00 0.00 C ATOM 1026 C ARG A 69 -16.336 -3.660 -10.262 1.00 0.00 C ATOM 1027 O ARG A 69 -16.943 -2.873 -9.564 1.00 0.00 O ATOM 1028 CB ARG A 69 -17.211 -4.381 -12.504 1.00 0.00 C ATOM 1029 CG ARG A 69 -18.604 -4.223 -11.895 1.00 0.00 C ATOM 1030 CD ARG A 69 -19.581 -5.146 -12.623 1.00 0.00 C ATOM 1031 NE ARG A 69 -20.890 -4.932 -11.945 1.00 0.00 N ATOM 1032 CZ ARG A 69 -21.572 -3.838 -12.160 1.00 0.00 C ATOM 1033 NH1 ARG A 69 -21.114 -2.925 -12.974 1.00 0.00 N ATOM 1034 NH2 ARG A 69 -22.716 -3.657 -11.558 1.00 0.00 N ATOM 0 H ARG A 69 -14.873 -4.721 -12.843 1.00 0.00 H new ATOM 0 HA ARG A 69 -16.433 -2.406 -11.973 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -17.237 -4.139 -13.566 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -16.881 -5.417 -12.421 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -18.579 -4.466 -10.833 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -18.934 -3.187 -11.977 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -19.641 -4.900 -13.683 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -19.266 -6.187 -12.554 1.00 0.00 H new ATOM 0 HE ARG A 69 -21.256 -5.642 -11.310 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -20.220 -3.064 -13.445 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -21.650 -2.073 -13.138 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -23.076 -4.368 -10.922 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -23.250 -2.804 -11.724 1.00 0.00 H new ATOM 1048 N ILE A 70 -15.796 -4.737 -9.755 1.00 0.00 N ATOM 1049 CA ILE A 70 -15.915 -5.024 -8.299 1.00 0.00 C ATOM 1050 C ILE A 70 -15.210 -3.922 -7.511 1.00 0.00 C ATOM 1051 O ILE A 70 -15.727 -3.388 -6.551 1.00 0.00 O ATOM 1052 CB ILE A 70 -15.239 -6.400 -8.130 1.00 0.00 C ATOM 1053 CG1 ILE A 70 -16.121 -7.289 -7.255 1.00 0.00 C ATOM 1054 CG2 ILE A 70 -13.847 -6.290 -7.483 1.00 0.00 C ATOM 1055 CD1 ILE A 70 -15.671 -8.745 -7.390 1.00 0.00 C ATOM 0 H ILE A 70 -15.276 -5.432 -10.291 1.00 0.00 H new ATOM 0 HA ILE A 70 -16.940 -5.047 -7.930 1.00 0.00 H new ATOM 0 HB ILE A 70 -15.114 -6.829 -9.124 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -16.056 -6.972 -6.214 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -17.165 -7.191 -7.554 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -13.412 -7.284 -7.385 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -13.203 -5.672 -8.108 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -13.939 -5.836 -6.497 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -16.300 -9.380 -6.766 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -15.759 -9.058 -8.430 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -14.633 -8.836 -7.070 1.00 0.00 H new ATOM 1067 N THR A 71 -14.071 -3.520 -7.987 1.00 0.00 N ATOM 1068 CA THR A 71 -13.355 -2.384 -7.366 1.00 0.00 C ATOM 1069 C THR A 71 -13.823 -1.087 -8.013 1.00 0.00 C ATOM 1070 O THR A 71 -14.616 -1.094 -8.933 1.00 0.00 O ATOM 1071 CB THR A 71 -11.876 -2.621 -7.679 1.00 0.00 C ATOM 1072 OG1 THR A 71 -11.628 -2.301 -9.041 1.00 0.00 O ATOM 1073 CG2 THR A 71 -11.521 -4.084 -7.428 1.00 0.00 C ATOM 0 H THR A 71 -13.601 -3.937 -8.791 1.00 0.00 H new ATOM 0 HA THR A 71 -13.534 -2.311 -6.293 1.00 0.00 H new ATOM 0 HB THR A 71 -11.265 -1.989 -7.035 1.00 0.00 H new ATOM 0 HG1 THR A 71 -11.953 -3.028 -9.612 1.00 0.00 H new ATOM 0 HG21 THR A 71 -10.467 -4.246 -7.653 1.00 0.00 H new ATOM 0 HG22 THR A 71 -11.712 -4.331 -6.384 1.00 0.00 H new ATOM 0 HG23 THR A 71 -12.131 -4.721 -8.068 1.00 0.00 H new ATOM 1081 N ASN A 72 -13.214 0.000 -7.661 1.00 0.00 N ATOM 1082 CA ASN A 72 -13.485 1.258 -8.388 1.00 0.00 C ATOM 1083 C ASN A 72 -12.309 1.528 -9.336 1.00 0.00 C ATOM 1084 O ASN A 72 -12.091 2.634 -9.785 1.00 0.00 O ATOM 1085 CB ASN A 72 -13.621 2.302 -7.271 1.00 0.00 C ATOM 1086 CG ASN A 72 -13.256 3.701 -7.767 1.00 0.00 C ATOM 1087 OD1 ASN A 72 -13.627 4.095 -8.855 1.00 0.00 O ATOM 1088 ND2 ASN A 72 -12.556 4.483 -6.989 1.00 0.00 N ATOM 0 H ASN A 72 -12.539 0.072 -6.900 1.00 0.00 H new ATOM 0 HA ASN A 72 -14.378 1.253 -9.012 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -14.644 2.303 -6.895 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -12.975 2.030 -6.436 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -12.320 5.427 -7.294 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -12.246 4.149 -6.076 1.00 0.00 H new ATOM 1095 N LEU A 73 -11.597 0.488 -9.718 1.00 0.00 N ATOM 1096 CA LEU A 73 -10.505 0.667 -10.713 1.00 0.00 C ATOM 1097 C LEU A 73 -11.094 1.029 -12.083 1.00 0.00 C ATOM 1098 O LEU A 73 -10.562 1.856 -12.797 1.00 0.00 O ATOM 1099 CB LEU A 73 -9.793 -0.687 -10.768 1.00 0.00 C ATOM 1100 CG LEU A 73 -9.055 -0.943 -9.448 1.00 0.00 C ATOM 1101 CD1 LEU A 73 -8.348 -2.298 -9.522 1.00 0.00 C ATOM 1102 CD2 LEU A 73 -8.020 0.161 -9.220 1.00 0.00 C ATOM 0 H LEU A 73 -11.730 -0.466 -9.382 1.00 0.00 H new ATOM 0 HA LEU A 73 -9.822 1.472 -10.441 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -10.517 -1.481 -10.950 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -9.087 -0.703 -11.598 1.00 0.00 H new ATOM 0 HG LEU A 73 -9.768 -0.946 -8.624 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -7.822 -2.485 -8.586 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -9.085 -3.084 -9.688 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -7.633 -2.291 -10.345 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -7.495 -0.020 -8.282 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -7.304 0.164 -10.042 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -8.523 1.127 -9.174 1.00 0.00 H new ATOM 1114 N GLY A 74 -12.187 0.413 -12.459 1.00 0.00 N ATOM 1115 CA GLY A 74 -12.803 0.717 -13.781 1.00 0.00 C ATOM 1116 C GLY A 74 -12.853 2.231 -14.009 1.00 0.00 C ATOM 1117 O GLY A 74 -12.966 2.693 -15.127 1.00 0.00 O ATOM 0 H GLY A 74 -12.678 -0.288 -11.904 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.228 0.242 -14.576 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -13.810 0.302 -13.824 1.00 0.00 H new ATOM 1121 N ASP A 75 -12.843 3.005 -12.959 1.00 0.00 N ATOM 1122 CA ASP A 75 -12.971 4.483 -13.121 1.00 0.00 C ATOM 1123 C ASP A 75 -11.752 5.055 -13.853 1.00 0.00 C ATOM 1124 O ASP A 75 -11.779 6.166 -14.344 1.00 0.00 O ATOM 1125 CB ASP A 75 -13.042 5.029 -11.695 1.00 0.00 C ATOM 1126 CG ASP A 75 -11.683 4.863 -11.012 1.00 0.00 C ATOM 1127 OD1 ASP A 75 -10.906 4.044 -11.473 1.00 0.00 O ATOM 1128 OD2 ASP A 75 -11.443 5.558 -10.038 1.00 0.00 O ATOM 0 H ASP A 75 -12.752 2.680 -11.997 1.00 0.00 H new ATOM 0 HA ASP A 75 -13.846 4.755 -13.712 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -13.325 6.081 -11.712 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -13.811 4.501 -11.131 1.00 0.00 H new ATOM 1133 N LEU A 76 -10.666 4.334 -13.873 1.00 0.00 N ATOM 1134 CA LEU A 76 -9.426 4.871 -14.507 1.00 0.00 C ATOM 1135 C LEU A 76 -9.654 5.156 -15.991 1.00 0.00 C ATOM 1136 O LEU A 76 -10.300 4.403 -16.693 1.00 0.00 O ATOM 1137 CB LEU A 76 -8.378 3.778 -14.339 1.00 0.00 C ATOM 1138 CG LEU A 76 -8.084 3.578 -12.853 1.00 0.00 C ATOM 1139 CD1 LEU A 76 -7.186 2.354 -12.670 1.00 0.00 C ATOM 1140 CD2 LEU A 76 -7.374 4.820 -12.309 1.00 0.00 C ATOM 0 H LEU A 76 -10.582 3.397 -13.479 1.00 0.00 H new ATOM 0 HA LEU A 76 -9.118 5.810 -14.047 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -8.735 2.847 -14.779 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -7.465 4.051 -14.868 1.00 0.00 H new ATOM 0 HG LEU A 76 -9.018 3.424 -12.312 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.976 2.212 -11.610 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -7.690 1.471 -13.062 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.250 2.506 -13.208 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -7.162 4.683 -11.249 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -6.440 4.971 -12.850 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -8.014 5.692 -12.441 1.00 0.00 H new ATOM 1152 N LYS A 77 -9.053 6.199 -16.482 1.00 0.00 N ATOM 1153 CA LYS A 77 -9.138 6.506 -17.940 1.00 0.00 C ATOM 1154 C LYS A 77 -7.843 7.175 -18.404 1.00 0.00 C ATOM 1155 O LYS A 77 -7.237 7.946 -17.684 1.00 0.00 O ATOM 1156 CB LYS A 77 -10.319 7.466 -18.075 1.00 0.00 C ATOM 1157 CG LYS A 77 -11.618 6.716 -17.777 1.00 0.00 C ATOM 1158 CD LYS A 77 -12.804 7.671 -17.911 1.00 0.00 C ATOM 1159 CE LYS A 77 -14.102 6.916 -17.612 1.00 0.00 C ATOM 1160 NZ LYS A 77 -15.173 7.673 -18.325 1.00 0.00 N ATOM 0 H LYS A 77 -8.501 6.860 -15.935 1.00 0.00 H new ATOM 0 HA LYS A 77 -9.274 5.612 -18.549 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -10.203 8.303 -17.386 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -10.350 7.884 -19.081 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -11.733 5.879 -18.466 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -11.586 6.299 -16.771 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -12.690 8.508 -17.222 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -12.837 8.088 -18.917 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -14.048 5.886 -17.964 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -14.296 6.876 -16.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -16.091 7.211 -18.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -15.208 8.648 -17.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -14.968 7.688 -19.344 1.00 0.00 H new ATOM 1174 N VAL A 78 -7.360 6.824 -19.560 1.00 0.00 N ATOM 1175 CA VAL A 78 -6.047 7.373 -19.996 1.00 0.00 C ATOM 1176 C VAL A 78 -6.120 8.890 -20.120 1.00 0.00 C ATOM 1177 O VAL A 78 -7.183 9.466 -20.236 1.00 0.00 O ATOM 1178 CB VAL A 78 -5.765 6.754 -21.353 1.00 0.00 C ATOM 1179 CG1 VAL A 78 -4.334 7.097 -21.767 1.00 0.00 C ATOM 1180 CG2 VAL A 78 -5.922 5.244 -21.255 1.00 0.00 C ATOM 0 H VAL A 78 -7.811 6.187 -20.217 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.262 7.142 -19.276 1.00 0.00 H new ATOM 0 HB VAL A 78 -6.463 7.143 -22.095 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -4.122 6.657 -22.741 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -4.222 8.180 -21.826 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -3.637 6.700 -21.029 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -5.721 4.793 -22.227 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.218 4.852 -20.521 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -6.940 5.003 -20.947 1.00 0.00 H new ATOM 1190 N GLY A 79 -5.007 9.544 -19.977 1.00 0.00 N ATOM 1191 CA GLY A 79 -5.019 11.025 -19.953 1.00 0.00 C ATOM 1192 C GLY A 79 -5.226 11.488 -18.511 1.00 0.00 C ATOM 1193 O GLY A 79 -4.955 12.620 -18.164 1.00 0.00 O ATOM 0 H GLY A 79 -4.087 9.115 -19.875 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.081 11.417 -20.345 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.816 11.407 -20.591 1.00 0.00 H new ATOM 1197 N ASP A 80 -5.641 10.591 -17.651 1.00 0.00 N ATOM 1198 CA ASP A 80 -5.788 10.944 -16.211 1.00 0.00 C ATOM 1199 C ASP A 80 -4.572 10.439 -15.434 1.00 0.00 C ATOM 1200 O ASP A 80 -3.794 9.658 -15.934 1.00 0.00 O ATOM 1201 CB ASP A 80 -7.051 10.212 -15.755 1.00 0.00 C ATOM 1202 CG ASP A 80 -7.538 10.808 -14.433 1.00 0.00 C ATOM 1203 OD1 ASP A 80 -6.774 11.531 -13.815 1.00 0.00 O ATOM 1204 OD2 ASP A 80 -8.667 10.532 -14.062 1.00 0.00 O ATOM 0 H ASP A 80 -5.884 9.629 -17.887 1.00 0.00 H new ATOM 0 HA ASP A 80 -5.858 12.019 -16.046 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -7.829 10.299 -16.514 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -6.844 9.149 -15.632 1.00 0.00 H new ATOM 1209 N TRP A 81 -4.430 10.828 -14.198 1.00 0.00 N ATOM 1210 CA TRP A 81 -3.294 10.304 -13.386 1.00 0.00 C ATOM 1211 C TRP A 81 -3.819 9.504 -12.191 1.00 0.00 C ATOM 1212 O TRP A 81 -4.995 9.518 -11.887 1.00 0.00 O ATOM 1213 CB TRP A 81 -2.527 11.536 -12.908 1.00 0.00 C ATOM 1214 CG TRP A 81 -1.758 12.116 -14.051 1.00 0.00 C ATOM 1215 CD1 TRP A 81 -2.291 12.499 -15.234 1.00 0.00 C ATOM 1216 CD2 TRP A 81 -0.329 12.385 -14.140 1.00 0.00 C ATOM 1217 NE1 TRP A 81 -1.281 12.982 -16.044 1.00 0.00 N ATOM 1218 CE2 TRP A 81 -0.054 12.935 -15.415 1.00 0.00 C ATOM 1219 CE3 TRP A 81 0.746 12.206 -13.246 1.00 0.00 C ATOM 1220 CZ2 TRP A 81 1.242 13.295 -15.790 1.00 0.00 C ATOM 1221 CZ3 TRP A 81 2.052 12.567 -13.621 1.00 0.00 C ATOM 1222 CH2 TRP A 81 2.298 13.111 -14.891 1.00 0.00 C ATOM 0 H TRP A 81 -5.047 11.482 -13.716 1.00 0.00 H new ATOM 0 HA TRP A 81 -2.658 9.634 -13.965 1.00 0.00 H new ATOM 0 HB2 TRP A 81 -3.220 12.277 -12.508 1.00 0.00 H new ATOM 0 HB3 TRP A 81 -1.849 11.265 -12.099 1.00 0.00 H new ATOM 0 HD1 TRP A 81 -3.335 12.437 -15.502 1.00 0.00 H new ATOM 0 HE1 TRP A 81 -1.425 13.331 -16.992 1.00 0.00 H new ATOM 0 HE3 TRP A 81 0.565 11.789 -12.266 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 1.428 13.713 -16.768 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 2.869 12.425 -12.929 1.00 0.00 H new ATOM 0 HH2 TRP A 81 3.303 13.388 -15.174 1.00 0.00 H new ATOM 1233 N VAL A 82 -2.955 8.792 -11.528 1.00 0.00 N ATOM 1234 CA VAL A 82 -3.385 7.965 -10.369 1.00 0.00 C ATOM 1235 C VAL A 82 -2.485 8.243 -9.166 1.00 0.00 C ATOM 1236 O VAL A 82 -1.299 8.447 -9.305 1.00 0.00 O ATOM 1237 CB VAL A 82 -3.219 6.509 -10.828 1.00 0.00 C ATOM 1238 CG1 VAL A 82 -1.900 6.353 -11.582 1.00 0.00 C ATOM 1239 CG2 VAL A 82 -3.192 5.579 -9.613 1.00 0.00 C ATOM 0 H VAL A 82 -1.959 8.747 -11.742 1.00 0.00 H new ATOM 0 HA VAL A 82 -4.409 8.183 -10.067 1.00 0.00 H new ATOM 0 HB VAL A 82 -4.056 6.251 -11.477 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.786 5.318 -11.906 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.899 7.008 -12.453 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.072 6.621 -10.926 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -3.074 4.548 -9.947 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -2.357 5.849 -8.967 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -4.126 5.677 -9.059 1.00 0.00 H new ATOM 1249 N ASN A 83 -2.993 8.022 -7.996 1.00 0.00 N ATOM 1250 CA ASN A 83 -2.114 8.015 -6.799 1.00 0.00 C ATOM 1251 C ASN A 83 -1.409 6.662 -6.702 1.00 0.00 C ATOM 1252 O ASN A 83 -2.020 5.655 -6.451 1.00 0.00 O ATOM 1253 CB ASN A 83 -3.075 8.222 -5.628 1.00 0.00 C ATOM 1254 CG ASN A 83 -2.931 9.646 -5.092 1.00 0.00 C ATOM 1255 OD1 ASN A 83 -2.335 10.491 -5.730 1.00 0.00 O ATOM 1256 ND2 ASN A 83 -3.452 9.948 -3.935 1.00 0.00 N ATOM 0 H ASN A 83 -3.981 7.845 -7.812 1.00 0.00 H new ATOM 0 HA ASN A 83 -1.336 8.778 -6.823 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -4.101 8.046 -5.951 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -2.862 7.502 -4.838 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -3.359 10.894 -3.565 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -3.952 9.238 -3.400 1.00 0.00 H new ATOM 1263 N VAL A 84 -0.143 6.610 -6.979 1.00 0.00 N ATOM 1264 CA VAL A 84 0.538 5.281 -6.982 1.00 0.00 C ATOM 1265 C VAL A 84 1.459 5.131 -5.774 1.00 0.00 C ATOM 1266 O VAL A 84 2.134 6.059 -5.357 1.00 0.00 O ATOM 1267 CB VAL A 84 1.335 5.171 -8.293 1.00 0.00 C ATOM 1268 CG1 VAL A 84 0.449 4.523 -9.355 1.00 0.00 C ATOM 1269 CG2 VAL A 84 1.792 6.549 -8.784 1.00 0.00 C ATOM 0 H VAL A 84 0.447 7.412 -7.201 1.00 0.00 H new ATOM 0 HA VAL A 84 -0.200 4.482 -6.917 1.00 0.00 H new ATOM 0 HB VAL A 84 2.223 4.565 -8.112 1.00 0.00 H new ATOM 0 HG11 VAL A 84 1.003 4.440 -10.290 1.00 0.00 H new ATOM 0 HG12 VAL A 84 0.148 3.530 -9.021 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -0.438 5.137 -9.513 1.00 0.00 H new ATOM 0 HG21 VAL A 84 2.352 6.437 -9.712 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.921 7.180 -8.960 1.00 0.00 H new ATOM 0 HG23 VAL A 84 2.428 7.011 -8.029 1.00 0.00 H new ATOM 1279 N GLU A 85 1.452 3.965 -5.191 1.00 0.00 N ATOM 1280 CA GLU A 85 2.288 3.716 -3.980 1.00 0.00 C ATOM 1281 C GLU A 85 2.983 2.355 -4.091 1.00 0.00 C ATOM 1282 O GLU A 85 2.441 1.418 -4.642 1.00 0.00 O ATOM 1283 CB GLU A 85 1.306 3.727 -2.808 1.00 0.00 C ATOM 1284 CG GLU A 85 2.066 3.479 -1.504 1.00 0.00 C ATOM 1285 CD GLU A 85 1.085 3.490 -0.330 1.00 0.00 C ATOM 1286 OE1 GLU A 85 -0.058 3.860 -0.543 1.00 0.00 O ATOM 1287 OE2 GLU A 85 1.492 3.125 0.760 1.00 0.00 O ATOM 0 H GLU A 85 0.899 3.167 -5.503 1.00 0.00 H new ATOM 0 HA GLU A 85 3.072 4.464 -3.857 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.788 4.685 -2.763 1.00 0.00 H new ATOM 0 HB3 GLU A 85 0.545 2.959 -2.950 1.00 0.00 H new ATOM 0 HG2 GLU A 85 2.584 2.521 -1.549 1.00 0.00 H new ATOM 0 HG3 GLU A 85 2.827 4.247 -1.363 1.00 0.00 H new ATOM 1294 N ARG A 86 4.209 2.264 -3.653 1.00 0.00 N ATOM 1295 CA ARG A 86 4.973 0.993 -3.827 1.00 0.00 C ATOM 1296 C ARG A 86 4.615 -0.019 -2.732 1.00 0.00 C ATOM 1297 O ARG A 86 4.653 0.281 -1.555 1.00 0.00 O ATOM 1298 CB ARG A 86 6.443 1.403 -3.718 1.00 0.00 C ATOM 1299 CG ARG A 86 6.752 1.836 -2.282 1.00 0.00 C ATOM 1300 CD ARG A 86 8.195 2.337 -2.198 1.00 0.00 C ATOM 1301 NE ARG A 86 8.424 2.606 -0.751 1.00 0.00 N ATOM 1302 CZ ARG A 86 8.650 1.618 0.074 1.00 0.00 C ATOM 1303 NH1 ARG A 86 8.675 0.387 -0.364 1.00 0.00 N ATOM 1304 NH2 ARG A 86 8.850 1.861 1.340 1.00 0.00 N ATOM 0 H ARG A 86 4.716 3.014 -3.182 1.00 0.00 H new ATOM 0 HA ARG A 86 4.746 0.509 -4.777 1.00 0.00 H new ATOM 0 HB2 ARG A 86 7.085 0.570 -4.003 1.00 0.00 H new ATOM 0 HB3 ARG A 86 6.655 2.220 -4.408 1.00 0.00 H new ATOM 0 HG2 ARG A 86 6.064 2.623 -1.972 1.00 0.00 H new ATOM 0 HG3 ARG A 86 6.606 0.999 -1.599 1.00 0.00 H new ATOM 0 HD2 ARG A 86 8.895 1.592 -2.577 1.00 0.00 H new ATOM 0 HD3 ARG A 86 8.336 3.238 -2.794 1.00 0.00 H new ATOM 0 HE ARG A 86 8.404 3.565 -0.403 1.00 0.00 H new ATOM 0 HH11 ARG A 86 8.518 0.194 -1.353 1.00 0.00 H new ATOM 0 HH12 ARG A 86 8.852 -0.381 0.283 1.00 0.00 H new ATOM 0 HH21 ARG A 86 8.830 2.821 1.684 1.00 0.00 H new ATOM 0 HH22 ARG A 86 9.027 1.091 1.985 1.00 0.00 H new ATOM 1318 N ALA A 87 4.335 -1.238 -3.113 1.00 0.00 N ATOM 1319 CA ALA A 87 4.058 -2.299 -2.101 1.00 0.00 C ATOM 1320 C ALA A 87 4.970 -3.505 -2.337 1.00 0.00 C ATOM 1321 O ALA A 87 5.340 -3.815 -3.460 1.00 0.00 O ATOM 1322 CB ALA A 87 2.599 -2.690 -2.313 1.00 0.00 C ATOM 0 H ALA A 87 4.286 -1.545 -4.085 1.00 0.00 H new ATOM 0 HA ALA A 87 4.241 -1.950 -1.085 1.00 0.00 H new ATOM 0 HB1 ALA A 87 2.324 -3.469 -1.601 1.00 0.00 H new ATOM 0 HB2 ALA A 87 1.963 -1.818 -2.161 1.00 0.00 H new ATOM 0 HB3 ALA A 87 2.466 -3.063 -3.328 1.00 0.00 H new ATOM 1328 N ALA A 88 5.368 -4.157 -1.281 1.00 0.00 N ATOM 1329 CA ALA A 88 6.304 -5.309 -1.415 1.00 0.00 C ATOM 1330 C ALA A 88 5.813 -6.499 -0.587 1.00 0.00 C ATOM 1331 O ALA A 88 5.286 -6.339 0.496 1.00 0.00 O ATOM 1332 CB ALA A 88 7.632 -4.792 -0.865 1.00 0.00 C ATOM 0 H ALA A 88 5.084 -3.941 -0.325 1.00 0.00 H new ATOM 0 HA ALA A 88 6.387 -5.656 -2.445 1.00 0.00 H new ATOM 0 HB1 ALA A 88 8.383 -5.580 -0.926 1.00 0.00 H new ATOM 0 HB2 ALA A 88 7.959 -3.933 -1.451 1.00 0.00 H new ATOM 0 HB3 ALA A 88 7.503 -4.493 0.175 1.00 0.00 H new ATOM 1338 N LYS A 89 5.990 -7.692 -1.084 1.00 0.00 N ATOM 1339 CA LYS A 89 5.543 -8.891 -0.319 1.00 0.00 C ATOM 1340 C LYS A 89 6.431 -9.094 0.912 1.00 0.00 C ATOM 1341 O LYS A 89 5.961 -9.431 1.981 1.00 0.00 O ATOM 1342 CB LYS A 89 5.695 -10.059 -1.291 1.00 0.00 C ATOM 1343 CG LYS A 89 4.818 -9.812 -2.520 1.00 0.00 C ATOM 1344 CD LYS A 89 3.379 -9.546 -2.072 1.00 0.00 C ATOM 1345 CE LYS A 89 2.459 -9.523 -3.294 1.00 0.00 C ATOM 1346 NZ LYS A 89 1.829 -10.872 -3.325 1.00 0.00 N ATOM 0 H LYS A 89 6.424 -7.889 -1.986 1.00 0.00 H new ATOM 0 HA LYS A 89 4.519 -8.794 0.042 1.00 0.00 H new ATOM 0 HB2 LYS A 89 6.738 -10.165 -1.590 1.00 0.00 H new ATOM 0 HB3 LYS A 89 5.406 -10.991 -0.805 1.00 0.00 H new ATOM 0 HG2 LYS A 89 5.197 -8.961 -3.086 1.00 0.00 H new ATOM 0 HG3 LYS A 89 4.850 -10.676 -3.183 1.00 0.00 H new ATOM 0 HD2 LYS A 89 3.055 -10.319 -1.375 1.00 0.00 H new ATOM 0 HD3 LYS A 89 3.322 -8.595 -1.543 1.00 0.00 H new ATOM 0 HE2 LYS A 89 1.708 -8.738 -3.208 1.00 0.00 H new ATOM 0 HE3 LYS A 89 3.021 -9.328 -4.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 1.182 -10.935 -4.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 2.568 -11.598 -3.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 1.296 -11.026 -2.446 1.00 0.00 H new ATOM 1360 N PHE A 90 7.711 -8.884 0.770 1.00 0.00 N ATOM 1361 CA PHE A 90 8.630 -9.056 1.930 1.00 0.00 C ATOM 1362 C PHE A 90 9.801 -8.077 1.822 1.00 0.00 C ATOM 1363 O PHE A 90 10.068 -7.529 0.771 1.00 0.00 O ATOM 1364 CB PHE A 90 9.123 -10.499 1.833 1.00 0.00 C ATOM 1365 CG PHE A 90 9.904 -10.682 0.554 1.00 0.00 C ATOM 1366 CD1 PHE A 90 9.245 -11.076 -0.619 1.00 0.00 C ATOM 1367 CD2 PHE A 90 11.288 -10.459 0.539 1.00 0.00 C ATOM 1368 CE1 PHE A 90 9.970 -11.247 -1.807 1.00 0.00 C ATOM 1369 CE2 PHE A 90 12.013 -10.630 -0.649 1.00 0.00 C ATOM 1370 CZ PHE A 90 11.354 -11.024 -1.822 1.00 0.00 C ATOM 0 H PHE A 90 8.160 -8.600 -0.101 1.00 0.00 H new ATOM 0 HA PHE A 90 8.138 -8.859 2.883 1.00 0.00 H new ATOM 0 HB2 PHE A 90 9.750 -10.738 2.692 1.00 0.00 H new ATOM 0 HB3 PHE A 90 8.277 -11.185 1.856 1.00 0.00 H new ATOM 0 HD1 PHE A 90 8.179 -11.248 -0.608 1.00 0.00 H new ATOM 0 HD2 PHE A 90 11.796 -10.155 1.443 1.00 0.00 H new ATOM 0 HE1 PHE A 90 9.462 -11.551 -2.711 1.00 0.00 H new ATOM 0 HE2 PHE A 90 13.079 -10.458 -0.660 1.00 0.00 H new ATOM 0 HZ PHE A 90 11.912 -11.156 -2.737 1.00 0.00 H new ATOM 1380 N SER A 91 10.466 -7.809 2.911 1.00 0.00 N ATOM 1381 CA SER A 91 11.577 -6.815 2.875 1.00 0.00 C ATOM 1382 C SER A 91 12.641 -7.162 3.919 1.00 0.00 C ATOM 1383 O SER A 91 12.395 -7.890 4.859 1.00 0.00 O ATOM 1384 CB SER A 91 10.921 -5.476 3.204 1.00 0.00 C ATOM 1385 OG SER A 91 11.899 -4.446 3.146 1.00 0.00 O ATOM 0 H SER A 91 10.290 -8.233 3.822 1.00 0.00 H new ATOM 0 HA SER A 91 12.080 -6.798 1.908 1.00 0.00 H new ATOM 0 HB2 SER A 91 10.116 -5.269 2.498 1.00 0.00 H new ATOM 0 HB3 SER A 91 10.473 -5.512 4.197 1.00 0.00 H new ATOM 0 HG SER A 91 11.480 -3.585 3.355 1.00 0.00 H new ATOM 1391 N ASP A 92 13.825 -6.641 3.757 1.00 0.00 N ATOM 1392 CA ASP A 92 14.913 -6.928 4.733 1.00 0.00 C ATOM 1393 C ASP A 92 14.586 -6.315 6.100 1.00 0.00 C ATOM 1394 O ASP A 92 14.931 -6.858 7.130 1.00 0.00 O ATOM 1395 CB ASP A 92 16.160 -6.277 4.134 1.00 0.00 C ATOM 1396 CG ASP A 92 16.595 -7.056 2.891 1.00 0.00 C ATOM 1397 OD1 ASP A 92 16.454 -8.268 2.897 1.00 0.00 O ATOM 1398 OD2 ASP A 92 17.056 -6.428 1.953 1.00 0.00 O ATOM 0 H ASP A 92 14.087 -6.026 2.987 1.00 0.00 H new ATOM 0 HA ASP A 92 15.047 -7.997 4.896 1.00 0.00 H new ATOM 0 HB2 ASP A 92 15.951 -5.240 3.872 1.00 0.00 H new ATOM 0 HB3 ASP A 92 16.965 -6.264 4.869 1.00 0.00 H new ATOM 1403 N GLU A 93 13.980 -5.158 6.119 1.00 0.00 N ATOM 1404 CA GLU A 93 13.709 -4.483 7.418 1.00 0.00 C ATOM 1405 C GLU A 93 12.360 -3.765 7.376 1.00 0.00 C ATOM 1406 O GLU A 93 12.287 -2.553 7.422 1.00 0.00 O ATOM 1407 CB GLU A 93 14.848 -3.477 7.586 1.00 0.00 C ATOM 1408 CG GLU A 93 16.147 -4.223 7.894 1.00 0.00 C ATOM 1409 CD GLU A 93 17.306 -3.226 7.958 1.00 0.00 C ATOM 1410 OE1 GLU A 93 17.097 -2.082 7.589 1.00 0.00 O ATOM 1411 OE2 GLU A 93 18.382 -3.624 8.372 1.00 0.00 O ATOM 0 H GLU A 93 13.662 -4.653 5.292 1.00 0.00 H new ATOM 0 HA GLU A 93 13.662 -5.190 8.246 1.00 0.00 H new ATOM 0 HB2 GLU A 93 14.962 -2.886 6.677 1.00 0.00 H new ATOM 0 HB3 GLU A 93 14.616 -2.781 8.392 1.00 0.00 H new ATOM 0 HG2 GLU A 93 16.058 -4.754 8.842 1.00 0.00 H new ATOM 0 HG3 GLU A 93 16.340 -4.972 7.126 1.00 0.00 H new ATOM 1418 N ILE A 94 11.292 -4.508 7.397 1.00 0.00 N ATOM 1419 CA ILE A 94 9.944 -3.871 7.479 1.00 0.00 C ATOM 1420 C ILE A 94 9.842 -3.044 8.762 1.00 0.00 C ATOM 1421 O ILE A 94 9.419 -1.905 8.747 1.00 0.00 O ATOM 1422 CB ILE A 94 8.952 -5.035 7.525 1.00 0.00 C ATOM 1423 CG1 ILE A 94 8.914 -5.737 6.166 1.00 0.00 C ATOM 1424 CG2 ILE A 94 7.557 -4.507 7.869 1.00 0.00 C ATOM 1425 CD1 ILE A 94 8.352 -4.783 5.109 1.00 0.00 C ATOM 0 H ILE A 94 11.290 -5.527 7.361 1.00 0.00 H new ATOM 0 HA ILE A 94 9.750 -3.204 6.639 1.00 0.00 H new ATOM 0 HB ILE A 94 9.269 -5.746 8.288 1.00 0.00 H new ATOM 0 HG12 ILE A 94 9.917 -6.058 5.884 1.00 0.00 H new ATOM 0 HG13 ILE A 94 8.297 -6.633 6.226 1.00 0.00 H new ATOM 0 HG21 ILE A 94 6.851 -5.337 7.901 1.00 0.00 H new ATOM 0 HG22 ILE A 94 7.584 -4.015 8.841 1.00 0.00 H new ATOM 0 HG23 ILE A 94 7.241 -3.792 7.109 1.00 0.00 H new ATOM 0 HD11 ILE A 94 8.326 -5.286 4.142 1.00 0.00 H new ATOM 0 HD12 ILE A 94 7.342 -4.483 5.389 1.00 0.00 H new ATOM 0 HD13 ILE A 94 8.987 -3.900 5.042 1.00 0.00 H new ATOM 1437 N GLY A 95 10.282 -3.589 9.863 1.00 0.00 N ATOM 1438 CA GLY A 95 10.271 -2.814 11.136 1.00 0.00 C ATOM 1439 C GLY A 95 8.888 -2.898 11.784 1.00 0.00 C ATOM 1440 O GLY A 95 8.762 -3.093 12.976 1.00 0.00 O ATOM 0 H GLY A 95 10.649 -4.538 9.936 1.00 0.00 H new ATOM 0 HA2 GLY A 95 11.026 -3.206 11.817 1.00 0.00 H new ATOM 0 HA3 GLY A 95 10.528 -1.773 10.940 1.00 0.00 H new ATOM 1444 N GLY A 96 7.849 -2.712 11.016 1.00 0.00 N ATOM 1445 CA GLY A 96 6.478 -2.736 11.598 1.00 0.00 C ATOM 1446 C GLY A 96 6.077 -1.318 12.008 1.00 0.00 C ATOM 1447 O GLY A 96 6.726 -0.689 12.820 1.00 0.00 O ATOM 0 H GLY A 96 7.891 -2.544 10.011 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.769 -3.131 10.871 1.00 0.00 H new ATOM 0 HA3 GLY A 96 6.449 -3.399 12.463 1.00 0.00 H new ATOM 1451 N HIS A 97 5.019 -0.805 11.443 1.00 8.42 N ATOM 1452 CA HIS A 97 4.586 0.580 11.790 1.00 9.15 C ATOM 1453 C HIS A 97 3.063 0.697 11.695 1.00 9.69 C ATOM 1454 O HIS A 97 2.387 -0.169 12.226 1.00 9.91 O ATOM 1455 CB HIS A 97 5.259 1.477 10.751 1.00 9.49 C ATOM 1456 CG HIS A 97 6.671 1.771 11.180 1.00 9.58 C ATOM 1457 ND1 HIS A 97 7.667 2.093 10.271 1.00 9.67 N ATOM 1458 CD2 HIS A 97 7.269 1.796 12.415 1.00 9.87 C ATOM 1459 CE1 HIS A 97 8.801 2.297 10.967 1.00 9.99 C ATOM 1460 NE2 HIS A 97 8.613 2.128 12.279 1.00 10.12 N ATOM 1461 OXT HIS A 97 2.598 1.651 11.093 1.00 10.09 O ATOM 0 H HIS A 97 4.435 -1.283 10.757 1.00 8.42 H new ATOM 0 HA HIS A 97 4.862 0.857 12.807 1.00 9.15 H new ATOM 0 HB2 HIS A 97 5.258 0.987 9.777 1.00 9.49 H new ATOM 0 HB3 HIS A 97 4.700 2.406 10.641 1.00 9.49 H new ATOM 0 HD2 HIS A 97 6.771 1.589 13.351 1.00 9.87 H new ATOM 0 HE1 HIS A 97 9.747 2.565 10.520 1.00 9.99 H new ATOM 0 HE2 HIS A 97 9.306 2.222 13.021 1.00 10.12 H new TER 1469 HIS A 97 ATOM 1470 N MET B 1 3.095 -6.125 5.200 1.00 0.00 N ATOM 1471 CA MET B 1 1.665 -6.446 4.922 1.00 0.00 C ATOM 1472 C MET B 1 0.980 -5.261 4.235 1.00 0.00 C ATOM 1473 O MET B 1 1.018 -4.149 4.722 1.00 0.00 O ATOM 1474 CB MET B 1 1.040 -6.697 6.295 1.00 0.00 C ATOM 1475 CG MET B 1 1.577 -8.006 6.876 1.00 0.00 C ATOM 1476 SD MET B 1 0.830 -8.293 8.501 1.00 0.00 S ATOM 1477 CE MET B 1 1.654 -9.863 8.861 1.00 0.00 C ATOM 0 H1 MET B 1 3.634 -7.008 5.309 1.00 0.00 H new ATOM 0 H2 MET B 1 3.487 -5.575 4.409 1.00 0.00 H new ATOM 0 H3 MET B 1 3.162 -5.568 6.076 1.00 0.00 H new ATOM 0 HA MET B 1 1.558 -7.305 4.260 1.00 0.00 H new ATOM 0 HB2 MET B 1 1.269 -5.869 6.966 1.00 0.00 H new ATOM 0 HB3 MET B 1 -0.045 -6.745 6.208 1.00 0.00 H new ATOM 0 HG2 MET B 1 1.348 -8.835 6.206 1.00 0.00 H new ATOM 0 HG3 MET B 1 2.662 -7.959 6.965 1.00 0.00 H new ATOM 0 HE1 MET B 1 1.332 -10.228 9.836 1.00 0.00 H new ATOM 0 HE2 MET B 1 1.393 -10.594 8.096 1.00 0.00 H new ATOM 0 HE3 MET B 1 2.734 -9.714 8.868 1.00 0.00 H new ATOM 1489 N PHE B 2 0.218 -5.518 3.206 1.00 0.00 N ATOM 1490 CA PHE B 2 -0.616 -4.443 2.619 1.00 0.00 C ATOM 1491 C PHE B 2 -1.625 -5.063 1.662 1.00 0.00 C ATOM 1492 O PHE B 2 -1.324 -6.001 0.950 1.00 0.00 O ATOM 1493 CB PHE B 2 0.350 -3.512 1.877 1.00 0.00 C ATOM 1494 CG PHE B 2 0.862 -4.167 0.609 1.00 0.00 C ATOM 1495 CD1 PHE B 2 0.004 -4.343 -0.488 1.00 0.00 C ATOM 1496 CD2 PHE B 2 2.198 -4.590 0.525 1.00 0.00 C ATOM 1497 CE1 PHE B 2 0.478 -4.944 -1.662 1.00 0.00 C ATOM 1498 CE2 PHE B 2 2.671 -5.190 -0.651 1.00 0.00 C ATOM 1499 CZ PHE B 2 1.811 -5.368 -1.743 1.00 0.00 C ATOM 0 H PHE B 2 0.140 -6.427 2.750 1.00 0.00 H new ATOM 0 HA PHE B 2 -1.175 -3.889 3.374 1.00 0.00 H new ATOM 0 HB2 PHE B 2 -0.155 -2.578 1.631 1.00 0.00 H new ATOM 0 HB3 PHE B 2 1.189 -3.259 2.525 1.00 0.00 H new ATOM 0 HD1 PHE B 2 -1.023 -4.015 -0.427 1.00 0.00 H new ATOM 0 HD2 PHE B 2 2.862 -4.453 1.366 1.00 0.00 H new ATOM 0 HE1 PHE B 2 -0.184 -5.080 -2.504 1.00 0.00 H new ATOM 0 HE2 PHE B 2 3.699 -5.515 -0.715 1.00 0.00 H new ATOM 0 HZ PHE B 2 2.176 -5.832 -2.647 1.00 0.00 H new ATOM 1509 N THR B 3 -2.831 -4.587 1.668 1.00 0.00 N ATOM 1510 CA THR B 3 -3.861 -5.189 0.792 1.00 0.00 C ATOM 1511 C THR B 3 -4.628 -4.083 0.081 1.00 0.00 C ATOM 1512 O THR B 3 -5.032 -4.220 -1.056 1.00 0.00 O ATOM 1513 CB THR B 3 -4.775 -5.955 1.745 1.00 0.00 C ATOM 1514 OG1 THR B 3 -5.286 -5.062 2.725 1.00 0.00 O ATOM 1515 CG2 THR B 3 -3.978 -7.064 2.432 1.00 0.00 C ATOM 0 H THR B 3 -3.148 -3.806 2.242 1.00 0.00 H new ATOM 0 HA THR B 3 -3.443 -5.838 0.022 1.00 0.00 H new ATOM 0 HB THR B 3 -5.601 -6.395 1.186 1.00 0.00 H new ATOM 0 HG1 THR B 3 -5.875 -5.551 3.337 1.00 0.00 H new ATOM 0 HG21 THR B 3 -4.629 -7.612 3.113 1.00 0.00 H new ATOM 0 HG22 THR B 3 -3.582 -7.747 1.680 1.00 0.00 H new ATOM 0 HG23 THR B 3 -3.153 -6.625 2.993 1.00 0.00 H new ATOM 1523 N GLY B 4 -4.882 -3.007 0.770 1.00 0.00 N ATOM 1524 CA GLY B 4 -5.682 -1.917 0.163 1.00 0.00 C ATOM 1525 C GLY B 4 -6.990 -2.497 -0.368 1.00 0.00 C ATOM 1526 O GLY B 4 -7.617 -1.934 -1.243 1.00 0.00 O ATOM 0 H GLY B 4 -4.569 -2.838 1.726 1.00 0.00 H new ATOM 0 HA2 GLY B 4 -5.886 -1.143 0.903 1.00 0.00 H new ATOM 0 HA3 GLY B 4 -5.124 -1.446 -0.646 1.00 0.00 H new ATOM 1530 N ILE B 5 -7.377 -3.655 0.103 1.00 0.00 N ATOM 1531 CA ILE B 5 -8.609 -4.293 -0.447 1.00 0.00 C ATOM 1532 C ILE B 5 -9.851 -3.642 0.174 1.00 0.00 C ATOM 1533 O ILE B 5 -9.897 -3.386 1.361 1.00 0.00 O ATOM 1534 CB ILE B 5 -8.497 -5.768 -0.054 1.00 0.00 C ATOM 1535 CG1 ILE B 5 -7.209 -6.350 -0.638 1.00 0.00 C ATOM 1536 CG2 ILE B 5 -9.686 -6.546 -0.618 1.00 0.00 C ATOM 1537 CD1 ILE B 5 -6.987 -7.759 -0.086 1.00 0.00 C ATOM 0 H ILE B 5 -6.900 -4.180 0.835 1.00 0.00 H new ATOM 0 HA ILE B 5 -8.702 -4.176 -1.527 1.00 0.00 H new ATOM 0 HB ILE B 5 -8.488 -5.848 1.033 1.00 0.00 H new ATOM 0 HG12 ILE B 5 -7.272 -6.380 -1.726 1.00 0.00 H new ATOM 0 HG13 ILE B 5 -6.362 -5.712 -0.385 1.00 0.00 H new ATOM 0 HG21 ILE B 5 -9.601 -7.595 -0.335 1.00 0.00 H new ATOM 0 HG22 ILE B 5 -10.613 -6.136 -0.217 1.00 0.00 H new ATOM 0 HG23 ILE B 5 -9.693 -6.462 -1.705 1.00 0.00 H new ATOM 0 HD11 ILE B 5 -6.069 -8.173 -0.503 1.00 0.00 H new ATOM 0 HD12 ILE B 5 -6.905 -7.716 1.000 1.00 0.00 H new ATOM 0 HD13 ILE B 5 -7.829 -8.394 -0.361 1.00 0.00 H new ATOM 1549 N VAL B 6 -10.779 -3.216 -0.645 1.00 0.00 N ATOM 1550 CA VAL B 6 -11.918 -2.401 -0.123 1.00 0.00 C ATOM 1551 C VAL B 6 -13.115 -3.295 0.219 1.00 0.00 C ATOM 1552 O VAL B 6 -13.493 -4.170 -0.534 1.00 0.00 O ATOM 1553 CB VAL B 6 -12.251 -1.420 -1.260 1.00 0.00 C ATOM 1554 CG1 VAL B 6 -13.732 -1.027 -1.229 1.00 0.00 C ATOM 1555 CG2 VAL B 6 -11.412 -0.158 -1.084 1.00 0.00 C ATOM 0 H VAL B 6 -10.798 -3.396 -1.649 1.00 0.00 H new ATOM 0 HA VAL B 6 -11.667 -1.878 0.800 1.00 0.00 H new ATOM 0 HB VAL B 6 -12.034 -1.905 -2.212 1.00 0.00 H new ATOM 0 HG11 VAL B 6 -13.941 -0.333 -2.043 1.00 0.00 H new ATOM 0 HG12 VAL B 6 -14.348 -1.919 -1.345 1.00 0.00 H new ATOM 0 HG13 VAL B 6 -13.962 -0.549 -0.277 1.00 0.00 H new ATOM 0 HG21 VAL B 6 -11.640 0.545 -1.885 1.00 0.00 H new ATOM 0 HG22 VAL B 6 -11.642 0.301 -0.122 1.00 0.00 H new ATOM 0 HG23 VAL B 6 -10.354 -0.417 -1.119 1.00 0.00 H new ATOM 1565 N GLN B 7 -13.733 -3.042 1.338 1.00 0.00 N ATOM 1566 CA GLN B 7 -14.933 -3.829 1.731 1.00 0.00 C ATOM 1567 C GLN B 7 -16.148 -3.469 0.866 1.00 0.00 C ATOM 1568 O GLN B 7 -17.066 -4.253 0.740 1.00 0.00 O ATOM 1569 CB GLN B 7 -15.185 -3.460 3.193 1.00 0.00 C ATOM 1570 CG GLN B 7 -14.078 -4.058 4.064 1.00 0.00 C ATOM 1571 CD GLN B 7 -14.202 -3.524 5.492 1.00 0.00 C ATOM 1572 OE1 GLN B 7 -14.820 -2.504 5.720 1.00 0.00 O ATOM 1573 NE2 GLN B 7 -13.636 -4.178 6.469 1.00 0.00 N ATOM 0 H GLN B 7 -13.456 -2.319 2.002 1.00 0.00 H new ATOM 0 HA GLN B 7 -14.773 -4.899 1.594 1.00 0.00 H new ATOM 0 HB2 GLN B 7 -15.208 -2.376 3.308 1.00 0.00 H new ATOM 0 HB3 GLN B 7 -16.157 -3.835 3.512 1.00 0.00 H new ATOM 0 HG2 GLN B 7 -14.150 -5.146 4.064 1.00 0.00 H new ATOM 0 HG3 GLN B 7 -13.101 -3.803 3.653 1.00 0.00 H new ATOM 0 HE21 GLN B 7 -13.117 -5.035 6.276 1.00 0.00 H new ATOM 0 HE22 GLN B 7 -13.712 -3.833 7.426 1.00 0.00 H new ATOM 1582 N GLY B 8 -16.246 -2.250 0.390 1.00 0.00 N ATOM 1583 CA GLY B 8 -17.511 -1.853 -0.300 1.00 0.00 C ATOM 1584 C GLY B 8 -17.256 -0.699 -1.268 1.00 0.00 C ATOM 1585 O GLY B 8 -16.155 -0.210 -1.395 1.00 0.00 O ATOM 0 H GLY B 8 -15.525 -1.531 0.447 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -17.919 -2.706 -0.842 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -18.257 -1.558 0.438 1.00 0.00 H new ATOM 1589 N THR B 9 -18.273 -0.264 -1.963 1.00 0.00 N ATOM 1590 CA THR B 9 -18.088 0.850 -2.934 1.00 0.00 C ATOM 1591 C THR B 9 -19.111 1.962 -2.682 1.00 0.00 C ATOM 1592 O THR B 9 -20.015 1.825 -1.881 1.00 0.00 O ATOM 1593 CB THR B 9 -18.304 0.220 -4.311 1.00 0.00 C ATOM 1594 OG1 THR B 9 -19.514 -0.524 -4.306 1.00 0.00 O ATOM 1595 CG2 THR B 9 -17.131 -0.704 -4.642 1.00 0.00 C ATOM 0 H THR B 9 -19.222 -0.632 -1.900 1.00 0.00 H new ATOM 0 HA THR B 9 -17.103 1.308 -2.846 1.00 0.00 H new ATOM 0 HB THR B 9 -18.366 1.005 -5.065 1.00 0.00 H new ATOM 0 HG1 THR B 9 -19.654 -0.927 -5.188 1.00 0.00 H new ATOM 0 HG21 THR B 9 -17.286 -1.152 -5.623 1.00 0.00 H new ATOM 0 HG22 THR B 9 -16.205 -0.129 -4.648 1.00 0.00 H new ATOM 0 HG23 THR B 9 -17.064 -1.491 -3.890 1.00 0.00 H new ATOM 1603 N ALA B 10 -18.934 3.081 -3.326 1.00 0.00 N ATOM 1604 CA ALA B 10 -19.845 4.242 -3.100 1.00 0.00 C ATOM 1605 C ALA B 10 -20.188 4.887 -4.437 1.00 0.00 C ATOM 1606 O ALA B 10 -19.394 4.896 -5.351 1.00 0.00 O ATOM 1607 CB ALA B 10 -19.042 5.213 -2.231 1.00 0.00 C ATOM 0 H ALA B 10 -18.191 3.244 -4.006 1.00 0.00 H new ATOM 0 HA ALA B 10 -20.782 3.953 -2.625 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -19.645 6.096 -2.020 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -18.772 4.725 -1.294 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -18.136 5.510 -2.759 1.00 0.00 H new ATOM 1613 N LYS B 11 -21.349 5.453 -4.555 1.00 0.00 N ATOM 1614 CA LYS B 11 -21.706 6.123 -5.833 1.00 0.00 C ATOM 1615 C LYS B 11 -21.602 7.636 -5.677 1.00 0.00 C ATOM 1616 O LYS B 11 -22.424 8.254 -5.032 1.00 0.00 O ATOM 1617 CB LYS B 11 -23.150 5.728 -6.111 1.00 0.00 C ATOM 1618 CG LYS B 11 -23.599 6.375 -7.422 1.00 0.00 C ATOM 1619 CD LYS B 11 -24.996 5.879 -7.791 1.00 0.00 C ATOM 1620 CE LYS B 11 -25.822 7.049 -8.332 1.00 0.00 C ATOM 1621 NZ LYS B 11 -27.200 6.508 -8.494 1.00 0.00 N ATOM 0 H LYS B 11 -22.064 5.483 -3.829 1.00 0.00 H new ATOM 0 HA LYS B 11 -21.040 5.829 -6.644 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -23.238 4.644 -6.177 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -23.793 6.051 -5.292 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -23.603 7.460 -7.320 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -22.895 6.133 -8.218 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -24.928 5.090 -8.540 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -25.484 5.448 -6.917 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -25.808 7.893 -7.643 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -25.424 7.406 -9.282 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -27.825 7.254 -8.862 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -27.184 5.710 -9.161 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -27.555 6.182 -7.573 1.00 0.00 H new ATOM 1635 N LEU B 12 -20.709 8.254 -6.388 1.00 0.00 N ATOM 1636 CA LEU B 12 -20.701 9.737 -6.402 1.00 0.00 C ATOM 1637 C LEU B 12 -22.040 10.224 -6.936 1.00 0.00 C ATOM 1638 O LEU B 12 -22.512 9.776 -7.961 1.00 0.00 O ATOM 1639 CB LEU B 12 -19.577 10.121 -7.359 1.00 0.00 C ATOM 1640 CG LEU B 12 -19.119 11.553 -7.085 1.00 0.00 C ATOM 1641 CD1 LEU B 12 -18.796 11.710 -5.598 1.00 0.00 C ATOM 1642 CD2 LEU B 12 -17.863 11.846 -7.908 1.00 0.00 C ATOM 0 H LEU B 12 -19.991 7.803 -6.955 1.00 0.00 H new ATOM 0 HA LEU B 12 -20.550 10.173 -5.415 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -18.739 9.434 -7.242 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -19.920 10.032 -8.390 1.00 0.00 H new ATOM 0 HG LEU B 12 -19.912 12.249 -7.361 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -18.469 12.731 -5.402 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -19.687 11.495 -5.008 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -18.002 11.016 -5.323 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -17.532 12.867 -7.716 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -17.073 11.150 -7.627 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -18.088 11.731 -8.968 1.00 0.00 H new ATOM 1654 N VAL B 13 -22.685 11.082 -6.217 1.00 0.00 N ATOM 1655 CA VAL B 13 -24.032 11.534 -6.647 1.00 0.00 C ATOM 1656 C VAL B 13 -24.100 13.054 -6.645 1.00 0.00 C ATOM 1657 O VAL B 13 -24.806 13.657 -7.429 1.00 0.00 O ATOM 1658 CB VAL B 13 -25.006 10.935 -5.630 1.00 0.00 C ATOM 1659 CG1 VAL B 13 -24.475 11.091 -4.201 1.00 0.00 C ATOM 1660 CG2 VAL B 13 -26.356 11.643 -5.745 1.00 0.00 C ATOM 0 H VAL B 13 -22.342 11.493 -5.349 1.00 0.00 H new ATOM 0 HA VAL B 13 -24.272 11.213 -7.661 1.00 0.00 H new ATOM 0 HB VAL B 13 -25.117 9.872 -5.844 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -25.187 10.657 -3.499 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -23.517 10.578 -4.111 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -24.343 12.149 -3.976 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -27.052 11.219 -5.022 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -26.227 12.707 -5.544 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -26.752 11.509 -6.752 1.00 0.00 H new ATOM 1670 N SER B 14 -23.387 13.679 -5.761 1.00 0.00 N ATOM 1671 CA SER B 14 -23.433 15.169 -5.707 1.00 0.00 C ATOM 1672 C SER B 14 -22.071 15.749 -5.320 1.00 0.00 C ATOM 1673 O SER B 14 -21.421 15.275 -4.411 1.00 0.00 O ATOM 1674 CB SER B 14 -24.468 15.481 -4.632 1.00 0.00 C ATOM 1675 OG SER B 14 -25.307 16.537 -5.079 1.00 0.00 O ATOM 0 H SER B 14 -22.777 13.233 -5.076 1.00 0.00 H new ATOM 0 HA SER B 14 -23.687 15.604 -6.674 1.00 0.00 H new ATOM 0 HB2 SER B 14 -25.064 14.594 -4.417 1.00 0.00 H new ATOM 0 HB3 SER B 14 -23.971 15.764 -3.704 1.00 0.00 H new ATOM 0 HG SER B 14 -25.974 16.738 -4.390 1.00 0.00 H new ATOM 1681 N ILE B 15 -21.696 16.850 -5.916 1.00 0.00 N ATOM 1682 CA ILE B 15 -20.447 17.540 -5.474 1.00 0.00 C ATOM 1683 C ILE B 15 -20.788 18.838 -4.749 1.00 0.00 C ATOM 1684 O ILE B 15 -21.523 19.668 -5.248 1.00 0.00 O ATOM 1685 CB ILE B 15 -19.659 17.854 -6.741 1.00 0.00 C ATOM 1686 CG1 ILE B 15 -19.633 16.617 -7.627 1.00 0.00 C ATOM 1687 CG2 ILE B 15 -18.231 18.252 -6.357 1.00 0.00 C ATOM 1688 CD1 ILE B 15 -18.707 16.848 -8.826 1.00 0.00 C ATOM 0 H ILE B 15 -22.195 17.299 -6.684 1.00 0.00 H new ATOM 0 HA ILE B 15 -19.876 16.914 -4.788 1.00 0.00 H new ATOM 0 HB ILE B 15 -20.128 18.676 -7.282 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -19.290 15.756 -7.053 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -20.640 16.388 -7.974 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -17.661 18.478 -7.258 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -18.259 19.132 -5.715 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -17.755 17.429 -5.824 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -18.695 15.957 -9.454 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -19.069 17.696 -9.407 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -17.697 17.055 -8.471 1.00 0.00 H new ATOM 1700 N ASP B 16 -20.150 19.075 -3.643 1.00 0.00 N ATOM 1701 CA ASP B 16 -20.313 20.385 -2.959 1.00 0.00 C ATOM 1702 C ASP B 16 -19.025 21.196 -3.081 1.00 0.00 C ATOM 1703 O ASP B 16 -17.978 20.783 -2.629 1.00 0.00 O ATOM 1704 CB ASP B 16 -20.601 20.036 -1.500 1.00 0.00 C ATOM 1705 CG ASP B 16 -22.073 19.649 -1.348 1.00 0.00 C ATOM 1706 OD1 ASP B 16 -22.834 19.918 -2.262 1.00 0.00 O ATOM 1707 OD2 ASP B 16 -22.414 19.089 -0.318 1.00 0.00 O ATOM 0 H ASP B 16 -19.521 18.418 -3.181 1.00 0.00 H new ATOM 0 HA ASP B 16 -21.111 20.988 -3.392 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -19.963 19.213 -1.179 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -20.370 20.887 -0.859 1.00 0.00 H new ATOM 1712 N GLU B 17 -19.072 22.306 -3.763 1.00 0.00 N ATOM 1713 CA GLU B 17 -17.821 23.083 -3.996 1.00 0.00 C ATOM 1714 C GLU B 17 -17.779 24.318 -3.093 1.00 0.00 C ATOM 1715 O GLU B 17 -18.509 25.268 -3.291 1.00 0.00 O ATOM 1716 CB GLU B 17 -17.883 23.501 -5.465 1.00 0.00 C ATOM 1717 CG GLU B 17 -16.636 24.313 -5.819 1.00 0.00 C ATOM 1718 CD GLU B 17 -16.698 24.731 -7.289 1.00 0.00 C ATOM 1719 OE1 GLU B 17 -17.565 24.235 -7.989 1.00 0.00 O ATOM 1720 OE2 GLU B 17 -15.880 25.543 -7.688 1.00 0.00 O ATOM 0 H GLU B 17 -19.918 22.708 -4.168 1.00 0.00 H new ATOM 0 HA GLU B 17 -16.929 22.498 -3.771 1.00 0.00 H new ATOM 0 HB2 GLU B 17 -17.948 22.619 -6.102 1.00 0.00 H new ATOM 0 HB3 GLU B 17 -18.779 24.094 -5.648 1.00 0.00 H new ATOM 0 HG2 GLU B 17 -16.571 25.195 -5.182 1.00 0.00 H new ATOM 0 HG3 GLU B 17 -15.740 23.721 -5.636 1.00 0.00 H new ATOM 1727 N LYS B 18 -16.856 24.354 -2.172 1.00 0.00 N ATOM 1728 CA LYS B 18 -16.680 25.579 -1.338 1.00 0.00 C ATOM 1729 C LYS B 18 -15.322 26.206 -1.652 1.00 0.00 C ATOM 1730 O LYS B 18 -14.308 25.544 -1.575 1.00 0.00 O ATOM 1731 CB LYS B 18 -16.719 25.104 0.123 1.00 0.00 C ATOM 1732 CG LYS B 18 -17.719 23.954 0.285 1.00 0.00 C ATOM 1733 CD LYS B 18 -18.573 24.189 1.532 1.00 0.00 C ATOM 1734 CE LYS B 18 -17.687 24.119 2.778 1.00 0.00 C ATOM 1735 NZ LYS B 18 -18.557 23.533 3.835 1.00 0.00 N ATOM 0 H LYS B 18 -16.216 23.589 -1.960 1.00 0.00 H new ATOM 0 HA LYS B 18 -17.452 26.324 -1.531 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -15.726 24.777 0.432 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -16.999 25.932 0.774 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -18.356 23.886 -0.597 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -17.188 23.006 0.369 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -19.061 25.162 1.474 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -19.363 23.440 1.592 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -16.807 23.500 2.603 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -17.329 25.108 3.064 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -18.020 23.453 4.722 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -19.383 24.147 3.985 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -18.877 22.589 3.538 1.00 0.00 H new ATOM 1749 N PRO B 19 -15.341 27.463 -1.998 1.00 0.00 N ATOM 1750 CA PRO B 19 -14.084 28.173 -2.331 1.00 0.00 C ATOM 1751 C PRO B 19 -13.055 27.972 -1.216 1.00 0.00 C ATOM 1752 O PRO B 19 -11.863 27.999 -1.447 1.00 0.00 O ATOM 1753 CB PRO B 19 -14.503 29.642 -2.453 1.00 0.00 C ATOM 1754 CG PRO B 19 -15.908 29.709 -1.931 1.00 0.00 C ATOM 1755 CD PRO B 19 -16.504 28.339 -2.099 1.00 0.00 C ATOM 0 HA PRO B 19 -13.614 27.809 -3.245 1.00 0.00 H new ATOM 0 HB2 PRO B 19 -13.840 30.287 -1.876 1.00 0.00 H new ATOM 0 HB3 PRO B 19 -14.454 29.978 -3.489 1.00 0.00 H new ATOM 0 HG2 PRO B 19 -15.916 30.007 -0.883 1.00 0.00 H new ATOM 0 HG3 PRO B 19 -16.488 30.452 -2.479 1.00 0.00 H new ATOM 0 HD2 PRO B 19 -17.242 28.122 -1.326 1.00 0.00 H new ATOM 0 HD3 PRO B 19 -17.008 28.233 -3.060 1.00 0.00 H new ATOM 1763 N ASN B 20 -13.509 27.667 -0.032 1.00 0.00 N ATOM 1764 CA ASN B 20 -12.558 27.345 1.071 1.00 0.00 C ATOM 1765 C ASN B 20 -12.067 25.901 0.930 1.00 0.00 C ATOM 1766 O ASN B 20 -10.907 25.603 1.133 1.00 0.00 O ATOM 1767 CB ASN B 20 -13.371 27.503 2.357 1.00 0.00 C ATOM 1768 CG ASN B 20 -14.212 28.778 2.281 1.00 0.00 C ATOM 1769 OD1 ASN B 20 -13.687 29.872 2.336 1.00 0.00 O ATOM 1770 ND2 ASN B 20 -15.506 28.680 2.148 1.00 0.00 N ATOM 0 H ASN B 20 -14.496 27.627 0.220 1.00 0.00 H new ATOM 0 HA ASN B 20 -11.680 27.990 1.062 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -14.018 26.637 2.499 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -12.704 27.547 3.218 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -16.078 29.523 2.090 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -15.946 27.761 2.102 1.00 0.00 H new ATOM 1777 N PHE B 21 -12.957 24.999 0.612 1.00 0.00 N ATOM 1778 CA PHE B 21 -12.565 23.565 0.488 1.00 0.00 C ATOM 1779 C PHE B 21 -13.552 22.829 -0.423 1.00 0.00 C ATOM 1780 O PHE B 21 -14.716 23.171 -0.496 1.00 0.00 O ATOM 1781 CB PHE B 21 -12.629 23.011 1.912 1.00 0.00 C ATOM 1782 CG PHE B 21 -11.722 23.824 2.804 1.00 0.00 C ATOM 1783 CD1 PHE B 21 -10.352 23.533 2.863 1.00 0.00 C ATOM 1784 CD2 PHE B 21 -12.250 24.873 3.570 1.00 0.00 C ATOM 1785 CE1 PHE B 21 -9.509 24.290 3.688 1.00 0.00 C ATOM 1786 CE2 PHE B 21 -11.407 25.630 4.396 1.00 0.00 C ATOM 1787 CZ PHE B 21 -10.037 25.339 4.455 1.00 0.00 C ATOM 0 H PHE B 21 -13.942 25.194 0.432 1.00 0.00 H new ATOM 0 HA PHE B 21 -11.574 23.441 0.050 1.00 0.00 H new ATOM 0 HB2 PHE B 21 -13.653 23.049 2.284 1.00 0.00 H new ATOM 0 HB3 PHE B 21 -12.325 21.964 1.922 1.00 0.00 H new ATOM 0 HD1 PHE B 21 -9.946 22.725 2.272 1.00 0.00 H new ATOM 0 HD2 PHE B 21 -13.305 25.098 3.524 1.00 0.00 H new ATOM 0 HE1 PHE B 21 -8.453 24.066 3.733 1.00 0.00 H new ATOM 0 HE2 PHE B 21 -11.813 26.438 4.987 1.00 0.00 H new ATOM 0 HZ PHE B 21 -9.388 25.923 5.091 1.00 0.00 H new ATOM 1797 N ARG B 22 -13.109 21.815 -1.110 1.00 0.00 N ATOM 1798 CA ARG B 22 -14.044 21.065 -1.992 1.00 0.00 C ATOM 1799 C ARG B 22 -14.676 19.904 -1.229 1.00 0.00 C ATOM 1800 O ARG B 22 -14.074 19.314 -0.355 1.00 0.00 O ATOM 1801 CB ARG B 22 -13.199 20.551 -3.155 1.00 0.00 C ATOM 1802 CG ARG B 22 -14.106 19.868 -4.181 1.00 0.00 C ATOM 1803 CD ARG B 22 -13.269 19.394 -5.371 1.00 0.00 C ATOM 1804 NE ARG B 22 -14.246 18.753 -6.295 1.00 0.00 N ATOM 1805 CZ ARG B 22 -13.977 18.643 -7.569 1.00 0.00 C ATOM 1806 NH1 ARG B 22 -12.838 19.073 -8.042 1.00 0.00 N ATOM 1807 NH2 ARG B 22 -14.848 18.095 -8.372 1.00 0.00 N ATOM 0 H ARG B 22 -12.147 21.475 -1.100 1.00 0.00 H new ATOM 0 HA ARG B 22 -14.860 21.696 -2.344 1.00 0.00 H new ATOM 0 HB2 ARG B 22 -12.662 21.377 -3.621 1.00 0.00 H new ATOM 0 HB3 ARG B 22 -12.449 19.848 -2.791 1.00 0.00 H new ATOM 0 HG2 ARG B 22 -14.617 19.021 -3.723 1.00 0.00 H new ATOM 0 HG3 ARG B 22 -14.877 20.561 -4.519 1.00 0.00 H new ATOM 0 HD2 ARG B 22 -12.759 20.228 -5.852 1.00 0.00 H new ATOM 0 HD3 ARG B 22 -12.500 18.688 -5.057 1.00 0.00 H new ATOM 0 HE ARG B 22 -15.130 18.398 -5.931 1.00 0.00 H new ATOM 0 HH11 ARG B 22 -12.153 19.497 -7.416 1.00 0.00 H new ATOM 0 HH12 ARG B 22 -12.633 18.985 -9.037 1.00 0.00 H new ATOM 0 HH21 ARG B 22 -15.736 17.754 -8.005 1.00 0.00 H new ATOM 0 HH22 ARG B 22 -14.640 18.008 -9.367 1.00 0.00 H new ATOM 1821 N THR B 23 -15.910 19.617 -1.519 1.00 0.00 N ATOM 1822 CA THR B 23 -16.631 18.544 -0.783 1.00 0.00 C ATOM 1823 C THR B 23 -17.285 17.587 -1.777 1.00 0.00 C ATOM 1824 O THR B 23 -17.862 18.006 -2.758 1.00 0.00 O ATOM 1825 CB THR B 23 -17.705 19.281 0.019 1.00 0.00 C ATOM 1826 OG1 THR B 23 -17.082 20.177 0.929 1.00 0.00 O ATOM 1827 CG2 THR B 23 -18.554 18.269 0.791 1.00 0.00 C ATOM 0 H THR B 23 -16.457 20.084 -2.242 1.00 0.00 H new ATOM 0 HA THR B 23 -15.970 17.954 -0.147 1.00 0.00 H new ATOM 0 HB THR B 23 -18.346 19.842 -0.661 1.00 0.00 H new ATOM 0 HG1 THR B 23 -17.769 20.651 1.443 1.00 0.00 H new ATOM 0 HG21 THR B 23 -19.319 18.796 1.362 1.00 0.00 H new ATOM 0 HG22 THR B 23 -19.032 17.585 0.090 1.00 0.00 H new ATOM 0 HG23 THR B 23 -17.917 17.704 1.472 1.00 0.00 H new ATOM 1835 N HIS B 24 -17.222 16.310 -1.532 1.00 0.00 N ATOM 1836 CA HIS B 24 -17.874 15.358 -2.473 1.00 0.00 C ATOM 1837 C HIS B 24 -18.789 14.387 -1.729 1.00 0.00 C ATOM 1838 O HIS B 24 -18.495 13.955 -0.637 1.00 0.00 O ATOM 1839 CB HIS B 24 -16.727 14.618 -3.143 1.00 0.00 C ATOM 1840 CG HIS B 24 -16.596 15.132 -4.548 1.00 0.00 C ATOM 1841 ND1 HIS B 24 -15.386 15.545 -5.082 1.00 0.00 N ATOM 1842 CD2 HIS B 24 -17.530 15.340 -5.530 1.00 0.00 C ATOM 1843 CE1 HIS B 24 -15.626 15.980 -6.333 1.00 0.00 C ATOM 1844 NE2 HIS B 24 -16.916 15.875 -6.656 1.00 0.00 N ATOM 0 H HIS B 24 -16.753 15.887 -0.731 1.00 0.00 H new ATOM 0 HA HIS B 24 -18.506 15.873 -3.196 1.00 0.00 H new ATOM 0 HB2 HIS B 24 -15.800 14.775 -2.592 1.00 0.00 H new ATOM 0 HB3 HIS B 24 -16.917 13.545 -3.147 1.00 0.00 H new ATOM 0 HD1 HIS B 24 -14.480 15.523 -4.613 1.00 0.00 H new ATOM 0 HD2 HIS B 24 -18.584 15.121 -5.442 1.00 0.00 H new ATOM 0 HE1 HIS B 24 -14.866 16.367 -6.995 1.00 0.00 H new ATOM 1852 N VAL B 25 -19.927 14.087 -2.291 1.00 0.00 N ATOM 1853 CA VAL B 25 -20.892 13.201 -1.582 1.00 0.00 C ATOM 1854 C VAL B 25 -21.170 11.948 -2.402 1.00 0.00 C ATOM 1855 O VAL B 25 -21.371 12.000 -3.601 1.00 0.00 O ATOM 1856 CB VAL B 25 -22.161 14.028 -1.437 1.00 0.00 C ATOM 1857 CG1 VAL B 25 -23.114 13.339 -0.459 1.00 0.00 C ATOM 1858 CG2 VAL B 25 -21.808 15.423 -0.917 1.00 0.00 C ATOM 0 H VAL B 25 -20.230 14.416 -3.208 1.00 0.00 H new ATOM 0 HA VAL B 25 -20.505 12.870 -0.618 1.00 0.00 H new ATOM 0 HB VAL B 25 -22.646 14.118 -2.409 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -24.022 13.933 -0.357 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -23.369 12.349 -0.836 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -22.631 13.244 0.514 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -22.718 16.014 -0.814 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -21.319 15.337 0.054 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -21.135 15.914 -1.620 1.00 0.00 H new ATOM 1868 N VAL B 26 -21.147 10.820 -1.758 1.00 0.00 N ATOM 1869 CA VAL B 26 -21.361 9.537 -2.476 1.00 0.00 C ATOM 1870 C VAL B 26 -22.594 8.823 -1.918 1.00 0.00 C ATOM 1871 O VAL B 26 -23.138 9.210 -0.906 1.00 0.00 O ATOM 1872 CB VAL B 26 -20.100 8.721 -2.187 1.00 0.00 C ATOM 1873 CG1 VAL B 26 -18.857 9.546 -2.536 1.00 0.00 C ATOM 1874 CG2 VAL B 26 -20.062 8.352 -0.699 1.00 0.00 C ATOM 0 H VAL B 26 -20.988 10.730 -0.755 1.00 0.00 H new ATOM 0 HA VAL B 26 -21.529 9.678 -3.544 1.00 0.00 H new ATOM 0 HB VAL B 26 -20.113 7.814 -2.791 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -17.961 8.960 -2.328 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -18.881 9.810 -3.593 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -18.843 10.455 -1.935 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -19.164 7.770 -0.491 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -20.052 9.262 -0.099 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -20.943 7.761 -0.448 1.00 0.00 H new ATOM 1884 N GLU B 27 -23.034 7.782 -2.571 1.00 0.00 N ATOM 1885 CA GLU B 27 -24.226 7.036 -2.092 1.00 0.00 C ATOM 1886 C GLU B 27 -23.767 5.743 -1.425 1.00 0.00 C ATOM 1887 O GLU B 27 -23.068 4.945 -2.017 1.00 0.00 O ATOM 1888 CB GLU B 27 -24.999 6.733 -3.369 1.00 0.00 C ATOM 1889 CG GLU B 27 -26.504 6.732 -3.097 1.00 0.00 C ATOM 1890 CD GLU B 27 -27.261 6.794 -4.425 1.00 0.00 C ATOM 1891 OE1 GLU B 27 -26.613 6.947 -5.447 1.00 0.00 O ATOM 1892 OE2 GLU B 27 -28.476 6.684 -4.398 1.00 0.00 O ATOM 0 H GLU B 27 -22.612 7.415 -3.424 1.00 0.00 H new ATOM 0 HA GLU B 27 -24.825 7.583 -1.364 1.00 0.00 H new ATOM 0 HB2 GLU B 27 -24.762 7.477 -4.130 1.00 0.00 H new ATOM 0 HB3 GLU B 27 -24.694 5.764 -3.764 1.00 0.00 H new ATOM 0 HG2 GLU B 27 -26.785 5.833 -2.547 1.00 0.00 H new ATOM 0 HG3 GLU B 27 -26.772 7.584 -2.473 1.00 0.00 H new ATOM 1899 N LEU B 28 -24.041 5.593 -0.165 1.00 0.00 N ATOM 1900 CA LEU B 28 -23.497 4.426 0.579 1.00 0.00 C ATOM 1901 C LEU B 28 -24.391 3.197 0.364 1.00 0.00 C ATOM 1902 O LEU B 28 -25.595 3.273 0.512 1.00 0.00 O ATOM 1903 CB LEU B 28 -23.509 4.872 2.038 1.00 0.00 C ATOM 1904 CG LEU B 28 -22.374 4.183 2.799 1.00 0.00 C ATOM 1905 CD1 LEU B 28 -21.041 4.472 2.104 1.00 0.00 C ATOM 1906 CD2 LEU B 28 -22.318 4.726 4.229 1.00 0.00 C ATOM 0 H LEU B 28 -24.619 6.228 0.385 1.00 0.00 H new ATOM 0 HA LEU B 28 -22.499 4.137 0.249 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -23.395 5.954 2.098 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -24.468 4.626 2.495 1.00 0.00 H new ATOM 0 HG LEU B 28 -22.553 3.108 2.817 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -20.234 3.981 2.647 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -21.074 4.094 1.082 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -20.865 5.548 2.087 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -21.510 4.236 4.773 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -22.139 5.801 4.203 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -23.265 4.528 4.731 1.00 0.00 H new ATOM 1918 N PRO B 29 -23.767 2.103 0.008 1.00 0.00 N ATOM 1919 CA PRO B 29 -24.513 0.843 -0.246 1.00 0.00 C ATOM 1920 C PRO B 29 -25.120 0.293 1.048 1.00 0.00 C ATOM 1921 O PRO B 29 -24.984 0.872 2.107 1.00 0.00 O ATOM 1922 CB PRO B 29 -23.456 -0.108 -0.791 1.00 0.00 C ATOM 1923 CG PRO B 29 -22.146 0.452 -0.337 1.00 0.00 C ATOM 1924 CD PRO B 29 -22.325 1.937 -0.187 1.00 0.00 C ATOM 0 HA PRO B 29 -25.348 0.985 -0.933 1.00 0.00 H new ATOM 0 HB2 PRO B 29 -23.604 -1.119 -0.411 1.00 0.00 H new ATOM 0 HB3 PRO B 29 -23.503 -0.166 -1.878 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -21.843 0.004 0.609 1.00 0.00 H new ATOM 0 HG3 PRO B 29 -21.361 0.230 -1.060 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -21.761 2.323 0.662 1.00 0.00 H new ATOM 0 HD3 PRO B 29 -21.978 2.472 -1.071 1.00 0.00 H new ATOM 1932 N ASP B 30 -25.871 -0.769 0.948 1.00 0.00 N ATOM 1933 CA ASP B 30 -26.589 -1.298 2.143 1.00 0.00 C ATOM 1934 C ASP B 30 -25.605 -1.683 3.253 1.00 0.00 C ATOM 1935 O ASP B 30 -25.901 -1.542 4.423 1.00 0.00 O ATOM 1936 CB ASP B 30 -27.334 -2.534 1.641 1.00 0.00 C ATOM 1937 CG ASP B 30 -28.113 -3.164 2.796 1.00 0.00 C ATOM 1938 OD1 ASP B 30 -27.825 -2.825 3.933 1.00 0.00 O ATOM 1939 OD2 ASP B 30 -28.982 -3.976 2.526 1.00 0.00 O ATOM 0 H ASP B 30 -26.019 -1.295 0.087 1.00 0.00 H new ATOM 0 HA ASP B 30 -27.260 -0.554 2.571 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -28.015 -2.259 0.836 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -26.628 -3.255 1.229 1.00 0.00 H new ATOM 1944 N HIS B 31 -24.492 -2.273 2.912 1.00 0.00 N ATOM 1945 CA HIS B 31 -23.578 -2.779 3.978 1.00 0.00 C ATOM 1946 C HIS B 31 -22.571 -1.700 4.386 1.00 0.00 C ATOM 1947 O HIS B 31 -21.845 -1.856 5.348 1.00 0.00 O ATOM 1948 CB HIS B 31 -22.876 -4.003 3.382 1.00 0.00 C ATOM 1949 CG HIS B 31 -21.977 -3.606 2.243 1.00 0.00 C ATOM 1950 ND1 HIS B 31 -22.032 -2.359 1.638 1.00 0.00 N ATOM 1951 CD2 HIS B 31 -20.996 -4.299 1.581 1.00 0.00 C ATOM 1952 CE1 HIS B 31 -21.107 -2.345 0.659 1.00 0.00 C ATOM 1953 NE2 HIS B 31 -20.447 -3.502 0.583 1.00 0.00 N ATOM 0 H HIS B 31 -24.178 -2.426 1.954 1.00 0.00 H new ATOM 0 HA HIS B 31 -24.123 -3.044 4.884 1.00 0.00 H new ATOM 0 HB2 HIS B 31 -22.292 -4.504 4.154 1.00 0.00 H new ATOM 0 HB3 HIS B 31 -23.620 -4.718 3.031 1.00 0.00 H new ATOM 0 HD2 HIS B 31 -20.695 -5.312 1.802 1.00 0.00 H new ATOM 0 HE1 HIS B 31 -20.922 -1.499 0.013 1.00 0.00 H new ATOM 0 HE2 HIS B 31 -19.701 -3.749 -0.067 1.00 0.00 H new ATOM 1961 N MET B 32 -22.651 -0.543 3.789 1.00 0.00 N ATOM 1962 CA MET B 32 -21.843 0.604 4.294 1.00 0.00 C ATOM 1963 C MET B 32 -22.767 1.648 4.927 1.00 0.00 C ATOM 1964 O MET B 32 -22.343 2.478 5.706 1.00 0.00 O ATOM 1965 CB MET B 32 -21.141 1.178 3.065 1.00 0.00 C ATOM 1966 CG MET B 32 -20.112 0.171 2.551 1.00 0.00 C ATOM 1967 SD MET B 32 -18.890 -0.161 3.844 1.00 0.00 S ATOM 1968 CE MET B 32 -18.074 1.454 3.811 1.00 0.00 C ATOM 0 H MET B 32 -23.237 -0.342 2.978 1.00 0.00 H new ATOM 0 HA MET B 32 -21.126 0.302 5.057 1.00 0.00 H new ATOM 0 HB2 MET B 32 -21.871 1.399 2.286 1.00 0.00 H new ATOM 0 HB3 MET B 32 -20.651 2.118 3.318 1.00 0.00 H new ATOM 0 HG2 MET B 32 -20.608 -0.755 2.259 1.00 0.00 H new ATOM 0 HG3 MET B 32 -19.618 0.562 1.661 1.00 0.00 H new ATOM 0 HE1 MET B 32 -17.047 1.350 4.160 1.00 0.00 H new ATOM 0 HE2 MET B 32 -18.073 1.840 2.792 1.00 0.00 H new ATOM 0 HE3 MET B 32 -18.610 2.146 4.461 1.00 0.00 H new ATOM 1978 N LEU B 33 -24.042 1.557 4.659 1.00 0.00 N ATOM 1979 CA LEU B 33 -25.014 2.482 5.309 1.00 0.00 C ATOM 1980 C LEU B 33 -25.111 2.179 6.806 1.00 0.00 C ATOM 1981 O LEU B 33 -25.302 3.063 7.618 1.00 0.00 O ATOM 1982 CB LEU B 33 -26.347 2.207 4.612 1.00 0.00 C ATOM 1983 CG LEU B 33 -26.388 2.941 3.269 1.00 0.00 C ATOM 1984 CD1 LEU B 33 -27.532 2.389 2.417 1.00 0.00 C ATOM 1985 CD2 LEU B 33 -26.618 4.428 3.520 1.00 0.00 C ATOM 0 H LEU B 33 -24.453 0.880 4.016 1.00 0.00 H new ATOM 0 HA LEU B 33 -24.718 3.527 5.219 1.00 0.00 H new ATOM 0 HB2 LEU B 33 -26.472 1.136 4.456 1.00 0.00 H new ATOM 0 HB3 LEU B 33 -27.173 2.536 5.243 1.00 0.00 H new ATOM 0 HG LEU B 33 -25.444 2.795 2.744 1.00 0.00 H new ATOM 0 HD11 LEU B 33 -27.560 2.913 1.461 1.00 0.00 H new ATOM 0 HD12 LEU B 33 -27.375 1.324 2.243 1.00 0.00 H new ATOM 0 HD13 LEU B 33 -28.478 2.536 2.939 1.00 0.00 H new ATOM 0 HD21 LEU B 33 -26.648 4.957 2.568 1.00 0.00 H new ATOM 0 HD22 LEU B 33 -27.564 4.567 4.043 1.00 0.00 H new ATOM 0 HD23 LEU B 33 -25.806 4.824 4.129 1.00 0.00 H new ATOM 1997 N ASP B 34 -24.990 0.935 7.177 1.00 0.00 N ATOM 1998 CA ASP B 34 -25.083 0.572 8.620 1.00 0.00 C ATOM 1999 C ASP B 34 -23.699 0.630 9.272 1.00 0.00 C ATOM 2000 O ASP B 34 -22.852 -0.206 9.026 1.00 0.00 O ATOM 2001 CB ASP B 34 -25.619 -0.861 8.628 1.00 0.00 C ATOM 2002 CG ASP B 34 -25.759 -1.347 10.072 1.00 0.00 C ATOM 2003 OD1 ASP B 34 -25.151 -0.744 10.941 1.00 0.00 O ATOM 2004 OD2 ASP B 34 -26.469 -2.316 10.284 1.00 0.00 O ATOM 0 H ASP B 34 -24.830 0.152 6.543 1.00 0.00 H new ATOM 0 HA ASP B 34 -25.724 1.254 9.179 1.00 0.00 H new ATOM 0 HB2 ASP B 34 -26.585 -0.902 8.124 1.00 0.00 H new ATOM 0 HB3 ASP B 34 -24.944 -1.516 8.077 1.00 0.00 H new ATOM 2009 N GLY B 35 -23.484 1.570 10.155 1.00 0.00 N ATOM 2010 CA GLY B 35 -22.180 1.624 10.877 1.00 0.00 C ATOM 2011 C GLY B 35 -21.477 2.961 10.610 1.00 0.00 C ATOM 2012 O GLY B 35 -21.021 3.620 11.522 1.00 0.00 O ATOM 0 H GLY B 35 -24.152 2.299 10.406 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -22.344 1.499 11.947 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -21.544 0.800 10.554 1.00 0.00 H new ATOM 2016 N LEU B 36 -21.289 3.314 9.365 1.00 0.00 N ATOM 2017 CA LEU B 36 -20.502 4.545 9.053 1.00 0.00 C ATOM 2018 C LEU B 36 -21.158 5.782 9.673 1.00 0.00 C ATOM 2019 O LEU B 36 -22.364 5.862 9.805 1.00 0.00 O ATOM 2020 CB LEU B 36 -20.500 4.648 7.529 1.00 0.00 C ATOM 2021 CG LEU B 36 -19.513 5.734 7.097 1.00 0.00 C ATOM 2022 CD1 LEU B 36 -18.986 5.420 5.696 1.00 0.00 C ATOM 2023 CD2 LEU B 36 -20.218 7.092 7.084 1.00 0.00 C ATOM 0 H LEU B 36 -21.644 2.807 8.554 1.00 0.00 H new ATOM 0 HA LEU B 36 -19.492 4.491 9.460 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -20.221 3.691 7.089 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -21.501 4.885 7.168 1.00 0.00 H new ATOM 0 HG LEU B 36 -18.680 5.764 7.799 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -18.283 6.195 5.390 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -18.481 4.454 5.705 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -19.818 5.387 4.993 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -19.514 7.865 6.776 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -21.053 7.062 6.384 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -20.591 7.318 8.083 1.00 0.00 H new ATOM 2035 N GLU B 37 -20.366 6.747 10.054 1.00 0.00 N ATOM 2036 CA GLU B 37 -20.922 7.986 10.668 1.00 0.00 C ATOM 2037 C GLU B 37 -20.105 9.200 10.214 1.00 0.00 C ATOM 2038 O GLU B 37 -19.028 9.062 9.669 1.00 0.00 O ATOM 2039 CB GLU B 37 -20.778 7.777 12.176 1.00 0.00 C ATOM 2040 CG GLU B 37 -19.295 7.800 12.555 1.00 0.00 C ATOM 2041 CD GLU B 37 -19.148 7.591 14.064 1.00 0.00 C ATOM 2042 OE1 GLU B 37 -20.157 7.630 14.748 1.00 0.00 O ATOM 2043 OE2 GLU B 37 -18.029 7.396 14.509 1.00 0.00 O ATOM 0 H GLU B 37 -19.350 6.730 9.965 1.00 0.00 H new ATOM 0 HA GLU B 37 -21.958 8.168 10.380 1.00 0.00 H new ATOM 0 HB2 GLU B 37 -21.314 8.558 12.715 1.00 0.00 H new ATOM 0 HB3 GLU B 37 -21.224 6.826 12.466 1.00 0.00 H new ATOM 0 HG2 GLU B 37 -18.759 7.019 12.016 1.00 0.00 H new ATOM 0 HG3 GLU B 37 -18.850 8.751 12.264 1.00 0.00 H new ATOM 2050 N THR B 38 -20.598 10.386 10.439 1.00 0.00 N ATOM 2051 CA THR B 38 -19.833 11.598 10.023 1.00 0.00 C ATOM 2052 C THR B 38 -18.585 11.761 10.902 1.00 0.00 C ATOM 2053 O THR B 38 -18.509 11.230 11.992 1.00 0.00 O ATOM 2054 CB THR B 38 -20.794 12.768 10.226 1.00 0.00 C ATOM 2055 OG1 THR B 38 -21.892 12.353 11.028 1.00 0.00 O ATOM 2056 CG2 THR B 38 -21.300 13.261 8.870 1.00 0.00 C ATOM 0 H THR B 38 -21.494 10.570 10.891 1.00 0.00 H new ATOM 0 HA THR B 38 -19.488 11.535 8.991 1.00 0.00 H new ATOM 0 HB THR B 38 -20.270 13.581 10.729 1.00 0.00 H new ATOM 0 HG1 THR B 38 -22.505 13.106 11.158 1.00 0.00 H new ATOM 0 HG21 THR B 38 -21.985 14.096 9.019 1.00 0.00 H new ATOM 0 HG22 THR B 38 -20.455 13.589 8.264 1.00 0.00 H new ATOM 0 HG23 THR B 38 -21.821 12.451 8.359 1.00 0.00 H new ATOM 2064 N GLY B 39 -17.571 12.417 10.397 1.00 0.00 N ATOM 2065 CA GLY B 39 -16.291 12.527 11.155 1.00 0.00 C ATOM 2066 C GLY B 39 -15.543 11.192 11.096 1.00 0.00 C ATOM 2067 O GLY B 39 -14.442 11.065 11.594 1.00 0.00 O ATOM 0 H GLY B 39 -17.576 12.882 9.489 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -15.674 13.320 10.733 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -16.492 12.797 12.192 1.00 0.00 H new ATOM 2071 N ALA B 40 -16.099 10.218 10.426 1.00 0.00 N ATOM 2072 CA ALA B 40 -15.384 8.923 10.258 1.00 0.00 C ATOM 2073 C ALA B 40 -14.346 9.057 9.146 1.00 0.00 C ATOM 2074 O ALA B 40 -14.457 9.914 8.292 1.00 0.00 O ATOM 2075 CB ALA B 40 -16.474 7.934 9.851 1.00 0.00 C ATOM 0 H ALA B 40 -17.019 10.265 9.988 1.00 0.00 H new ATOM 0 HA ALA B 40 -14.859 8.606 11.159 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -16.034 6.947 9.705 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -17.229 7.882 10.635 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -16.938 8.266 8.922 1.00 0.00 H new ATOM 2081 N SER B 41 -13.367 8.197 9.106 1.00 0.00 N ATOM 2082 CA SER B 41 -12.382 8.274 7.995 1.00 0.00 C ATOM 2083 C SER B 41 -12.741 7.262 6.909 1.00 0.00 C ATOM 2084 O SER B 41 -12.579 6.071 7.078 1.00 0.00 O ATOM 2085 CB SER B 41 -11.031 7.937 8.621 1.00 0.00 C ATOM 2086 OG SER B 41 -11.232 7.105 9.755 1.00 0.00 O ATOM 0 H SER B 41 -13.208 7.453 9.786 1.00 0.00 H new ATOM 0 HA SER B 41 -12.369 9.258 7.526 1.00 0.00 H new ATOM 0 HB2 SER B 41 -10.396 7.432 7.893 1.00 0.00 H new ATOM 0 HB3 SER B 41 -10.515 8.851 8.914 1.00 0.00 H new ATOM 0 HG SER B 41 -11.888 6.410 9.539 1.00 0.00 H new ATOM 2092 N VAL B 42 -13.146 7.736 5.766 1.00 0.00 N ATOM 2093 CA VAL B 42 -13.419 6.811 4.633 1.00 0.00 C ATOM 2094 C VAL B 42 -12.247 6.858 3.655 1.00 0.00 C ATOM 2095 O VAL B 42 -11.916 7.897 3.121 1.00 0.00 O ATOM 2096 CB VAL B 42 -14.720 7.335 3.991 1.00 0.00 C ATOM 2097 CG1 VAL B 42 -14.716 7.132 2.479 1.00 0.00 C ATOM 2098 CG2 VAL B 42 -15.903 6.566 4.553 1.00 0.00 C ATOM 0 H VAL B 42 -13.300 8.724 5.567 1.00 0.00 H new ATOM 0 HA VAL B 42 -13.532 5.772 4.942 1.00 0.00 H new ATOM 0 HB VAL B 42 -14.793 8.400 4.214 1.00 0.00 H new ATOM 0 HG11 VAL B 42 -15.647 7.512 2.058 1.00 0.00 H new ATOM 0 HG12 VAL B 42 -13.874 7.669 2.042 1.00 0.00 H new ATOM 0 HG13 VAL B 42 -14.624 6.069 2.255 1.00 0.00 H new ATOM 0 HG21 VAL B 42 -16.824 6.934 4.101 1.00 0.00 H new ATOM 0 HG22 VAL B 42 -15.787 5.506 4.329 1.00 0.00 H new ATOM 0 HG23 VAL B 42 -15.948 6.706 5.633 1.00 0.00 H new ATOM 2108 N ALA B 43 -11.711 5.726 3.316 1.00 0.00 N ATOM 2109 CA ALA B 43 -10.677 5.705 2.256 1.00 0.00 C ATOM 2110 C ALA B 43 -11.342 5.440 0.909 1.00 0.00 C ATOM 2111 O ALA B 43 -11.933 4.399 0.694 1.00 0.00 O ATOM 2112 CB ALA B 43 -9.738 4.560 2.628 1.00 0.00 C ATOM 0 H ALA B 43 -11.942 4.820 3.724 1.00 0.00 H new ATOM 0 HA ALA B 43 -10.138 6.649 2.177 1.00 0.00 H new ATOM 0 HB1 ALA B 43 -8.944 4.484 1.885 1.00 0.00 H new ATOM 0 HB2 ALA B 43 -9.301 4.752 3.608 1.00 0.00 H new ATOM 0 HB3 ALA B 43 -10.298 3.625 2.657 1.00 0.00 H new ATOM 2118 N HIS B 44 -11.211 6.348 -0.015 1.00 0.00 N ATOM 2119 CA HIS B 44 -11.787 6.114 -1.366 1.00 0.00 C ATOM 2120 C HIS B 44 -10.739 5.425 -2.242 1.00 0.00 C ATOM 2121 O HIS B 44 -9.672 5.952 -2.484 1.00 0.00 O ATOM 2122 CB HIS B 44 -12.131 7.503 -1.906 1.00 0.00 C ATOM 2123 CG HIS B 44 -13.523 7.894 -1.481 1.00 0.00 C ATOM 2124 ND1 HIS B 44 -14.020 7.649 -0.201 1.00 0.00 N ATOM 2125 CD2 HIS B 44 -14.537 8.526 -2.160 1.00 0.00 C ATOM 2126 CE1 HIS B 44 -15.278 8.130 -0.158 1.00 0.00 C ATOM 2127 NE2 HIS B 44 -15.634 8.671 -1.322 1.00 0.00 N ATOM 0 H HIS B 44 -10.731 7.240 0.106 1.00 0.00 H new ATOM 0 HA HIS B 44 -12.669 5.474 -1.348 1.00 0.00 H new ATOM 0 HB2 HIS B 44 -11.411 8.234 -1.537 1.00 0.00 H new ATOM 0 HB3 HIS B 44 -12.060 7.507 -2.994 1.00 0.00 H new ATOM 0 HD1 HIS B 44 -13.523 7.190 0.562 1.00 0.00 H new ATOM 0 HD2 HIS B 44 -14.488 8.858 -3.186 1.00 0.00 H new ATOM 0 HE1 HIS B 44 -15.917 8.083 0.711 1.00 0.00 H new ATOM 2136 N ASN B 45 -10.951 4.171 -2.507 1.00 0.00 N ATOM 2137 CA ASN B 45 -9.893 3.328 -3.124 1.00 0.00 C ATOM 2138 C ASN B 45 -8.594 3.409 -2.320 1.00 0.00 C ATOM 2139 O ASN B 45 -7.581 2.888 -2.735 1.00 0.00 O ATOM 2140 CB ASN B 45 -9.692 3.880 -4.534 1.00 0.00 C ATOM 2141 CG ASN B 45 -9.391 2.715 -5.475 1.00 0.00 C ATOM 2142 OD1 ASN B 45 -8.276 2.237 -5.532 1.00 0.00 O ATOM 2143 ND2 ASN B 45 -10.344 2.236 -6.224 1.00 0.00 N ATOM 0 H ASN B 45 -11.828 3.685 -2.319 1.00 0.00 H new ATOM 0 HA ASN B 45 -10.181 2.277 -3.143 1.00 0.00 H new ATOM 0 HB2 ASN B 45 -10.585 4.411 -4.863 1.00 0.00 H new ATOM 0 HB3 ASN B 45 -8.872 4.598 -4.546 1.00 0.00 H new ATOM 0 HD21 ASN B 45 -10.153 1.460 -6.858 1.00 0.00 H new ATOM 0 HD22 ASN B 45 -11.281 2.637 -6.176 1.00 0.00 H new ATOM 2150 N GLY B 46 -8.654 3.889 -1.105 1.00 0.00 N ATOM 2151 CA GLY B 46 -7.458 3.805 -0.224 1.00 0.00 C ATOM 2152 C GLY B 46 -6.937 5.205 0.126 1.00 0.00 C ATOM 2153 O GLY B 46 -5.989 5.340 0.869 1.00 0.00 O ATOM 0 H GLY B 46 -9.474 4.332 -0.690 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -7.712 3.268 0.690 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -6.674 3.235 -0.722 1.00 0.00 H new ATOM 2157 N CYS B 47 -7.596 6.251 -0.302 1.00 0.00 N ATOM 2158 CA CYS B 47 -7.164 7.611 0.137 1.00 0.00 C ATOM 2159 C CYS B 47 -8.061 8.079 1.283 1.00 0.00 C ATOM 2160 O CYS B 47 -9.259 8.178 1.131 1.00 0.00 O ATOM 2161 CB CYS B 47 -7.335 8.520 -1.083 1.00 0.00 C ATOM 2162 SG CYS B 47 -6.551 10.116 -0.749 1.00 0.00 S ATOM 0 H CYS B 47 -8.402 6.224 -0.927 1.00 0.00 H new ATOM 0 HA CYS B 47 -6.134 7.623 0.493 1.00 0.00 H new ATOM 0 HB2 CYS B 47 -6.886 8.058 -1.962 1.00 0.00 H new ATOM 0 HB3 CYS B 47 -8.394 8.660 -1.302 1.00 0.00 H new ATOM 0 HG CYS B 47 -6.310 10.725 -1.872 1.00 0.00 H new ATOM 2168 N CYS B 48 -7.524 8.184 2.469 1.00 0.00 N ATOM 2169 CA CYS B 48 -8.398 8.428 3.654 1.00 0.00 C ATOM 2170 C CYS B 48 -8.820 9.897 3.739 1.00 0.00 C ATOM 2171 O CYS B 48 -8.004 10.778 3.921 1.00 0.00 O ATOM 2172 CB CYS B 48 -7.543 8.052 4.864 1.00 0.00 C ATOM 2173 SG CYS B 48 -6.039 9.058 4.877 1.00 0.00 S ATOM 0 H CYS B 48 -6.526 8.112 2.668 1.00 0.00 H new ATOM 0 HA CYS B 48 -9.318 7.846 3.598 1.00 0.00 H new ATOM 0 HB2 CYS B 48 -8.106 8.209 5.784 1.00 0.00 H new ATOM 0 HB3 CYS B 48 -7.285 6.994 4.825 1.00 0.00 H new ATOM 0 HG CYS B 48 -5.108 8.455 4.200 1.00 0.00 H new ATOM 2179 N LEU B 49 -10.101 10.134 3.811 1.00 0.00 N ATOM 2180 CA LEU B 49 -10.594 11.507 4.121 1.00 0.00 C ATOM 2181 C LEU B 49 -11.720 11.419 5.157 1.00 0.00 C ATOM 2182 O LEU B 49 -12.136 10.344 5.535 1.00 0.00 O ATOM 2183 CB LEU B 49 -11.115 12.079 2.799 1.00 0.00 C ATOM 2184 CG LEU B 49 -11.856 10.999 2.007 1.00 0.00 C ATOM 2185 CD1 LEU B 49 -12.857 11.670 1.065 1.00 0.00 C ATOM 2186 CD2 LEU B 49 -10.849 10.186 1.185 1.00 0.00 C ATOM 0 H LEU B 49 -10.830 9.435 3.668 1.00 0.00 H new ATOM 0 HA LEU B 49 -9.812 12.142 4.536 1.00 0.00 H new ATOM 0 HB2 LEU B 49 -11.783 12.917 2.996 1.00 0.00 H new ATOM 0 HB3 LEU B 49 -10.284 12.466 2.210 1.00 0.00 H new ATOM 0 HG LEU B 49 -12.382 10.335 2.693 1.00 0.00 H new ATOM 0 HD11 LEU B 49 -13.389 10.907 0.497 1.00 0.00 H new ATOM 0 HD12 LEU B 49 -13.571 12.253 1.648 1.00 0.00 H new ATOM 0 HD13 LEU B 49 -12.325 12.329 0.378 1.00 0.00 H new ATOM 0 HD21 LEU B 49 -11.376 9.417 0.621 1.00 0.00 H new ATOM 0 HD22 LEU B 49 -10.325 10.847 0.495 1.00 0.00 H new ATOM 0 HD23 LEU B 49 -10.129 9.715 1.854 1.00 0.00 H new ATOM 2198 N THR B 50 -12.150 12.529 5.693 1.00 0.00 N ATOM 2199 CA THR B 50 -13.166 12.473 6.787 1.00 0.00 C ATOM 2200 C THR B 50 -14.554 12.822 6.254 1.00 0.00 C ATOM 2201 O THR B 50 -14.702 13.567 5.304 1.00 0.00 O ATOM 2202 CB THR B 50 -12.718 13.510 7.820 1.00 0.00 C ATOM 2203 OG1 THR B 50 -11.373 13.250 8.197 1.00 0.00 O ATOM 2204 CG2 THR B 50 -13.625 13.431 9.055 1.00 0.00 C ATOM 0 H THR B 50 -11.846 13.465 5.425 1.00 0.00 H new ATOM 0 HA THR B 50 -13.234 11.474 7.217 1.00 0.00 H new ATOM 0 HB THR B 50 -12.787 14.508 7.387 1.00 0.00 H new ATOM 0 HG1 THR B 50 -11.084 13.914 8.857 1.00 0.00 H new ATOM 0 HG21 THR B 50 -13.305 14.170 9.790 1.00 0.00 H new ATOM 0 HG22 THR B 50 -14.656 13.633 8.763 1.00 0.00 H new ATOM 0 HG23 THR B 50 -13.560 12.434 9.491 1.00 0.00 H new ATOM 2212 N VAL B 51 -15.574 12.289 6.870 1.00 0.00 N ATOM 2213 CA VAL B 51 -16.961 12.582 6.418 1.00 0.00 C ATOM 2214 C VAL B 51 -17.396 13.962 6.912 1.00 0.00 C ATOM 2215 O VAL B 51 -17.622 14.166 8.088 1.00 0.00 O ATOM 2216 CB VAL B 51 -17.818 11.491 7.063 1.00 0.00 C ATOM 2217 CG1 VAL B 51 -19.229 11.540 6.491 1.00 0.00 C ATOM 2218 CG2 VAL B 51 -17.196 10.126 6.788 1.00 0.00 C ATOM 0 H VAL B 51 -15.504 11.661 7.670 1.00 0.00 H new ATOM 0 HA VAL B 51 -17.052 12.590 5.332 1.00 0.00 H new ATOM 0 HB VAL B 51 -17.864 11.656 8.139 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -19.836 10.761 6.953 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -19.671 12.515 6.696 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -19.191 11.379 5.414 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -17.807 9.349 7.248 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -17.146 9.959 5.712 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -16.191 10.093 7.208 1.00 0.00 H new ATOM 2228 N THR B 52 -17.577 14.894 6.018 1.00 0.00 N ATOM 2229 CA THR B 52 -18.070 16.236 6.435 1.00 0.00 C ATOM 2230 C THR B 52 -19.523 16.136 6.885 1.00 0.00 C ATOM 2231 O THR B 52 -19.938 16.776 7.831 1.00 0.00 O ATOM 2232 CB THR B 52 -17.967 17.105 5.183 1.00 0.00 C ATOM 2233 OG1 THR B 52 -18.903 16.651 4.216 1.00 0.00 O ATOM 2234 CG2 THR B 52 -16.556 17.009 4.614 1.00 0.00 C ATOM 0 H THR B 52 -17.405 14.785 5.019 1.00 0.00 H new ATOM 0 HA THR B 52 -17.497 16.647 7.266 1.00 0.00 H new ATOM 0 HB THR B 52 -18.184 18.142 5.439 1.00 0.00 H new ATOM 0 HG1 THR B 52 -18.933 15.672 4.225 1.00 0.00 H new ATOM 0 HG21 THR B 52 -16.481 17.629 3.720 1.00 0.00 H new ATOM 0 HG22 THR B 52 -15.839 17.357 5.358 1.00 0.00 H new ATOM 0 HG23 THR B 52 -16.337 15.973 4.356 1.00 0.00 H new ATOM 2242 N GLU B 53 -20.310 15.361 6.194 1.00 0.00 N ATOM 2243 CA GLU B 53 -21.748 15.254 6.571 1.00 0.00 C ATOM 2244 C GLU B 53 -22.401 14.053 5.888 1.00 0.00 C ATOM 2245 O GLU B 53 -22.063 13.700 4.779 1.00 0.00 O ATOM 2246 CB GLU B 53 -22.381 16.556 6.077 1.00 0.00 C ATOM 2247 CG GLU B 53 -23.874 16.559 6.412 1.00 0.00 C ATOM 2248 CD GLU B 53 -24.506 17.861 5.917 1.00 0.00 C ATOM 2249 OE1 GLU B 53 -23.763 18.747 5.528 1.00 0.00 O ATOM 2250 OE2 GLU B 53 -25.722 17.950 5.935 1.00 0.00 O ATOM 0 H GLU B 53 -20.024 14.801 5.391 1.00 0.00 H new ATOM 0 HA GLU B 53 -21.878 15.110 7.644 1.00 0.00 H new ATOM 0 HB2 GLU B 53 -21.891 17.411 6.544 1.00 0.00 H new ATOM 0 HB3 GLU B 53 -22.239 16.656 5.001 1.00 0.00 H new ATOM 0 HG2 GLU B 53 -24.364 15.704 5.945 1.00 0.00 H new ATOM 0 HG3 GLU B 53 -24.016 16.460 7.488 1.00 0.00 H new ATOM 2257 N ILE B 54 -23.407 13.497 6.497 1.00 0.00 N ATOM 2258 CA ILE B 54 -24.171 12.403 5.831 1.00 0.00 C ATOM 2259 C ILE B 54 -25.526 12.920 5.370 1.00 0.00 C ATOM 2260 O ILE B 54 -26.259 13.543 6.113 1.00 0.00 O ATOM 2261 CB ILE B 54 -24.342 11.327 6.900 1.00 0.00 C ATOM 2262 CG1 ILE B 54 -22.983 10.697 7.200 1.00 0.00 C ATOM 2263 CG2 ILE B 54 -25.294 10.253 6.377 1.00 0.00 C ATOM 2264 CD1 ILE B 54 -22.864 10.394 8.698 1.00 0.00 C ATOM 0 H ILE B 54 -23.736 13.751 7.428 1.00 0.00 H new ATOM 0 HA ILE B 54 -23.659 12.018 4.949 1.00 0.00 H new ATOM 0 HB ILE B 54 -24.749 11.768 7.810 1.00 0.00 H new ATOM 0 HG12 ILE B 54 -22.864 9.779 6.624 1.00 0.00 H new ATOM 0 HG13 ILE B 54 -22.184 11.372 6.893 1.00 0.00 H new ATOM 0 HG21 ILE B 54 -25.422 9.480 7.135 1.00 0.00 H new ATOM 0 HG22 ILE B 54 -26.261 10.703 6.151 1.00 0.00 H new ATOM 0 HG23 ILE B 54 -24.880 9.809 5.472 1.00 0.00 H new ATOM 0 HD11 ILE B 54 -21.892 9.945 8.902 1.00 0.00 H new ATOM 0 HD12 ILE B 54 -22.963 11.319 9.265 1.00 0.00 H new ATOM 0 HD13 ILE B 54 -23.653 9.702 8.993 1.00 0.00 H new ATOM 2276 N ASN B 55 -25.869 12.643 4.148 1.00 0.00 N ATOM 2277 CA ASN B 55 -27.187 13.091 3.626 1.00 0.00 C ATOM 2278 C ASN B 55 -28.132 11.897 3.535 1.00 0.00 C ATOM 2279 O ASN B 55 -28.435 11.409 2.463 1.00 0.00 O ATOM 2280 CB ASN B 55 -26.892 13.665 2.241 1.00 0.00 C ATOM 2281 CG ASN B 55 -26.293 15.064 2.393 1.00 0.00 C ATOM 2282 OD1 ASN B 55 -26.998 16.013 2.673 1.00 0.00 O ATOM 2283 ND2 ASN B 55 -25.010 15.233 2.223 1.00 0.00 N ATOM 0 H ASN B 55 -25.293 12.124 3.485 1.00 0.00 H new ATOM 0 HA ASN B 55 -27.667 13.830 4.268 1.00 0.00 H new ATOM 0 HB2 ASN B 55 -26.199 13.016 1.705 1.00 0.00 H new ATOM 0 HB3 ASN B 55 -27.807 13.710 1.651 1.00 0.00 H new ATOM 0 HD21 ASN B 55 -24.600 16.161 2.325 1.00 0.00 H new ATOM 0 HD22 ASN B 55 -24.417 14.437 1.988 1.00 0.00 H new ATOM 2290 N GLY B 56 -28.479 11.332 4.657 1.00 0.00 N ATOM 2291 CA GLY B 56 -29.266 10.071 4.632 1.00 0.00 C ATOM 2292 C GLY B 56 -28.329 8.920 4.288 1.00 0.00 C ATOM 2293 O GLY B 56 -27.380 8.653 4.998 1.00 0.00 O ATOM 0 H GLY B 56 -28.252 11.688 5.586 1.00 0.00 H new ATOM 0 HA2 GLY B 56 -29.736 9.899 5.600 1.00 0.00 H new ATOM 0 HA3 GLY B 56 -30.067 10.140 3.896 1.00 0.00 H new ATOM 2297 N ASN B 57 -28.529 8.285 3.169 1.00 0.00 N ATOM 2298 CA ASN B 57 -27.578 7.221 2.764 1.00 0.00 C ATOM 2299 C ASN B 57 -26.330 7.868 2.138 1.00 0.00 C ATOM 2300 O ASN B 57 -25.287 7.255 2.032 1.00 0.00 O ATOM 2301 CB ASN B 57 -28.358 6.337 1.770 1.00 0.00 C ATOM 2302 CG ASN B 57 -27.865 6.542 0.341 1.00 0.00 C ATOM 2303 OD1 ASN B 57 -28.552 7.091 -0.498 1.00 0.00 O ATOM 2304 ND2 ASN B 57 -26.681 6.106 0.051 1.00 0.00 N ATOM 0 H ASN B 57 -29.301 8.455 2.525 1.00 0.00 H new ATOM 0 HA ASN B 57 -27.219 6.617 3.597 1.00 0.00 H new ATOM 0 HB2 ASN B 57 -28.248 5.289 2.048 1.00 0.00 H new ATOM 0 HB3 ASN B 57 -29.421 6.572 1.828 1.00 0.00 H new ATOM 0 HD21 ASN B 57 -26.312 6.221 -0.893 1.00 0.00 H new ATOM 0 HD22 ASN B 57 -26.117 5.647 0.767 1.00 0.00 H new ATOM 2311 N HIS B 58 -26.450 9.086 1.676 1.00 0.00 N ATOM 2312 CA HIS B 58 -25.290 9.745 1.011 1.00 0.00 C ATOM 2313 C HIS B 58 -24.272 10.180 2.049 1.00 0.00 C ATOM 2314 O HIS B 58 -24.608 10.429 3.188 1.00 0.00 O ATOM 2315 CB HIS B 58 -25.853 10.978 0.318 1.00 0.00 C ATOM 2316 CG HIS B 58 -26.391 10.600 -1.037 1.00 0.00 C ATOM 2317 ND1 HIS B 58 -27.622 11.043 -1.493 1.00 0.00 N ATOM 2318 CD2 HIS B 58 -25.866 9.837 -2.057 1.00 0.00 C ATOM 2319 CE1 HIS B 58 -27.796 10.552 -2.734 1.00 0.00 C ATOM 2320 NE2 HIS B 58 -26.757 9.809 -3.124 1.00 0.00 N ATOM 0 H HIS B 58 -27.298 9.650 1.731 1.00 0.00 H new ATOM 0 HA HIS B 58 -24.797 9.068 0.313 1.00 0.00 H new ATOM 0 HB2 HIS B 58 -26.645 11.418 0.924 1.00 0.00 H new ATOM 0 HB3 HIS B 58 -25.075 11.734 0.213 1.00 0.00 H new ATOM 0 HD1 HIS B 58 -28.277 11.634 -0.981 1.00 0.00 H new ATOM 0 HD2 HIS B 58 -24.909 9.337 -2.032 1.00 0.00 H new ATOM 0 HE1 HIS B 58 -28.670 10.737 -3.341 1.00 0.00 H new ATOM 2328 N VAL B 59 -23.053 10.375 1.649 1.00 0.00 N ATOM 2329 CA VAL B 59 -22.059 10.909 2.608 1.00 0.00 C ATOM 2330 C VAL B 59 -21.117 11.903 1.924 1.00 0.00 C ATOM 2331 O VAL B 59 -20.397 11.567 1.005 1.00 0.00 O ATOM 2332 CB VAL B 59 -21.320 9.677 3.105 1.00 0.00 C ATOM 2333 CG1 VAL B 59 -20.179 10.108 4.013 1.00 0.00 C ATOM 2334 CG2 VAL B 59 -22.301 8.810 3.895 1.00 0.00 C ATOM 0 H VAL B 59 -22.704 10.190 0.709 1.00 0.00 H new ATOM 0 HA VAL B 59 -22.517 11.465 3.426 1.00 0.00 H new ATOM 0 HB VAL B 59 -20.917 9.114 2.264 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -19.647 9.227 4.371 1.00 0.00 H new ATOM 0 HG12 VAL B 59 -19.492 10.746 3.456 1.00 0.00 H new ATOM 0 HG13 VAL B 59 -20.579 10.661 4.863 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -21.788 7.920 4.260 1.00 0.00 H new ATOM 0 HG22 VAL B 59 -22.689 9.378 4.741 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -23.127 8.513 3.248 1.00 0.00 H new ATOM 2344 N SER B 60 -21.098 13.118 2.401 1.00 0.00 N ATOM 2345 CA SER B 60 -20.181 14.148 1.828 1.00 0.00 C ATOM 2346 C SER B 60 -18.819 14.074 2.524 1.00 0.00 C ATOM 2347 O SER B 60 -18.735 14.142 3.734 1.00 0.00 O ATOM 2348 CB SER B 60 -20.858 15.482 2.138 1.00 0.00 C ATOM 2349 OG SER B 60 -22.183 15.467 1.626 1.00 0.00 O ATOM 0 H SER B 60 -21.683 13.445 3.170 1.00 0.00 H new ATOM 0 HA SER B 60 -20.009 14.009 0.761 1.00 0.00 H new ATOM 0 HB2 SER B 60 -20.874 15.653 3.214 1.00 0.00 H new ATOM 0 HB3 SER B 60 -20.293 16.301 1.693 1.00 0.00 H new ATOM 0 HG SER B 60 -22.620 16.321 1.825 1.00 0.00 H new ATOM 2355 N PHE B 61 -17.747 13.989 1.780 1.00 0.00 N ATOM 2356 CA PHE B 61 -16.403 13.972 2.431 1.00 0.00 C ATOM 2357 C PHE B 61 -15.627 15.244 2.068 1.00 0.00 C ATOM 2358 O PHE B 61 -15.952 15.924 1.116 1.00 0.00 O ATOM 2359 CB PHE B 61 -15.687 12.743 1.867 1.00 0.00 C ATOM 2360 CG PHE B 61 -16.424 11.483 2.255 1.00 0.00 C ATOM 2361 CD1 PHE B 61 -17.432 10.975 1.423 1.00 0.00 C ATOM 2362 CD2 PHE B 61 -16.090 10.813 3.441 1.00 0.00 C ATOM 2363 CE1 PHE B 61 -18.106 9.798 1.777 1.00 0.00 C ATOM 2364 CE2 PHE B 61 -16.766 9.637 3.795 1.00 0.00 C ATOM 2365 CZ PHE B 61 -17.772 9.129 2.963 1.00 0.00 C ATOM 0 H PHE B 61 -17.742 13.931 0.762 1.00 0.00 H new ATOM 0 HA PHE B 61 -16.480 13.933 3.518 1.00 0.00 H new ATOM 0 HB2 PHE B 61 -15.625 12.816 0.781 1.00 0.00 H new ATOM 0 HB3 PHE B 61 -14.665 12.705 2.243 1.00 0.00 H new ATOM 0 HD1 PHE B 61 -17.689 11.491 0.509 1.00 0.00 H new ATOM 0 HD2 PHE B 61 -15.312 11.203 4.081 1.00 0.00 H new ATOM 0 HE1 PHE B 61 -18.882 9.407 1.136 1.00 0.00 H new ATOM 0 HE2 PHE B 61 -16.511 9.122 4.710 1.00 0.00 H new ATOM 0 HZ PHE B 61 -18.291 8.222 3.235 1.00 0.00 H new ATOM 2375 N ASP B 62 -14.628 15.594 2.837 1.00 0.00 N ATOM 2376 CA ASP B 62 -13.873 16.852 2.545 1.00 0.00 C ATOM 2377 C ASP B 62 -12.649 16.577 1.684 1.00 0.00 C ATOM 2378 O ASP B 62 -12.053 15.519 1.728 1.00 0.00 O ATOM 2379 CB ASP B 62 -13.448 17.404 3.907 1.00 0.00 C ATOM 2380 CG ASP B 62 -12.606 16.360 4.642 1.00 0.00 C ATOM 2381 OD1 ASP B 62 -12.689 15.198 4.279 1.00 0.00 O ATOM 2382 OD2 ASP B 62 -11.891 16.740 5.554 1.00 0.00 O ATOM 0 H ASP B 62 -14.303 15.069 3.649 1.00 0.00 H new ATOM 0 HA ASP B 62 -14.490 17.558 1.990 1.00 0.00 H new ATOM 0 HB2 ASP B 62 -12.875 18.322 3.776 1.00 0.00 H new ATOM 0 HB3 ASP B 62 -14.328 17.659 4.498 1.00 0.00 H new ATOM 2387 N LEU B 63 -12.315 17.519 0.853 1.00 0.00 N ATOM 2388 CA LEU B 63 -11.184 17.330 -0.084 1.00 0.00 C ATOM 2389 C LEU B 63 -10.614 18.696 -0.468 1.00 0.00 C ATOM 2390 O LEU B 63 -11.272 19.485 -1.115 1.00 0.00 O ATOM 2391 CB LEU B 63 -11.827 16.658 -1.293 1.00 0.00 C ATOM 2392 CG LEU B 63 -11.245 15.258 -1.492 1.00 0.00 C ATOM 2393 CD1 LEU B 63 -12.388 14.242 -1.451 1.00 0.00 C ATOM 2394 CD2 LEU B 63 -10.533 15.181 -2.852 1.00 0.00 C ATOM 0 H LEU B 63 -12.784 18.422 0.784 1.00 0.00 H new ATOM 0 HA LEU B 63 -10.364 16.744 0.331 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -12.906 16.594 -1.151 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -11.658 17.260 -2.186 1.00 0.00 H new ATOM 0 HG LEU B 63 -10.525 15.040 -0.703 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -11.988 13.238 -1.592 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -12.892 14.300 -0.486 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -13.100 14.463 -2.246 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -10.120 14.182 -2.990 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -11.246 15.392 -3.649 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -9.727 15.915 -2.883 1.00 0.00 H new ATOM 2406 N MET B 64 -9.395 18.983 -0.107 1.00 0.00 N ATOM 2407 CA MET B 64 -8.817 20.299 -0.506 1.00 0.00 C ATOM 2408 C MET B 64 -8.555 20.302 -2.011 1.00 0.00 C ATOM 2409 O MET B 64 -8.147 19.310 -2.576 1.00 0.00 O ATOM 2410 CB MET B 64 -7.508 20.433 0.274 1.00 0.00 C ATOM 2411 CG MET B 64 -6.970 21.857 0.121 1.00 0.00 C ATOM 2412 SD MET B 64 -5.310 21.957 0.835 1.00 0.00 S ATOM 2413 CE MET B 64 -5.797 21.789 2.569 1.00 0.00 C ATOM 0 H MET B 64 -8.782 18.376 0.437 1.00 0.00 H new ATOM 0 HA MET B 64 -9.488 21.130 -0.288 1.00 0.00 H new ATOM 0 HB2 MET B 64 -7.674 20.206 1.327 1.00 0.00 H new ATOM 0 HB3 MET B 64 -6.776 19.714 -0.095 1.00 0.00 H new ATOM 0 HG2 MET B 64 -6.941 22.135 -0.933 1.00 0.00 H new ATOM 0 HG3 MET B 64 -7.634 22.563 0.619 1.00 0.00 H new ATOM 0 HE1 MET B 64 -5.016 22.202 3.208 1.00 0.00 H new ATOM 0 HE2 MET B 64 -6.729 22.329 2.739 1.00 0.00 H new ATOM 0 HE3 MET B 64 -5.940 20.735 2.806 1.00 0.00 H new ATOM 2423 N LYS B 65 -8.834 21.387 -2.675 1.00 0.00 N ATOM 2424 CA LYS B 65 -8.649 21.417 -4.152 1.00 0.00 C ATOM 2425 C LYS B 65 -7.188 21.142 -4.505 1.00 0.00 C ATOM 2426 O LYS B 65 -6.887 20.384 -5.404 1.00 0.00 O ATOM 2427 CB LYS B 65 -9.046 22.832 -4.574 1.00 0.00 C ATOM 2428 CG LYS B 65 -8.893 22.974 -6.089 1.00 0.00 C ATOM 2429 CD LYS B 65 -9.290 24.390 -6.510 1.00 0.00 C ATOM 2430 CE LYS B 65 -9.140 24.535 -8.026 1.00 0.00 C ATOM 2431 NZ LYS B 65 -8.204 25.678 -8.212 1.00 0.00 N ATOM 0 H LYS B 65 -9.181 22.252 -2.261 1.00 0.00 H new ATOM 0 HA LYS B 65 -9.247 20.659 -4.659 1.00 0.00 H new ATOM 0 HB2 LYS B 65 -10.076 23.035 -4.281 1.00 0.00 H new ATOM 0 HB3 LYS B 65 -8.420 23.564 -4.064 1.00 0.00 H new ATOM 0 HG2 LYS B 65 -7.863 22.771 -6.382 1.00 0.00 H new ATOM 0 HG3 LYS B 65 -9.519 22.242 -6.599 1.00 0.00 H new ATOM 0 HD2 LYS B 65 -10.320 24.593 -6.215 1.00 0.00 H new ATOM 0 HD3 LYS B 65 -8.662 25.121 -6.001 1.00 0.00 H new ATOM 0 HE2 LYS B 65 -8.743 23.623 -8.473 1.00 0.00 H new ATOM 0 HE3 LYS B 65 -10.101 24.731 -8.501 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 -8.051 25.840 -9.228 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 -8.611 26.533 -7.783 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 -7.295 25.460 -7.755 1.00 0.00 H new ATOM 2445 N GLU B 66 -6.272 21.724 -3.786 1.00 0.00 N ATOM 2446 CA GLU B 66 -4.839 21.452 -4.073 1.00 0.00 C ATOM 2447 C GLU B 66 -4.491 20.016 -3.679 1.00 0.00 C ATOM 2448 O GLU B 66 -3.871 19.297 -4.433 1.00 0.00 O ATOM 2449 CB GLU B 66 -4.060 22.456 -3.223 1.00 0.00 C ATOM 2450 CG GLU B 66 -2.560 22.260 -3.446 1.00 0.00 C ATOM 2451 CD GLU B 66 -1.783 23.265 -2.595 1.00 0.00 C ATOM 2452 OE1 GLU B 66 -2.414 24.140 -2.023 1.00 0.00 O ATOM 2453 OE2 GLU B 66 -0.571 23.143 -2.526 1.00 0.00 O ATOM 0 H GLU B 66 -6.451 22.371 -3.018 1.00 0.00 H new ATOM 0 HA GLU B 66 -4.600 21.556 -5.131 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -4.348 23.473 -3.488 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -4.302 22.321 -2.169 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -2.272 21.243 -3.181 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -2.317 22.395 -4.500 1.00 0.00 H new ATOM 2460 N THR B 67 -5.006 19.548 -2.575 1.00 0.00 N ATOM 2461 CA THR B 67 -4.832 18.106 -2.240 1.00 0.00 C ATOM 2462 C THR B 67 -5.479 17.254 -3.329 1.00 0.00 C ATOM 2463 O THR B 67 -5.002 16.195 -3.672 1.00 0.00 O ATOM 2464 CB THR B 67 -5.545 17.896 -0.905 1.00 0.00 C ATOM 2465 OG1 THR B 67 -4.955 18.730 0.083 1.00 0.00 O ATOM 2466 CG2 THR B 67 -5.412 16.433 -0.482 1.00 0.00 C ATOM 0 H THR B 67 -5.535 20.096 -1.896 1.00 0.00 H new ATOM 0 HA THR B 67 -3.782 17.823 -2.173 1.00 0.00 H new ATOM 0 HB THR B 67 -6.600 18.149 -1.012 1.00 0.00 H new ATOM 0 HG1 THR B 67 -5.301 18.485 0.967 1.00 0.00 H new ATOM 0 HG21 THR B 67 -5.920 16.282 0.470 1.00 0.00 H new ATOM 0 HG22 THR B 67 -5.863 15.793 -1.240 1.00 0.00 H new ATOM 0 HG23 THR B 67 -4.357 16.180 -0.374 1.00 0.00 H new ATOM 2474 N LEU B 68 -6.568 17.712 -3.875 1.00 0.00 N ATOM 2475 CA LEU B 68 -7.248 16.938 -4.938 1.00 0.00 C ATOM 2476 C LEU B 68 -6.290 16.752 -6.118 1.00 0.00 C ATOM 2477 O LEU B 68 -6.105 15.659 -6.615 1.00 0.00 O ATOM 2478 CB LEU B 68 -8.433 17.819 -5.322 1.00 0.00 C ATOM 2479 CG LEU B 68 -9.358 17.069 -6.273 1.00 0.00 C ATOM 2480 CD1 LEU B 68 -10.067 15.946 -5.513 1.00 0.00 C ATOM 2481 CD2 LEU B 68 -10.391 18.050 -6.819 1.00 0.00 C ATOM 0 H LEU B 68 -7.016 18.594 -3.627 1.00 0.00 H new ATOM 0 HA LEU B 68 -7.562 15.941 -4.628 1.00 0.00 H new ATOM 0 HB2 LEU B 68 -8.981 18.115 -4.427 1.00 0.00 H new ATOM 0 HB3 LEU B 68 -8.077 18.734 -5.795 1.00 0.00 H new ATOM 0 HG LEU B 68 -8.784 16.638 -7.093 1.00 0.00 H new ATOM 0 HD11 LEU B 68 -10.729 15.409 -6.192 1.00 0.00 H new ATOM 0 HD12 LEU B 68 -9.326 15.257 -5.108 1.00 0.00 H new ATOM 0 HD13 LEU B 68 -10.652 16.371 -4.697 1.00 0.00 H new ATOM 0 HD21 LEU B 68 -11.062 17.529 -7.502 1.00 0.00 H new ATOM 0 HD22 LEU B 68 -10.967 18.469 -5.994 1.00 0.00 H new ATOM 0 HD23 LEU B 68 -9.883 18.854 -7.352 1.00 0.00 H new ATOM 2493 N ARG B 69 -5.582 17.789 -6.480 1.00 0.00 N ATOM 2494 CA ARG B 69 -4.525 17.645 -7.523 1.00 0.00 C ATOM 2495 C ARG B 69 -3.341 16.830 -6.985 1.00 0.00 C ATOM 2496 O ARG B 69 -2.742 16.047 -7.695 1.00 0.00 O ATOM 2497 CB ARG B 69 -4.087 19.074 -7.833 1.00 0.00 C ATOM 2498 CG ARG B 69 -2.834 19.044 -8.708 1.00 0.00 C ATOM 2499 CD ARG B 69 -2.399 20.476 -9.016 1.00 0.00 C ATOM 2500 NE ARG B 69 -1.171 20.335 -9.848 1.00 0.00 N ATOM 2501 CZ ARG B 69 -1.260 19.963 -11.097 1.00 0.00 C ATOM 2502 NH1 ARG B 69 -2.427 19.716 -11.629 1.00 0.00 N ATOM 2503 NH2 ARG B 69 -0.178 19.838 -11.816 1.00 0.00 N ATOM 0 H ARG B 69 -5.690 18.729 -6.099 1.00 0.00 H new ATOM 0 HA ARG B 69 -4.890 17.121 -8.407 1.00 0.00 H new ATOM 0 HB2 ARG B 69 -4.888 19.608 -8.344 1.00 0.00 H new ATOM 0 HB3 ARG B 69 -3.884 19.613 -6.907 1.00 0.00 H new ATOM 0 HG2 ARG B 69 -2.033 18.510 -8.197 1.00 0.00 H new ATOM 0 HG3 ARG B 69 -3.036 18.506 -9.634 1.00 0.00 H new ATOM 0 HD2 ARG B 69 -3.178 21.019 -9.551 1.00 0.00 H new ATOM 0 HD3 ARG B 69 -2.194 21.032 -8.101 1.00 0.00 H new ATOM 0 HE ARG B 69 -0.257 20.530 -9.440 1.00 0.00 H new ATOM 0 HH11 ARG B 69 -3.274 19.813 -11.069 1.00 0.00 H new ATOM 0 HH12 ARG B 69 -2.492 19.426 -12.605 1.00 0.00 H new ATOM 0 HH21 ARG B 69 0.734 20.031 -11.402 1.00 0.00 H new ATOM 0 HH22 ARG B 69 -0.245 19.548 -12.792 1.00 0.00 H new ATOM 2517 N ILE B 70 -2.966 17.051 -5.752 1.00 0.00 N ATOM 2518 CA ILE B 70 -1.784 16.339 -5.189 1.00 0.00 C ATOM 2519 C ILE B 70 -2.068 14.838 -5.166 1.00 0.00 C ATOM 2520 O ILE B 70 -1.257 14.026 -5.568 1.00 0.00 O ATOM 2521 CB ILE B 70 -1.626 16.934 -3.775 1.00 0.00 C ATOM 2522 CG1 ILE B 70 -0.156 17.270 -3.534 1.00 0.00 C ATOM 2523 CG2 ILE B 70 -2.101 15.965 -2.679 1.00 0.00 C ATOM 2524 CD1 ILE B 70 -0.036 18.193 -2.320 1.00 0.00 C ATOM 0 H ILE B 70 -3.429 17.695 -5.111 1.00 0.00 H new ATOM 0 HA ILE B 70 -0.869 16.463 -5.768 1.00 0.00 H new ATOM 0 HB ILE B 70 -2.246 17.829 -3.723 1.00 0.00 H new ATOM 0 HG12 ILE B 70 0.414 16.356 -3.367 1.00 0.00 H new ATOM 0 HG13 ILE B 70 0.267 17.753 -4.415 1.00 0.00 H new ATOM 0 HG21 ILE B 70 -1.970 16.429 -1.701 1.00 0.00 H new ATOM 0 HG22 ILE B 70 -3.155 15.732 -2.831 1.00 0.00 H new ATOM 0 HG23 ILE B 70 -1.515 15.047 -2.726 1.00 0.00 H new ATOM 0 HD11 ILE B 70 1.013 18.433 -2.148 1.00 0.00 H new ATOM 0 HD12 ILE B 70 -0.593 19.112 -2.505 1.00 0.00 H new ATOM 0 HD13 ILE B 70 -0.443 17.693 -1.441 1.00 0.00 H new ATOM 2536 N THR B 71 -3.260 14.489 -4.787 1.00 0.00 N ATOM 2537 CA THR B 71 -3.674 13.068 -4.833 1.00 0.00 C ATOM 2538 C THR B 71 -4.267 12.764 -6.202 1.00 0.00 C ATOM 2539 O THR B 71 -4.395 13.636 -7.039 1.00 0.00 O ATOM 2540 CB THR B 71 -4.750 12.928 -3.755 1.00 0.00 C ATOM 2541 OG1 THR B 71 -5.958 13.512 -4.221 1.00 0.00 O ATOM 2542 CG2 THR B 71 -4.301 13.640 -2.480 1.00 0.00 C ATOM 0 H THR B 71 -3.971 15.135 -4.444 1.00 0.00 H new ATOM 0 HA THR B 71 -2.842 12.384 -4.666 1.00 0.00 H new ATOM 0 HB THR B 71 -4.910 11.872 -3.539 1.00 0.00 H new ATOM 0 HG1 THR B 71 -5.896 14.488 -4.156 1.00 0.00 H new ATOM 0 HG21 THR B 71 -5.071 13.537 -1.715 1.00 0.00 H new ATOM 0 HG22 THR B 71 -3.373 13.195 -2.122 1.00 0.00 H new ATOM 0 HG23 THR B 71 -4.138 14.697 -2.691 1.00 0.00 H new ATOM 2550 N ASN B 72 -4.784 11.590 -6.375 1.00 0.00 N ATOM 2551 CA ASN B 72 -5.545 11.299 -7.607 1.00 0.00 C ATOM 2552 C ASN B 72 -7.040 11.332 -7.268 1.00 0.00 C ATOM 2553 O ASN B 72 -7.869 10.798 -7.976 1.00 0.00 O ATOM 2554 CB ASN B 72 -5.044 9.909 -8.026 1.00 0.00 C ATOM 2555 CG ASN B 72 -6.099 9.157 -8.838 1.00 0.00 C ATOM 2556 OD1 ASN B 72 -6.748 9.723 -9.694 1.00 0.00 O ATOM 2557 ND2 ASN B 72 -6.283 7.883 -8.614 1.00 0.00 N ATOM 0 H ASN B 72 -4.712 10.817 -5.714 1.00 0.00 H new ATOM 0 HA ASN B 72 -5.406 12.012 -8.420 1.00 0.00 H new ATOM 0 HB2 ASN B 72 -4.133 10.011 -8.616 1.00 0.00 H new ATOM 0 HB3 ASN B 72 -4.785 9.331 -7.139 1.00 0.00 H new ATOM 0 HD21 ASN B 72 -6.972 7.364 -9.158 1.00 0.00 H new ATOM 0 HD22 ASN B 72 -5.738 7.408 -7.895 1.00 0.00 H new ATOM 2564 N LEU B 73 -7.401 12.045 -6.221 1.00 0.00 N ATOM 2565 CA LEU B 73 -8.845 12.199 -5.895 1.00 0.00 C ATOM 2566 C LEU B 73 -9.542 13.043 -6.971 1.00 0.00 C ATOM 2567 O LEU B 73 -10.657 12.764 -7.364 1.00 0.00 O ATOM 2568 CB LEU B 73 -8.873 12.913 -4.542 1.00 0.00 C ATOM 2569 CG LEU B 73 -8.341 11.979 -3.448 1.00 0.00 C ATOM 2570 CD1 LEU B 73 -8.375 12.704 -2.101 1.00 0.00 C ATOM 2571 CD2 LEU B 73 -9.221 10.728 -3.374 1.00 0.00 C ATOM 0 H LEU B 73 -6.758 12.520 -5.588 1.00 0.00 H new ATOM 0 HA LEU B 73 -9.366 11.243 -5.857 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -8.267 13.818 -4.586 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -9.891 13.222 -4.305 1.00 0.00 H new ATOM 0 HG LEU B 73 -7.316 11.690 -3.682 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -7.997 12.042 -1.322 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -7.752 13.597 -2.152 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -9.400 12.991 -1.868 1.00 0.00 H new ATOM 0 HD21 LEU B 73 -8.844 10.063 -2.597 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -10.245 11.017 -3.139 1.00 0.00 H new ATOM 0 HD23 LEU B 73 -9.201 10.212 -4.334 1.00 0.00 H new ATOM 2583 N GLY B 74 -8.895 14.078 -7.447 1.00 0.00 N ATOM 2584 CA GLY B 74 -9.521 14.940 -8.489 1.00 0.00 C ATOM 2585 C GLY B 74 -10.165 14.076 -9.578 1.00 0.00 C ATOM 2586 O GLY B 74 -11.025 14.526 -10.309 1.00 0.00 O ATOM 0 H GLY B 74 -7.959 14.361 -7.157 1.00 0.00 H new ATOM 0 HA2 GLY B 74 -10.274 15.584 -8.034 1.00 0.00 H new ATOM 0 HA3 GLY B 74 -8.768 15.593 -8.931 1.00 0.00 H new ATOM 2590 N ASP B 75 -9.711 12.864 -9.741 1.00 0.00 N ATOM 2591 CA ASP B 75 -10.248 12.007 -10.839 1.00 0.00 C ATOM 2592 C ASP B 75 -11.725 11.680 -10.597 1.00 0.00 C ATOM 2593 O ASP B 75 -12.429 11.253 -11.490 1.00 0.00 O ATOM 2594 CB ASP B 75 -9.404 10.734 -10.791 1.00 0.00 C ATOM 2595 CG ASP B 75 -9.740 9.941 -9.526 1.00 0.00 C ATOM 2596 OD1 ASP B 75 -10.273 10.533 -8.603 1.00 0.00 O ATOM 2597 OD2 ASP B 75 -9.458 8.754 -9.503 1.00 0.00 O ATOM 0 H ASP B 75 -8.992 12.429 -9.163 1.00 0.00 H new ATOM 0 HA ASP B 75 -10.193 12.502 -11.808 1.00 0.00 H new ATOM 0 HB2 ASP B 75 -9.595 10.126 -11.675 1.00 0.00 H new ATOM 0 HB3 ASP B 75 -8.344 10.988 -10.802 1.00 0.00 H new ATOM 2602 N LEU B 76 -12.183 11.814 -9.383 1.00 0.00 N ATOM 2603 CA LEU B 76 -13.595 11.440 -9.073 1.00 0.00 C ATOM 2604 C LEU B 76 -14.573 12.288 -9.885 1.00 0.00 C ATOM 2605 O LEU B 76 -14.389 13.476 -10.065 1.00 0.00 O ATOM 2606 CB LEU B 76 -13.771 11.717 -7.585 1.00 0.00 C ATOM 2607 CG LEU B 76 -12.862 10.788 -6.783 1.00 0.00 C ATOM 2608 CD1 LEU B 76 -12.888 11.196 -5.309 1.00 0.00 C ATOM 2609 CD2 LEU B 76 -13.363 9.349 -6.924 1.00 0.00 C ATOM 0 H LEU B 76 -11.643 12.166 -8.592 1.00 0.00 H new ATOM 0 HA LEU B 76 -13.796 10.398 -9.324 1.00 0.00 H new ATOM 0 HB2 LEU B 76 -13.529 12.757 -7.367 1.00 0.00 H new ATOM 0 HB3 LEU B 76 -14.811 11.564 -7.296 1.00 0.00 H new ATOM 0 HG LEU B 76 -11.841 10.859 -7.159 1.00 0.00 H new ATOM 0 HD11 LEU B 76 -12.239 10.533 -4.736 1.00 0.00 H new ATOM 0 HD12 LEU B 76 -12.536 12.223 -5.209 1.00 0.00 H new ATOM 0 HD13 LEU B 76 -13.907 11.123 -4.929 1.00 0.00 H new ATOM 0 HD21 LEU B 76 -12.717 8.681 -6.353 1.00 0.00 H new ATOM 0 HD22 LEU B 76 -14.383 9.280 -6.545 1.00 0.00 H new ATOM 0 HD23 LEU B 76 -13.346 9.059 -7.975 1.00 0.00 H new ATOM 2621 N LYS B 77 -15.652 11.694 -10.300 1.00 0.00 N ATOM 2622 CA LYS B 77 -16.711 12.461 -11.020 1.00 0.00 C ATOM 2623 C LYS B 77 -18.084 11.868 -10.703 1.00 0.00 C ATOM 2624 O LYS B 77 -18.234 10.670 -10.554 1.00 0.00 O ATOM 2625 CB LYS B 77 -16.382 12.297 -12.502 1.00 0.00 C ATOM 2626 CG LYS B 77 -15.093 13.056 -12.822 1.00 0.00 C ATOM 2627 CD LYS B 77 -14.757 12.897 -14.306 1.00 0.00 C ATOM 2628 CE LYS B 77 -13.466 13.658 -14.619 1.00 0.00 C ATOM 2629 NZ LYS B 77 -13.539 13.967 -16.074 1.00 0.00 N ATOM 0 H LYS B 77 -15.851 10.702 -10.172 1.00 0.00 H new ATOM 0 HA LYS B 77 -16.739 13.511 -10.728 1.00 0.00 H new ATOM 0 HB2 LYS B 77 -16.265 11.241 -12.745 1.00 0.00 H new ATOM 0 HB3 LYS B 77 -17.202 12.676 -13.112 1.00 0.00 H new ATOM 0 HG2 LYS B 77 -15.210 14.112 -12.577 1.00 0.00 H new ATOM 0 HG3 LYS B 77 -14.274 12.676 -12.211 1.00 0.00 H new ATOM 0 HD2 LYS B 77 -14.639 11.842 -14.553 1.00 0.00 H new ATOM 0 HD3 LYS B 77 -15.574 13.278 -14.918 1.00 0.00 H new ATOM 0 HE2 LYS B 77 -13.392 14.570 -14.026 1.00 0.00 H new ATOM 0 HE3 LYS B 77 -12.588 13.055 -14.388 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 -12.686 14.489 -16.361 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 -13.601 13.081 -16.614 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 -14.381 14.548 -16.264 1.00 0.00 H new ATOM 2643 N VAL B 78 -19.071 12.693 -10.505 1.00 0.00 N ATOM 2644 CA VAL B 78 -20.396 12.157 -10.090 1.00 0.00 C ATOM 2645 C VAL B 78 -20.955 11.232 -11.163 1.00 0.00 C ATOM 2646 O VAL B 78 -20.556 11.277 -12.310 1.00 0.00 O ATOM 2647 CB VAL B 78 -21.302 13.365 -9.922 1.00 0.00 C ATOM 2648 CG1 VAL B 78 -22.616 12.914 -9.285 1.00 0.00 C ATOM 2649 CG2 VAL B 78 -20.616 14.381 -9.020 1.00 0.00 C ATOM 0 H VAL B 78 -19.020 13.706 -10.611 1.00 0.00 H new ATOM 0 HA VAL B 78 -20.319 11.579 -9.169 1.00 0.00 H new ATOM 0 HB VAL B 78 -21.504 13.821 -10.891 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -23.274 13.774 -9.160 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -23.099 12.179 -9.929 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -22.414 12.467 -8.312 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -21.261 15.251 -8.895 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -20.422 13.931 -8.047 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -19.673 14.690 -9.471 1.00 0.00 H new ATOM 2659 N GLY B 79 -21.789 10.316 -10.770 1.00 0.00 N ATOM 2660 CA GLY B 79 -22.274 9.297 -11.730 1.00 0.00 C ATOM 2661 C GLY B 79 -21.301 8.116 -11.721 1.00 0.00 C ATOM 2662 O GLY B 79 -21.622 7.028 -12.157 1.00 0.00 O ATOM 0 H GLY B 79 -22.156 10.230 -9.822 1.00 0.00 H new ATOM 0 HA2 GLY B 79 -23.275 8.965 -11.455 1.00 0.00 H new ATOM 0 HA3 GLY B 79 -22.343 9.723 -12.731 1.00 0.00 H new ATOM 2666 N ASP B 80 -20.138 8.307 -11.154 1.00 0.00 N ATOM 2667 CA ASP B 80 -19.169 7.183 -11.028 1.00 0.00 C ATOM 2668 C ASP B 80 -19.232 6.608 -9.613 1.00 0.00 C ATOM 2669 O ASP B 80 -19.806 7.200 -8.724 1.00 0.00 O ATOM 2670 CB ASP B 80 -17.799 7.813 -11.285 1.00 0.00 C ATOM 2671 CG ASP B 80 -16.780 6.714 -11.592 1.00 0.00 C ATOM 2672 OD1 ASP B 80 -17.086 5.561 -11.336 1.00 0.00 O ATOM 2673 OD2 ASP B 80 -15.710 7.044 -12.077 1.00 0.00 O ATOM 0 H ASP B 80 -19.819 9.197 -10.772 1.00 0.00 H new ATOM 0 HA ASP B 80 -19.379 6.369 -11.721 1.00 0.00 H new ATOM 0 HB2 ASP B 80 -17.859 8.511 -12.120 1.00 0.00 H new ATOM 0 HB3 ASP B 80 -17.481 8.385 -10.413 1.00 0.00 H new ATOM 2678 N TRP B 81 -18.601 5.492 -9.377 1.00 0.00 N ATOM 2679 CA TRP B 81 -18.584 4.934 -7.994 1.00 0.00 C ATOM 2680 C TRP B 81 -17.151 4.880 -7.462 1.00 0.00 C ATOM 2681 O TRP B 81 -16.195 5.071 -8.189 1.00 0.00 O ATOM 2682 CB TRP B 81 -19.163 3.525 -8.110 1.00 0.00 C ATOM 2683 CG TRP B 81 -20.641 3.611 -8.315 1.00 0.00 C ATOM 2684 CD1 TRP B 81 -21.251 4.302 -9.307 1.00 0.00 C ATOM 2685 CD2 TRP B 81 -21.704 3.001 -7.528 1.00 0.00 C ATOM 2686 NE1 TRP B 81 -22.619 4.156 -9.176 1.00 0.00 N ATOM 2687 CE2 TRP B 81 -22.949 3.362 -8.098 1.00 0.00 C ATOM 2688 CE3 TRP B 81 -21.709 2.177 -6.385 1.00 0.00 C ATOM 2689 CZ2 TRP B 81 -24.156 2.921 -7.552 1.00 0.00 C ATOM 2690 CZ3 TRP B 81 -22.922 1.731 -5.832 1.00 0.00 C ATOM 2691 CH2 TRP B 81 -24.143 2.103 -6.416 1.00 0.00 C ATOM 0 H TRP B 81 -18.099 4.944 -10.076 1.00 0.00 H new ATOM 0 HA TRP B 81 -19.160 5.549 -7.303 1.00 0.00 H new ATOM 0 HB2 TRP B 81 -18.699 2.997 -8.943 1.00 0.00 H new ATOM 0 HB3 TRP B 81 -18.942 2.954 -7.208 1.00 0.00 H new ATOM 0 HD1 TRP B 81 -20.751 4.873 -10.075 1.00 0.00 H new ATOM 0 HE1 TRP B 81 -23.302 4.584 -9.801 1.00 0.00 H new ATOM 0 HE3 TRP B 81 -20.774 1.886 -5.930 1.00 0.00 H new ATOM 0 HZ2 TRP B 81 -25.094 3.209 -8.003 1.00 0.00 H new ATOM 0 HZ3 TRP B 81 -22.914 1.100 -4.955 1.00 0.00 H new ATOM 0 HH2 TRP B 81 -25.073 1.758 -5.989 1.00 0.00 H new ATOM 2702 N VAL B 82 -17.001 4.640 -6.190 1.00 0.00 N ATOM 2703 CA VAL B 82 -15.640 4.593 -5.586 1.00 0.00 C ATOM 2704 C VAL B 82 -15.478 3.318 -4.763 1.00 0.00 C ATOM 2705 O VAL B 82 -16.399 2.866 -4.116 1.00 0.00 O ATOM 2706 CB VAL B 82 -15.561 5.824 -4.674 1.00 0.00 C ATOM 2707 CG1 VAL B 82 -16.868 5.976 -3.898 1.00 0.00 C ATOM 2708 CG2 VAL B 82 -14.421 5.658 -3.668 1.00 0.00 C ATOM 0 H VAL B 82 -17.768 4.473 -5.538 1.00 0.00 H new ATOM 0 HA VAL B 82 -14.855 4.594 -6.342 1.00 0.00 H new ATOM 0 HB VAL B 82 -15.386 6.704 -5.293 1.00 0.00 H new ATOM 0 HG11 VAL B 82 -16.808 6.851 -3.251 1.00 0.00 H new ATOM 0 HG12 VAL B 82 -17.695 6.098 -4.598 1.00 0.00 H new ATOM 0 HG13 VAL B 82 -17.036 5.087 -3.290 1.00 0.00 H new ATOM 0 HG21 VAL B 82 -14.373 6.537 -3.025 1.00 0.00 H new ATOM 0 HG22 VAL B 82 -14.599 4.772 -3.059 1.00 0.00 H new ATOM 0 HG23 VAL B 82 -13.477 5.547 -4.202 1.00 0.00 H new ATOM 2718 N ASN B 83 -14.269 2.880 -4.603 1.00 0.00 N ATOM 2719 CA ASN B 83 -13.997 1.809 -3.611 1.00 0.00 C ATOM 2720 C ASN B 83 -13.914 2.423 -2.214 1.00 0.00 C ATOM 2721 O ASN B 83 -13.007 3.154 -1.905 1.00 0.00 O ATOM 2722 CB ASN B 83 -12.648 1.239 -4.047 1.00 0.00 C ATOM 2723 CG ASN B 83 -12.855 -0.131 -4.696 1.00 0.00 C ATOM 2724 OD1 ASN B 83 -13.964 -0.495 -5.031 1.00 0.00 O ATOM 2725 ND2 ASN B 83 -11.827 -0.912 -4.886 1.00 0.00 N ATOM 0 H ASN B 83 -13.454 3.216 -5.116 1.00 0.00 H new ATOM 0 HA ASN B 83 -14.769 1.041 -3.571 1.00 0.00 H new ATOM 0 HB2 ASN B 83 -12.166 1.917 -4.751 1.00 0.00 H new ATOM 0 HB3 ASN B 83 -11.985 1.149 -3.187 1.00 0.00 H new ATOM 0 HD21 ASN B 83 -11.955 -1.828 -5.316 1.00 0.00 H new ATOM 0 HD22 ASN B 83 -10.895 -0.606 -4.605 1.00 0.00 H new ATOM 2732 N VAL B 84 -14.895 2.209 -1.392 1.00 0.00 N ATOM 2733 CA VAL B 84 -14.874 2.885 -0.059 1.00 0.00 C ATOM 2734 C VAL B 84 -14.571 1.889 1.057 1.00 0.00 C ATOM 2735 O VAL B 84 -15.031 0.762 1.056 1.00 0.00 O ATOM 2736 CB VAL B 84 -16.249 3.540 0.151 1.00 0.00 C ATOM 2737 CG1 VAL B 84 -16.197 4.972 -0.380 1.00 0.00 C ATOM 2738 CG2 VAL B 84 -17.351 2.768 -0.582 1.00 0.00 C ATOM 0 H VAL B 84 -15.699 1.608 -1.573 1.00 0.00 H new ATOM 0 HA VAL B 84 -14.086 3.638 -0.032 1.00 0.00 H new ATOM 0 HB VAL B 84 -16.480 3.532 1.216 1.00 0.00 H new ATOM 0 HG11 VAL B 84 -17.167 5.448 -0.237 1.00 0.00 H new ATOM 0 HG12 VAL B 84 -15.434 5.533 0.160 1.00 0.00 H new ATOM 0 HG13 VAL B 84 -15.953 4.958 -1.442 1.00 0.00 H new ATOM 0 HG21 VAL B 84 -18.311 3.256 -0.414 1.00 0.00 H new ATOM 0 HG22 VAL B 84 -17.135 2.751 -1.650 1.00 0.00 H new ATOM 0 HG23 VAL B 84 -17.393 1.746 -0.204 1.00 0.00 H new ATOM 2748 N GLU B 85 -13.766 2.305 1.994 1.00 0.00 N ATOM 2749 CA GLU B 85 -13.376 1.403 3.117 1.00 0.00 C ATOM 2750 C GLU B 85 -13.428 2.165 4.445 1.00 0.00 C ATOM 2751 O GLU B 85 -13.144 3.344 4.503 1.00 0.00 O ATOM 2752 CB GLU B 85 -11.945 0.968 2.800 1.00 0.00 C ATOM 2753 CG GLU B 85 -11.442 0.030 3.899 1.00 0.00 C ATOM 2754 CD GLU B 85 -10.010 -0.406 3.583 1.00 0.00 C ATOM 2755 OE1 GLU B 85 -9.556 -0.131 2.484 1.00 0.00 O ATOM 2756 OE2 GLU B 85 -9.390 -1.006 4.446 1.00 0.00 O ATOM 0 H GLU B 85 -13.357 3.239 2.032 1.00 0.00 H new ATOM 0 HA GLU B 85 -14.046 0.549 3.214 1.00 0.00 H new ATOM 0 HB2 GLU B 85 -11.912 0.464 1.834 1.00 0.00 H new ATOM 0 HB3 GLU B 85 -11.296 1.841 2.727 1.00 0.00 H new ATOM 0 HG2 GLU B 85 -11.475 0.534 4.865 1.00 0.00 H new ATOM 0 HG3 GLU B 85 -12.091 -0.843 3.972 1.00 0.00 H new ATOM 2763 N ARG B 86 -13.874 1.525 5.492 1.00 0.00 N ATOM 2764 CA ARG B 86 -14.045 2.242 6.790 1.00 0.00 C ATOM 2765 C ARG B 86 -12.712 2.340 7.543 1.00 0.00 C ATOM 2766 O ARG B 86 -12.026 1.358 7.747 1.00 0.00 O ATOM 2767 CB ARG B 86 -15.045 1.393 7.577 1.00 0.00 C ATOM 2768 CG ARG B 86 -14.398 0.061 7.964 1.00 0.00 C ATOM 2769 CD ARG B 86 -15.430 -0.825 8.665 1.00 0.00 C ATOM 2770 NE ARG B 86 -14.667 -2.026 9.107 1.00 0.00 N ATOM 2771 CZ ARG B 86 -13.902 -1.967 10.164 1.00 0.00 C ATOM 2772 NH1 ARG B 86 -13.799 -0.855 10.841 1.00 0.00 N ATOM 2773 NH2 ARG B 86 -13.237 -3.023 10.546 1.00 0.00 N ATOM 0 H ARG B 86 -14.127 0.537 5.506 1.00 0.00 H new ATOM 0 HA ARG B 86 -14.392 3.265 6.647 1.00 0.00 H new ATOM 0 HB2 ARG B 86 -15.365 1.927 8.472 1.00 0.00 H new ATOM 0 HB3 ARG B 86 -15.937 1.214 6.977 1.00 0.00 H new ATOM 0 HG2 ARG B 86 -14.016 -0.441 7.075 1.00 0.00 H new ATOM 0 HG3 ARG B 86 -13.547 0.236 8.622 1.00 0.00 H new ATOM 0 HD2 ARG B 86 -15.882 -0.310 9.513 1.00 0.00 H new ATOM 0 HD3 ARG B 86 -16.240 -1.098 7.989 1.00 0.00 H new ATOM 0 HE ARG B 86 -14.742 -2.897 8.582 1.00 0.00 H new ATOM 0 HH11 ARG B 86 -14.317 -0.028 10.545 1.00 0.00 H new ATOM 0 HH12 ARG B 86 -13.200 -0.814 11.666 1.00 0.00 H new ATOM 0 HH21 ARG B 86 -13.315 -3.893 10.019 1.00 0.00 H new ATOM 0 HH22 ARG B 86 -12.639 -2.978 11.371 1.00 0.00 H new ATOM 2787 N ALA B 87 -12.380 3.511 8.021 1.00 0.00 N ATOM 2788 CA ALA B 87 -11.139 3.670 8.837 1.00 0.00 C ATOM 2789 C ALA B 87 -11.471 4.331 10.175 1.00 0.00 C ATOM 2790 O ALA B 87 -12.376 5.140 10.279 1.00 0.00 O ATOM 2791 CB ALA B 87 -10.227 4.571 8.013 1.00 0.00 C ATOM 0 H ALA B 87 -12.917 4.367 7.881 1.00 0.00 H new ATOM 0 HA ALA B 87 -10.669 2.712 9.058 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -9.293 4.733 8.551 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -10.016 4.097 7.055 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -10.719 5.529 7.843 1.00 0.00 H new ATOM 2797 N ALA B 88 -10.770 3.955 11.207 1.00 0.00 N ATOM 2798 CA ALA B 88 -11.066 4.507 12.561 1.00 0.00 C ATOM 2799 C ALA B 88 -9.773 4.945 13.253 1.00 0.00 C ATOM 2800 O ALA B 88 -8.744 4.311 13.127 1.00 0.00 O ATOM 2801 CB ALA B 88 -11.702 3.345 13.317 1.00 0.00 C ATOM 0 H ALA B 88 -10.001 3.286 11.172 1.00 0.00 H new ATOM 0 HA ALA B 88 -11.714 5.382 12.519 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -11.953 3.663 14.329 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -12.608 3.028 12.801 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -11.000 2.513 13.362 1.00 0.00 H new ATOM 2807 N LYS B 89 -9.820 6.018 13.993 1.00 0.00 N ATOM 2808 CA LYS B 89 -8.595 6.488 14.702 1.00 0.00 C ATOM 2809 C LYS B 89 -8.240 5.524 15.838 1.00 0.00 C ATOM 2810 O LYS B 89 -7.087 5.219 16.069 1.00 0.00 O ATOM 2811 CB LYS B 89 -8.964 7.863 15.257 1.00 0.00 C ATOM 2812 CG LYS B 89 -9.340 8.791 14.101 1.00 0.00 C ATOM 2813 CD LYS B 89 -8.207 8.808 13.074 1.00 0.00 C ATOM 2814 CE LYS B 89 -8.473 9.899 12.035 1.00 0.00 C ATOM 2815 NZ LYS B 89 -7.631 11.051 12.464 1.00 0.00 N ATOM 0 H LYS B 89 -10.652 6.590 14.138 1.00 0.00 H new ATOM 0 HA LYS B 89 -7.727 6.535 14.044 1.00 0.00 H new ATOM 0 HB2 LYS B 89 -9.798 7.775 15.954 1.00 0.00 H new ATOM 0 HB3 LYS B 89 -8.125 8.280 15.815 1.00 0.00 H new ATOM 0 HG2 LYS B 89 -10.264 8.452 13.634 1.00 0.00 H new ATOM 0 HG3 LYS B 89 -9.523 9.799 14.474 1.00 0.00 H new ATOM 0 HD2 LYS B 89 -7.254 8.990 13.571 1.00 0.00 H new ATOM 0 HD3 LYS B 89 -8.131 7.837 12.585 1.00 0.00 H new ATOM 0 HE2 LYS B 89 -8.204 9.564 11.033 1.00 0.00 H new ATOM 0 HE3 LYS B 89 -9.529 10.170 12.008 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 -7.759 11.841 11.800 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 -7.915 11.352 13.418 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 -6.631 10.765 12.474 1.00 0.00 H new ATOM 2829 N PHE B 90 -9.224 5.039 16.543 1.00 0.00 N ATOM 2830 CA PHE B 90 -8.949 4.090 17.659 1.00 0.00 C ATOM 2831 C PHE B 90 -10.104 3.096 17.799 1.00 0.00 C ATOM 2832 O PHE B 90 -11.188 3.316 17.297 1.00 0.00 O ATOM 2833 CB PHE B 90 -8.835 4.966 18.904 1.00 0.00 C ATOM 2834 CG PHE B 90 -10.154 5.656 19.159 1.00 0.00 C ATOM 2835 CD1 PHE B 90 -10.410 6.910 18.588 1.00 0.00 C ATOM 2836 CD2 PHE B 90 -11.121 5.044 19.969 1.00 0.00 C ATOM 2837 CE1 PHE B 90 -11.634 7.552 18.825 1.00 0.00 C ATOM 2838 CE2 PHE B 90 -12.345 5.685 20.206 1.00 0.00 C ATOM 2839 CZ PHE B 90 -12.601 6.940 19.635 1.00 0.00 C ATOM 0 H PHE B 90 -10.209 5.259 16.394 1.00 0.00 H new ATOM 0 HA PHE B 90 -8.045 3.504 17.494 1.00 0.00 H new ATOM 0 HB2 PHE B 90 -8.559 4.358 19.765 1.00 0.00 H new ATOM 0 HB3 PHE B 90 -8.046 5.706 18.770 1.00 0.00 H new ATOM 0 HD1 PHE B 90 -9.664 7.382 17.965 1.00 0.00 H new ATOM 0 HD2 PHE B 90 -10.923 4.078 20.410 1.00 0.00 H new ATOM 0 HE1 PHE B 90 -11.832 8.518 18.384 1.00 0.00 H new ATOM 0 HE2 PHE B 90 -13.091 5.212 20.828 1.00 0.00 H new ATOM 0 HZ PHE B 90 -13.543 7.435 19.819 1.00 0.00 H new ATOM 2849 N SER B 91 -9.866 1.980 18.431 1.00 0.00 N ATOM 2850 CA SER B 91 -10.938 0.950 18.544 1.00 0.00 C ATOM 2851 C SER B 91 -10.776 0.146 19.837 1.00 0.00 C ATOM 2852 O SER B 91 -9.720 0.115 20.437 1.00 0.00 O ATOM 2853 CB SER B 91 -10.751 0.048 17.325 1.00 0.00 C ATOM 2854 OG SER B 91 -11.767 -0.946 17.318 1.00 0.00 O ATOM 0 H SER B 91 -8.979 1.737 18.873 1.00 0.00 H new ATOM 0 HA SER B 91 -11.932 1.396 18.575 1.00 0.00 H new ATOM 0 HB2 SER B 91 -10.797 0.639 16.410 1.00 0.00 H new ATOM 0 HB3 SER B 91 -9.767 -0.421 17.352 1.00 0.00 H new ATOM 0 HG SER B 91 -11.652 -1.526 16.536 1.00 0.00 H new ATOM 2860 N ASP B 92 -11.819 -0.505 20.267 1.00 0.00 N ATOM 2861 CA ASP B 92 -11.739 -1.314 21.517 1.00 0.00 C ATOM 2862 C ASP B 92 -10.800 -2.509 21.323 1.00 0.00 C ATOM 2863 O ASP B 92 -10.114 -2.924 22.237 1.00 0.00 O ATOM 2864 CB ASP B 92 -13.169 -1.791 21.769 1.00 0.00 C ATOM 2865 CG ASP B 92 -14.037 -0.601 22.182 1.00 0.00 C ATOM 2866 OD1 ASP B 92 -13.528 0.267 22.872 1.00 0.00 O ATOM 2867 OD2 ASP B 92 -15.194 -0.576 21.797 1.00 0.00 O ATOM 0 H ASP B 92 -12.729 -0.513 19.805 1.00 0.00 H new ATOM 0 HA ASP B 92 -11.345 -0.739 22.355 1.00 0.00 H new ATOM 0 HB2 ASP B 92 -13.573 -2.255 20.869 1.00 0.00 H new ATOM 0 HB3 ASP B 92 -13.178 -2.550 22.551 1.00 0.00 H new ATOM 2872 N GLU B 93 -10.854 -3.137 20.179 1.00 0.00 N ATOM 2873 CA GLU B 93 -10.072 -4.374 19.966 1.00 0.00 C ATOM 2874 C GLU B 93 -8.788 -4.040 19.186 1.00 0.00 C ATOM 2875 O GLU B 93 -8.358 -4.747 18.299 1.00 0.00 O ATOM 2876 CB GLU B 93 -11.049 -5.265 19.184 1.00 0.00 C ATOM 2877 CG GLU B 93 -10.300 -6.340 18.417 1.00 0.00 C ATOM 2878 CD GLU B 93 -11.250 -7.488 18.073 1.00 0.00 C ATOM 2879 OE1 GLU B 93 -12.216 -7.241 17.370 1.00 0.00 O ATOM 2880 OE2 GLU B 93 -10.995 -8.596 18.517 1.00 0.00 O ATOM 0 H GLU B 93 -11.413 -2.838 19.380 1.00 0.00 H new ATOM 0 HA GLU B 93 -9.728 -4.868 20.875 1.00 0.00 H new ATOM 0 HB2 GLU B 93 -11.756 -5.728 19.872 1.00 0.00 H new ATOM 0 HB3 GLU B 93 -11.630 -4.656 18.492 1.00 0.00 H new ATOM 0 HG2 GLU B 93 -9.877 -5.920 17.504 1.00 0.00 H new ATOM 0 HG3 GLU B 93 -9.467 -6.712 19.014 1.00 0.00 H new ATOM 2887 N ILE B 94 -8.100 -3.027 19.619 1.00 0.00 N ATOM 2888 CA ILE B 94 -6.766 -2.722 19.025 1.00 0.00 C ATOM 2889 C ILE B 94 -5.751 -3.793 19.417 1.00 0.00 C ATOM 2890 O ILE B 94 -4.863 -4.113 18.656 1.00 0.00 O ATOM 2891 CB ILE B 94 -6.357 -1.374 19.609 1.00 0.00 C ATOM 2892 CG1 ILE B 94 -7.236 -0.272 19.011 1.00 0.00 C ATOM 2893 CG2 ILE B 94 -4.885 -1.107 19.282 1.00 0.00 C ATOM 2894 CD1 ILE B 94 -6.888 -0.073 17.534 1.00 0.00 C ATOM 0 H ILE B 94 -8.400 -2.393 20.360 1.00 0.00 H new ATOM 0 HA ILE B 94 -6.807 -2.699 17.936 1.00 0.00 H new ATOM 0 HB ILE B 94 -6.487 -1.385 20.691 1.00 0.00 H new ATOM 0 HG12 ILE B 94 -8.288 -0.538 19.113 1.00 0.00 H new ATOM 0 HG13 ILE B 94 -7.088 0.660 19.557 1.00 0.00 H new ATOM 0 HG21 ILE B 94 -4.589 -0.144 19.698 1.00 0.00 H new ATOM 0 HG22 ILE B 94 -4.268 -1.894 19.714 1.00 0.00 H new ATOM 0 HG23 ILE B 94 -4.749 -1.092 18.201 1.00 0.00 H new ATOM 0 HD11 ILE B 94 -7.517 0.712 17.115 1.00 0.00 H new ATOM 0 HD12 ILE B 94 -5.840 0.213 17.442 1.00 0.00 H new ATOM 0 HD13 ILE B 94 -7.059 -1.003 16.992 1.00 0.00 H new ATOM 2906 N GLY B 95 -5.806 -4.243 20.647 1.00 0.00 N ATOM 2907 CA GLY B 95 -4.767 -5.183 21.170 1.00 0.00 C ATOM 2908 C GLY B 95 -4.323 -6.154 20.075 1.00 0.00 C ATOM 2909 O GLY B 95 -4.915 -7.196 19.874 1.00 0.00 O ATOM 0 H GLY B 95 -6.534 -3.996 21.317 1.00 0.00 H new ATOM 0 HA2 GLY B 95 -3.908 -4.619 21.534 1.00 0.00 H new ATOM 0 HA3 GLY B 95 -5.166 -5.740 22.018 1.00 0.00 H new ATOM 2913 N GLY B 96 -3.292 -5.808 19.354 1.00 0.00 N ATOM 2914 CA GLY B 96 -2.816 -6.697 18.257 1.00 0.00 C ATOM 2915 C GLY B 96 -2.161 -7.943 18.855 1.00 0.00 C ATOM 2916 O GLY B 96 -1.696 -7.933 19.977 1.00 0.00 O ATOM 0 H GLY B 96 -2.758 -4.947 19.477 1.00 0.00 H new ATOM 0 HA2 GLY B 96 -3.652 -6.984 17.619 1.00 0.00 H new ATOM 0 HA3 GLY B 96 -2.102 -6.165 17.628 1.00 0.00 H new ATOM 2920 N HIS B 97 -2.121 -9.016 18.114 1.00 7.43 N ATOM 2921 CA HIS B 97 -1.495 -10.262 18.640 1.00 8.18 C ATOM 2922 C HIS B 97 -2.112 -10.635 19.991 1.00 8.33 C ATOM 2923 O HIS B 97 -3.310 -10.864 20.030 1.00 8.37 O ATOM 2924 CB HIS B 97 -0.013 -9.922 18.804 1.00 9.04 C ATOM 2925 CG HIS B 97 0.760 -11.178 19.096 1.00 9.33 C ATOM 2926 ND1 HIS B 97 0.956 -12.165 18.142 1.00 9.57 N ATOM 2927 CD2 HIS B 97 1.390 -11.625 20.232 1.00 9.70 C ATOM 2928 CE1 HIS B 97 1.676 -13.146 18.715 1.00 10.04 C ATOM 2929 NE2 HIS B 97 1.968 -12.867 19.989 1.00 10.14 N ATOM 2930 OXT HIS B 97 -1.376 -10.685 20.962 1.00 8.68 O ATOM 0 H HIS B 97 -2.495 -9.084 17.167 1.00 7.43 H new ATOM 0 HA HIS B 97 -1.648 -11.113 17.976 1.00 8.18 H new ATOM 0 HB2 HIS B 97 0.366 -9.452 17.897 1.00 9.04 H new ATOM 0 HB3 HIS B 97 0.119 -9.204 19.614 1.00 9.04 H new ATOM 0 HD2 HIS B 97 1.430 -11.093 21.171 1.00 9.70 H new ATOM 0 HE1 HIS B 97 1.981 -14.049 18.207 1.00 10.04 H new ATOM 0 HE2 HIS B 97 2.500 -13.441 20.643 1.00 10.14 H new TER 2938 HIS B 97 HETATM 2939 N1 RBF A 98 -7.112 -7.170 -8.456 1.00 0.52 N HETATM 2940 C2 RBF A 98 -6.898 -6.854 -9.747 1.00 0.40 C HETATM 2941 O2 RBF A 98 -7.941 -6.655 -10.568 1.00 0.53 O HETATM 2942 N3 RBF A 98 -5.604 -6.738 -10.232 1.00 0.23 N HETATM 2943 C4 RBF A 98 -4.528 -6.951 -9.384 1.00 0.24 C HETATM 2944 O4 RBF A 98 -3.277 -6.840 -9.848 1.00 0.43 O HETATM 2945 C4A RBF A 98 -4.760 -7.283 -8.043 1.00 0.24 C HETATM 2946 N5 RBF A 98 -3.747 -7.499 -7.187 1.00 0.28 N HETATM 2947 C5A RBF A 98 -3.953 -7.815 -5.894 1.00 0.30 C HETATM 2948 C6 RBF A 98 -2.859 -8.032 -5.047 1.00 0.37 C HETATM 2949 C7 RBF A 98 -3.068 -8.361 -3.702 1.00 0.39 C HETATM 2950 C7M RBF A 98 -1.888 -8.598 -2.791 1.00 0.48 C HETATM 2951 C8 RBF A 98 -4.373 -8.471 -3.202 1.00 0.50 C HETATM 2952 C8M RBF A 98 -4.596 -8.831 -1.752 1.00 0.64 C HETATM 2953 C9 RBF A 98 -5.471 -8.256 -4.047 1.00 0.58 C HETATM 2954 C9A RBF A 98 -5.265 -7.928 -5.397 1.00 0.44 C HETATM 2955 N10 RBF A 98 -6.339 -7.709 -6.264 1.00 0.55 N HETATM 2956 C10 RBF A 98 -6.092 -7.384 -7.600 1.00 0.41 C HETATM 2957 C1' RBF A 98 -7.728 -7.814 -5.778 1.00 0.85 C HETATM 2958 C2' RBF A 98 -7.979 -9.209 -5.202 1.00 0.56 C HETATM 2959 O2' RBF A 98 -6.882 -10.067 -5.529 1.00 1.30 O HETATM 2960 C3' RBF A 98 -9.269 -9.780 -5.788 1.00 1.15 C HETATM 2961 O3' RBF A 98 -9.302 -9.538 -7.197 1.00 2.08 O HETATM 2962 C4' RBF A 98 -10.469 -9.105 -5.126 1.00 0.66 C HETATM 2963 O4' RBF A 98 -10.431 -9.344 -3.716 1.00 1.56 O HETATM 2964 C5' RBF A 98 -11.761 -9.678 -5.705 1.00 0.98 C HETATM 2965 O5' RBF A 98 -11.798 -11.090 -5.483 1.00 1.79 O HETATM 0 HO5' RBF A 98 -12.628 -11.458 -5.853 1.00 1.79 H new HETATM 0 HO4' RBF A 98 -10.904 -10.178 -3.513 1.00 1.56 H new HETATM 0 HO3' RBF A 98 -9.806 -10.252 -7.640 1.00 2.08 H new HETATM 0 HO2' RBF A 98 -7.043 -10.960 -5.158 1.00 1.30 H new HETATM 0 HC83 RBF A 98 -4.152 -9.805 -1.546 1.00 0.64 H new HETATM 0 HC82 RBF A 98 -4.132 -8.078 -1.115 1.00 0.64 H new HETATM 0 HC81 RBF A 98 -5.666 -8.870 -1.547 1.00 0.64 H new HETATM 0 HC73 RBF A 98 -1.292 -9.426 -3.175 1.00 0.48 H new HETATM 0 HC72 RBF A 98 -1.274 -7.698 -2.749 1.00 0.48 H new HETATM 0 HC71 RBF A 98 -2.244 -8.841 -1.790 1.00 0.48 H new HETATM 0 HC52 RBF A 98 -12.624 -9.203 -5.238 1.00 0.98 H new HETATM 0 HC51 RBF A 98 -11.819 -9.465 -6.772 1.00 0.98 H new HETATM 0 HC4' RBF A 98 -10.432 -8.032 -5.315 1.00 0.66 H new HETATM 0 HC3' RBF A 98 -9.308 -10.854 -5.604 1.00 1.15 H new HETATM 0 HC2' RBF A 98 -8.074 -9.141 -4.118 1.00 0.56 H new HETATM 0 HC12 RBF A 98 -7.913 -7.058 -5.015 1.00 0.85 H new HETATM 0 HC11 RBF A 98 -8.423 -7.619 -6.595 1.00 0.85 H new HETATM 0 HN3 RBF A 98 -5.444 -6.497 -11.210 1.00 0.23 H new HETATM 0 HC9 RBF A 98 -6.485 -8.343 -3.656 1.00 0.58 H new HETATM 0 HC6 RBF A 98 -1.844 -7.945 -5.435 1.00 0.37 H new HETATM 2986 N1 RBF B 99 -6.758 14.907 2.249 1.00 0.71 N HETATM 2987 C2 RBF B 99 -7.895 15.459 1.784 1.00 0.58 C HETATM 2988 O2 RBF B 99 -7.867 16.211 0.674 1.00 0.69 O HETATM 2989 N3 RBF B 99 -9.093 15.255 2.452 1.00 0.51 N HETATM 2990 C4 RBF B 99 -9.119 14.483 3.603 1.00 0.64 C HETATM 2991 O4 RBF B 99 -10.273 14.284 4.252 1.00 0.81 O HETATM 2992 C4A RBF B 99 -7.931 13.916 4.082 1.00 0.74 C HETATM 2993 N5 RBF B 99 -7.909 13.162 5.195 1.00 0.95 N HETATM 2994 C5A RBF B 99 -6.777 12.607 5.665 1.00 1.11 C HETATM 2995 C6 RBF B 99 -6.813 11.832 6.832 1.00 1.35 C HETATM 2996 C7 RBF B 99 -5.637 11.253 7.325 1.00 1.54 C HETATM 2997 C7M RBF B 99 -5.677 10.421 8.584 1.00 1.81 C HETATM 2998 C8 RBF B 99 -4.423 11.446 6.651 1.00 1.53 C HETATM 2999 C8M RBF B 99 -3.156 10.825 7.188 1.00 1.78 C HETATM 3000 C9 RBF B 99 -4.383 12.222 5.483 1.00 1.35 C HETATM 3001 C9A RBF B 99 -5.559 12.806 4.987 1.00 1.11 C HETATM 3002 N10 RBF B 99 -5.551 13.586 3.827 1.00 0.97 N HETATM 3003 C10 RBF B 99 -6.742 14.149 3.365 1.00 0.76 C HETATM 3004 C1' RBF B 99 -4.295 13.813 3.087 1.00 1.14 C HETATM 3005 C2' RBF B 99 -3.260 14.474 4.000 1.00 1.69 C HETATM 3006 O2' RBF B 99 -3.889 14.897 5.212 1.00 2.49 O HETATM 3007 C3' RBF B 99 -2.647 15.681 3.291 1.00 2.03 C HETATM 3008 O3' RBF B 99 -3.683 16.443 2.666 1.00 2.48 O HETATM 3009 C4' RBF B 99 -1.658 15.199 2.232 1.00 2.43 C HETATM 3010 O4' RBF B 99 -0.625 14.433 2.858 1.00 2.87 O HETATM 3011 C5' RBF B 99 -1.039 16.404 1.525 1.00 3.24 C HETATM 3012 O5' RBF B 99 -0.379 17.233 2.485 1.00 3.76 O HETATM 0 HO5' RBF B 99 0.020 18.005 2.032 1.00 3.76 H new HETATM 0 HO4' RBF B 99 0.109 15.027 3.120 1.00 2.87 H new HETATM 0 HO3' RBF B 99 -3.362 17.353 2.495 1.00 2.48 H new HETATM 0 HO2' RBF B 99 -3.224 15.319 5.796 1.00 2.49 H new HETATM 0 HC83 RBF B 99 -2.963 11.203 8.192 1.00 1.78 H new HETATM 0 HC82 RBF B 99 -3.269 9.741 7.223 1.00 1.78 H new HETATM 0 HC81 RBF B 99 -2.321 11.082 6.537 1.00 1.78 H new HETATM 0 HC73 RBF B 99 -6.038 11.031 9.412 1.00 1.81 H new HETATM 0 HC72 RBF B 99 -6.347 9.574 8.439 1.00 1.81 H new HETATM 0 HC71 RBF B 99 -4.675 10.056 8.811 1.00 1.81 H new HETATM 0 HC52 RBF B 99 -0.329 16.070 0.768 1.00 3.24 H new HETATM 0 HC51 RBF B 99 -1.812 16.973 1.008 1.00 3.24 H new HETATM 0 HC4' RBF B 99 -2.181 14.579 1.503 1.00 2.43 H new HETATM 0 HC3' RBF B 99 -2.126 16.305 4.017 1.00 2.03 H new HETATM 0 HC2' RBF B 99 -2.474 13.756 4.234 1.00 1.69 H new HETATM 0 HC12 RBF B 99 -3.908 12.865 2.712 1.00 1.14 H new HETATM 0 HC11 RBF B 99 -4.484 14.446 2.220 1.00 1.14 H new HETATM 0 HN3 RBF B 99 -9.953 15.672 2.097 1.00 0.51 H new HETATM 0 HC9 RBF B 99 -3.438 12.371 4.960 1.00 1.35 H new HETATM 0 HC6 RBF B 99 -7.757 11.680 7.356 1.00 1.35 H new CONECT 2939 2940 2956 CONECT 2940 2939 2941 2942 CONECT 2941 2940 CONECT 2942 2940 2943 2966 CONECT 2943 2942 2944 2945 CONECT 2944 2943 CONECT 2945 2943 2946 2956 CONECT 2946 2945 2947 CONECT 2947 2946 2948 2954 CONECT 2948 2947 2949 2967 CONECT 2949 2948 2950 2951 CONECT 2950 2949 2968 2969 2970 CONECT 2951 2949 2952 2953 CONECT 2952 2951 2971 2972 2973 CONECT 2953 2951 2954 2974 CONECT 2954 2947 2953 2955 CONECT 2955 2954 2956 2957 CONECT 2956 2939 2945 2955 CONECT 2957 2955 2958 2975 2976 CONECT 2958 2957 2959 2960 2977 CONECT 2959 2958 2978 CONECT 2960 2958 2961 2962 2979 CONECT 2961 2960 2980 CONECT 2962 2960 2963 2964 2981 CONECT 2963 2962 2982 CONECT 2964 2962 2965 2983 2984 CONECT 2965 2964 2985 CONECT 2966 2942 CONECT 2967 2948 CONECT 2968 2950 CONECT 2969 2950 CONECT 2970 2950 CONECT 2971 2952 CONECT 2972 2952 CONECT 2973 2952 CONECT 2974 2953 CONECT 2975 2957 CONECT 2976 2957 CONECT 2977 2958 CONECT 2978 2959 CONECT 2979 2960 CONECT 2980 2961 CONECT 2981 2962 CONECT 2982 2963 CONECT 2983 2964 CONECT 2984 2964 CONECT 2985 2965 CONECT 2986 2987 3003 CONECT 2987 2986 2988 2989 CONECT 2988 2987 CONECT 2989 2987 2990 3013 CONECT 2990 2989 2991 2992 CONECT 2991 2990 CONECT 2992 2990 2993 3003 CONECT 2993 2992 2994 CONECT 2994 2993 2995 3001 CONECT 2995 2994 2996 3014 CONECT 2996 2995 2997 2998 CONECT 2997 2996 3015 3016 3017 CONECT 2998 2996 2999 3000 CONECT 2999 2998 3018 3019 3020 CONECT 3000 2998 3001 3021 CONECT 3001 2994 3000 3002 CONECT 3002 3001 3003 3004 CONECT 3003 2986 2992 3002 CONECT 3004 3002 3005 3022 3023 CONECT 3005 3004 3006 3007 3024 CONECT 3006 3005 3025 CONECT 3007 3005 3008 3009 3026 CONECT 3008 3007 3027 CONECT 3009 3007 3010 3011 3028 CONECT 3010 3009 3029 CONECT 3011 3009 3012 3030 3031 CONECT 3012 3011 3032 CONECT 3013 2989 CONECT 3014 2995 CONECT 3015 2997 CONECT 3016 2997 CONECT 3017 2997 CONECT 3018 2999 CONECT 3019 2999 CONECT 3020 2999 CONECT 3021 3000 CONECT 3022 3004 CONECT 3023 3004 CONECT 3024 3005 CONECT 3025 3006 CONECT 3026 3007 CONECT 3027 3008 CONECT 3028 3009 CONECT 3029 3010 CONECT 3030 3011 CONECT 3031 3011 CONECT 3032 3012 END