USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1316 hydrogens (6 hets) HEADER TRANSFERASE/CELL CYCLE 22-OCT-01 1J4Q TITLE NMR STRUCTURE OF THE FHA1 DOMAIN OF RAD53 IN COMPLEX WITH A TITLE 2 RAD9-DERIVED PHOSPHOTHREONINE (AT T192) PEPTIDE COMPND MOL_ID: 1; COMPND 2 MOLECULE: PROTEIN KINASE SPK1; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: N-TERMINAL FHA DOMAIN (FHA1); COMPND 5 EC: 2.7.1.-; COMPND 6 ENGINEERED: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: DNA REPAIR PROTEIN RAD9; COMPND 9 CHAIN: B; COMPND 0 FRAGMENT: RESIDUES 188-200; COMPND 1 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; SOURCE 3 ORGANISM_COMMON: BAKER'S YEAST; SOURCE 4 ORGANISM_TAXID: 4932; SOURCE 5 GENE: SPK1 OR RAD53; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: PGEX-4T; SOURCE 1 MOL_ID: 2; SOURCE 2 SYNTHETIC: YES; SOURCE 3 OTHER_DETAILS: THIS PHOSPHOTHREONINE PEPTIDE WAS SOURCE 4 CHEMICALLY SYNTHESIZED. KEYWDS FHA DOMAIN, RAD53, RAD9, PHOSPHOTHREONINE, PHOSPHOPROTEIN, KEYWDS 2 NMR, TRANSFERASE/CELL CYCLE COMPLEX EXPDTA SOLUTION NMR AUTHOR C.YUAN,S.YONGKIETTRAKUL,I.-J.L.BYEON,S.ZHOU,M.-D.TSAI REVDAT 3 24-FEB-09 1J4Q 1 VERSN REVDAT 2 01-APR-03 1J4Q 1 JRNL REVDAT 1 05-DEC-01 1J4Q 0 JRNL AUTH C.YUAN,S.YONGKIETTRAKUL,I.J.BYEON,S.ZHOU,M.D.TSAI JRNL TITL SOLUTION STRUCTURES OF TWO FHA1-PHOSPHOTHREONINE JRNL TITL 2 PEPTIDE COMPLEXES PROVIDE INSIGHT INTO THE JRNL TITL 3 STRUCTURAL BASIS OF THE LIGAND SPECIFICITY OF FHA1 JRNL TITL 4 FROM YEAST RAD53. JRNL REF J.MOL.BIOL. V. 314 563 2001 JRNL REFN ISSN 0022-2836 JRNL PMID 11846567 JRNL DOI 10.1006/JMBI.2001.5140 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH H.LIAO,C.YUAN,M.I.SU,S.YONGKIETTRAKUL,D.QIN,H.LI, REMARK 1 AUTH 2 I.J.BYEON,D.PEI,M.D.TSAI REMARK 1 TITL STRUCTURE OF THE FHA1 DOMAIN OF YEAST RAD53 AND REMARK 1 TITL 2 IDENTIFICATION OF BINDING SITES FOR BOTH FHA1 AND REMARK 1 TITL 3 ITS TARGET PROTEIN RAD9. REMARK 1 REF J.MOL.BIOL. V. 304 941 2000 REMARK 1 REFN ISSN 0022-2836 REMARK 1 DOI 10.1006/JMBI.2000.4291 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.0 REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU,READ, REMARK 3 RICE,SIMONSON,WARREN REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1J4Q COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 22-OCT-01. REMARK 100 THE RCSB ID CODE IS RCSB001610. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 293.00 REMARK 210 PH : 6.50 REMARK 210 IONIC STRENGTH : 10 MM SODIUM PHOSPHATE, 1 MM REMARK 210 DTT, AND 1 MM EDTA REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 0.5 MM FHA1 U-15N,13C 10 MM REMARK 210 SODIUM PHOSPHATE BUFFER (PH REMARK 210 6.5), 1 MM DTT, AND 1 MM EDTA; REMARK 210 90% H2O, 10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_13C-SEPARATED_NOESY, 3D_ REMARK 210 15N-SEPARATED_NOESY, 2D_13C/ REMARK 210 15N-FILTERED_NOESY, 3D_13C - REMARK 210 EDITED_13C/15N-FILTERED_NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ REMARK 210 SPECTROMETER MODEL : DRX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : XWINNMR 2.6, CNS 1.0 REMARK 210 METHOD USED : THE COMPLEX STRUCTURE ARE REMARK 210 GENERATED USING A TOTAL OF REMARK 210 2474 RESTRAINTS. AMONG THEM, 3 REMARK 210 ARTIFICIAL CONSTRAINTS, 192 REMARK 210 TALOS- DERIVED DIHEDRAL ANGLE REMARK 210 RESTRAINTS, 78 H-BOND REMARK 210 RESTRAINTS, 22 INTERMOLECULAR REMARK 210 DISTANCE CONSTRAINS, AND 2179 REMARK 210 INTRA-FHA1 AND INTRA- PEPTIDE REMARK 210 DISTANCE CONSTRAINTS 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: THE STRUCTURE WAS DETERMINED USING TRIPLE- RESONANCE REMARK 210 NMR SPECTROSCOPY REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 PHE B 175 CD1 - CG - CD2 ANGL. DEV. = -49.5 DEGREES REMARK 500 PHE B 175 CB - CG - CD1 ANGL. DEV. = 11.8 DEGREES REMARK 500 PHE B 175 CG - CD1 - CE1 ANGL. DEV. = -66.3 DEGREES REMARK 500 PHE B 175 CG - CD2 - CE2 ANGL. DEV. = -46.9 DEGREES REMARK 500 PHE B 175 CD1 - CE1 - CZ ANGL. DEV. = -48.2 DEGREES REMARK 500 PHE B 175 CE1 - CZ - CE2 ANGL. DEV. = -50.3 DEGREES REMARK 500 PHE B 175 CZ - CE2 - CD2 ANGL. DEV. = -69.9 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 GLN A 25 88.89 179.15 REMARK 500 ASN A 31 32.94 -177.19 REMARK 500 GLN A 42 -42.57 -145.38 REMARK 500 LYS A 59 46.54 -94.04 REMARK 500 ARG A 60 -169.98 -101.69 REMARK 500 LYS A 63 -78.44 -103.49 REMARK 500 ASN A 80 78.17 175.11 REMARK 500 GLU A 95 -76.25 66.30 REMARK 500 ASP A 96 -68.01 -158.38 REMARK 500 ILE A 104 38.69 -150.26 REMARK 500 ASN A 119 34.66 33.89 REMARK 500 ASP A 128 163.50 -48.71 REMARK 500 ASN A 158 -91.44 43.67 REMARK 500 ARG A 162 100.23 56.68 REMARK 500 LEU B 166 -173.76 44.33 REMARK 500 GLU B 167 39.79 -154.47 REMARK 500 THR B 174 48.40 -104.68 REMARK 500 VAL B 176 76.63 40.91 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 PHE B 175 0.41 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL DBREF 1J4Q A 14 164 UNP P22216 RAD53_YEAST 14 164 DBREF 1J4Q B 165 177 UNP P14737 RAD9_YEAST 188 200 SEQADV 1J4Q TPO B 169 UNP P14737 THR 192 MODIFIED RESIDUE SEQRES 1 A 151 ALA THR GLN ARG PHE LEU ILE GLU LYS PHE SER GLN GLU SEQRES 2 A 151 GLN ILE GLY GLU ASN ILE VAL CYS ARG VAL ILE CYS THR SEQRES 3 A 151 THR GLY GLN ILE PRO ILE ARG ASP LEU SER ALA ASP ILE SEQRES 4 A 151 SER GLN VAL LEU LYS GLU LYS ARG SER ILE LYS LYS VAL SEQRES 5 A 151 TRP THR PHE GLY ARG ASN PRO ALA CYS ASP TYR HIS LEU SEQRES 6 A 151 GLY ASN ILE SER ARG LEU SER ASN LYS HIS PHE GLN ILE SEQRES 7 A 151 LEU LEU GLY GLU ASP GLY ASN LEU LEU LEU ASN ASP ILE SEQRES 8 A 151 SER THR ASN GLY THR TRP LEU ASN GLY GLN LYS VAL GLU SEQRES 9 A 151 LYS ASN SER ASN GLN LEU LEU SER GLN GLY ASP GLU ILE SEQRES 10 A 151 THR VAL GLY VAL GLY VAL GLU SER ASP ILE LEU SER LEU SEQRES 11 A 151 VAL ILE PHE ILE ASN ASP LYS PHE LYS GLN CYS LEU GLU SEQRES 12 A 151 GLN ASN LYS VAL ASP ARG ILE ARG SEQRES 1 B 13 SER LEU GLU VAL TPO GLU ALA ASP ALA THR PHE VAL GLN MODRES 1J4Q TPO B 169 THR PHOSPHOTHREONINE HET TPO B 169 17 HETNAM TPO PHOSPHOTHREONINE HETSYN TPO PHOSPHONOTHREONINE FORMUL 2 TPO C4 H10 N O6 P HELIX 1 1 THR A 15 GLU A 26 1 12 HELIX 2 2 ASP A 51 GLU A 58 1 8 HELIX 3 3 ASN A 148 ASN A 158 1 11 SHEET 1 A 6 ARG A 46 SER A 49 0 SHEET 2 A 6 ILE A 32 CYS A 38 -1 N CYS A 34 O LEU A 48 SHEET 3 A 6 LEU A 141 ILE A 147 -1 O PHE A 146 N ARG A 35 SHEET 4 A 6 GLU A 129 VAL A 132 -1 N VAL A 132 O LEU A 141 SHEET 5 A 6 THR A 109 LEU A 111 -1 N TRP A 110 O THR A 131 SHEET 6 A 6 GLN A 114 LYS A 115 -1 O GLN A 114 N LEU A 111 SHEET 1 B 5 TYR A 76 HIS A 77 0 SHEET 2 B 5 ILE A 62 GLY A 69 1 N GLY A 69 O TYR A 76 SHEET 3 B 5 PHE A 89 GLY A 94 -1 O PHE A 89 N PHE A 68 SHEET 4 B 5 ASN A 98 ASP A 103 -1 O ASN A 102 N GLN A 90 SHEET 5 B 5 ASN A 121 LEU A 123 -1 O GLN A 122 N LEU A 101 LINK C VAL B 168 N TPO B 169 1555 1555 1.33 LINK C TPO B 169 N GLU B 170 1555 1555 1.33 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 NoAdj-H: B 169 TPO H2 : B 169 TPO N : B 168 VAL C :(H bumps) USER MOD Set 1.1: A 27 GLN :FLIP amide:sc= -0.0501 F(o=-0.95,f=-0.05) USER MOD Set 1.2: A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 88 HIS : no HD1:sc= -15.3! C(o=-17!,f=-21!) USER MOD Set 2.2: A 105 SER OG : rot -57:sc= -0.763! USER MOD Set 2.3: A 109 THR OG1 : rot -20:sc= -0.975! USER MOD Set 3.1: A 71 ASN : amide:sc= -3.38! C(o=-3.7!,f=-7.1!) USER MOD Set 3.2: A 86 ASN : amide:sc= -0.301 K(o=-3.7,f=-15!) USER MOD Set 4.1: A 67 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 90 GLN : amide:sc= -1.01 K(o=-1,f=-1.7) USER MOD Set 5.1: A 38 CYS SG : rot 36:sc= -0.849! USER MOD Set 5.2: A 40 THR OG1 : rot -2:sc= 0.666 USER MOD Single : A 15 THR OG1 : rot 180:sc= -0.398 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 LYS NZ :NH3+ -153:sc= -0.458 (180deg=-1.45!) USER MOD Single : A 24 SER OG : rot -20:sc= 1.15 USER MOD Single : A 25 GLN :FLIP amide:sc= -0.613 F(o=-1.4,f=-0.61) USER MOD Single : A 31 ASN : amide:sc= -2.62 K(o=-2.6,f=-11!) USER MOD Single : A 34 CYS SG : rot -170:sc= -3.26! USER MOD Single : A 39 THR OG1 : rot -174:sc= 0.0775 USER MOD Single : A 42 GLN :FLIP amide:sc= -0.197 F(o=-0.75,f=-0.2) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= -0.119 K(o=-0.12,f=-2!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ -165:sc= -0.128 (180deg=-0.417) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -154:sc= 0.00299 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 157:sc= 0.337 (180deg=0.0719) USER MOD Single : A 74 CYS SG : rot 20:sc= -7.45 USER MOD Single : A 76 TYR OH : rot -55:sc= 0.263 USER MOD Single : A 77 HIS :FLIP no HD1:sc= -0.0266 F(o=-0.78,f=-0.027) USER MOD Single : A 80 ASN :FLIP amide:sc= 0.602 F(o=-1.2,f=0.6) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 120:sc= -2.28 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc=-0.00474 K(o=-0.0047,f=-0.57) USER MOD Single : A 102 ASN : amide:sc= -1.68 K(o=-1.7,f=-8.4!) USER MOD Single : A 106 THR OG1 : rot 176:sc= 0.279 USER MOD Single : A 107 ASN : amide:sc= -1.52 K(o=-1.5,f=-9.2!) USER MOD Single : A 112 ASN : amide:sc=-0.00836 X(o=-0.0084,f=-0.2) USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 115 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.147) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -3.08! C(o=-3.1!,f=-6.5!) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 ASN :FLIP amide:sc= -0.241 F(o=-1.9,f=-0.24) USER MOD Single : A 122 GLN : amide:sc= -0.488 X(o=-0.49,f=-0.061) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 141:sc= -0.348 USER MOD Single : A 148 ASN : amide:sc= -7.22! C(o=-7.2!,f=-8.6!) USER MOD Single : A 152 LYS NZ :NH3+ 159:sc= -0.0186 (180deg=-0.213) USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 154 CYS SG : rot -80:sc= -4.66! USER MOD Single : A 157 GLN : amide:sc=-0.00744 K(o=-0.0074,f=-1.2) USER MOD Single : A 158 ASN : amide:sc= -3.36! C(o=-3.4!,f=-4!) USER MOD Single : A 159 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0367) USER MOD Single : B 165 SER OG : rot 180:sc= 0 USER MOD Single : B 174 THR OG1 : rot 47:sc= 0.19 USER MOD Single : B 177 GLN : amide:sc= -0.017 K(o=-0.017,f=-0.83) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 14 -15.967 29.221 -33.935 1.00 9.96 N ATOM 2 CA ALA A 14 -16.749 27.991 -33.859 1.00 9.50 C ATOM 3 C ALA A 14 -15.846 26.764 -33.945 1.00 9.22 C ATOM 4 O ALA A 14 -16.250 25.717 -34.453 1.00 9.20 O ATOM 5 CB ALA A 14 -17.797 27.956 -34.963 1.00 9.59 C ATOM 0 HA ALA A 14 -17.257 27.973 -32.895 1.00 9.50 H new ATOM 0 HB1 ALA A 14 -18.371 27.032 -34.891 1.00 9.59 H new ATOM 0 HB2 ALA A 14 -18.467 28.809 -34.855 1.00 9.59 H new ATOM 0 HB3 ALA A 14 -17.304 28.002 -35.934 1.00 9.59 H new ATOM 11 N THR A 15 -14.623 26.903 -33.444 1.00 9.27 N ATOM 12 CA THR A 15 -13.655 25.809 -33.460 1.00 9.29 C ATOM 13 C THR A 15 -13.249 25.447 -34.888 1.00 8.96 C ATOM 14 O THR A 15 -12.650 24.398 -35.123 1.00 8.47 O ATOM 15 CB THR A 15 -14.230 24.578 -32.755 1.00 10.31 C ATOM 16 OG1 THR A 15 -15.299 24.944 -31.900 1.00 10.84 O ATOM 17 CG2 THR A 15 -13.209 23.834 -31.922 1.00 10.75 C ATOM 0 H THR A 15 -14.277 27.764 -33.021 1.00 9.27 H new ATOM 0 HA THR A 15 -12.766 26.145 -32.927 1.00 9.29 H new ATOM 0 HB THR A 15 -14.571 23.920 -33.554 1.00 10.31 H new ATOM 0 HG1 THR A 15 -15.654 24.144 -31.460 1.00 10.84 H new ATOM 0 HG21 THR A 15 -13.682 22.973 -31.450 1.00 10.75 H new ATOM 0 HG22 THR A 15 -12.395 23.495 -32.562 1.00 10.75 H new ATOM 0 HG23 THR A 15 -12.814 24.498 -31.153 1.00 10.75 H new ATOM 25 N GLN A 16 -13.575 26.318 -35.840 1.00 9.43 N ATOM 26 CA GLN A 16 -13.238 26.081 -37.238 1.00 9.50 C ATOM 27 C GLN A 16 -11.742 26.258 -37.477 1.00 8.62 C ATOM 28 O GLN A 16 -11.103 25.424 -38.117 1.00 8.49 O ATOM 29 CB GLN A 16 -14.027 27.024 -38.146 1.00 10.42 C ATOM 30 CG GLN A 16 -14.412 26.405 -39.480 1.00 11.27 C ATOM 31 CD GLN A 16 -13.669 27.024 -40.648 1.00 11.88 C ATOM 32 OE1 GLN A 16 -12.572 26.591 -41.001 1.00 11.96 O ATOM 33 NE2 GLN A 16 -14.266 28.045 -41.253 1.00 12.49 N ATOM 0 H GLN A 16 -14.071 27.192 -35.668 1.00 9.43 H new ATOM 0 HA GLN A 16 -13.506 25.052 -37.478 1.00 9.50 H new ATOM 0 HB2 GLN A 16 -14.932 27.341 -37.628 1.00 10.42 H new ATOM 0 HB3 GLN A 16 -13.434 27.920 -38.329 1.00 10.42 H new ATOM 0 HG2 GLN A 16 -14.209 25.335 -39.451 1.00 11.27 H new ATOM 0 HG3 GLN A 16 -15.485 26.522 -39.634 1.00 11.27 H new ATOM 0 HE21 GLN A 16 -15.176 28.370 -40.926 1.00 12.49 H new ATOM 0 HE22 GLN A 16 -13.815 28.504 -42.044 1.00 12.49 H new ATOM 42 N ARG A 17 -11.189 27.353 -36.960 1.00 8.23 N ATOM 43 CA ARG A 17 -9.767 27.641 -37.119 1.00 7.65 C ATOM 44 C ARG A 17 -8.918 26.628 -36.360 1.00 6.85 C ATOM 45 O ARG A 17 -8.011 26.018 -36.927 1.00 6.63 O ATOM 46 CB ARG A 17 -9.455 29.056 -36.629 1.00 7.77 C ATOM 47 CG ARG A 17 -8.084 29.558 -37.050 1.00 8.05 C ATOM 48 CD ARG A 17 -8.011 29.783 -38.552 1.00 8.39 C ATOM 49 NE ARG A 17 -7.206 30.955 -38.891 1.00 9.06 N ATOM 50 CZ ARG A 17 -7.246 31.563 -40.074 1.00 9.70 C ATOM 51 NH1 ARG A 17 -8.049 31.115 -41.031 1.00 9.79 N ATOM 52 NH2 ARG A 17 -6.481 32.623 -40.300 1.00 10.44 N ATOM 0 H ARG A 17 -11.704 28.054 -36.428 1.00 8.23 H new ATOM 0 HA ARG A 17 -9.523 27.569 -38.179 1.00 7.65 H new ATOM 0 HB2 ARG A 17 -10.215 29.739 -37.009 1.00 7.77 H new ATOM 0 HB3 ARG A 17 -9.522 29.078 -35.541 1.00 7.77 H new ATOM 0 HG2 ARG A 17 -7.861 30.490 -36.530 1.00 8.05 H new ATOM 0 HG3 ARG A 17 -7.324 28.836 -36.752 1.00 8.05 H new ATOM 0 HD2 ARG A 17 -7.586 28.901 -39.031 1.00 8.39 H new ATOM 0 HD3 ARG A 17 -9.018 29.908 -38.949 1.00 8.39 H new ATOM 0 HE ARG A 17 -6.577 31.328 -38.180 1.00 9.06 H new ATOM 0 HH11 ARG A 17 -8.640 30.301 -40.862 1.00 9.79 H new ATOM 0 HH12 ARG A 17 -8.076 31.585 -41.936 1.00 9.79 H new ATOM 0 HH21 ARG A 17 -5.863 32.971 -39.567 1.00 10.44 H new ATOM 0 HH22 ARG A 17 -6.511 33.090 -41.206 1.00 10.44 H new ATOM 66 N PHE A 18 -9.218 26.447 -35.078 1.00 6.68 N ATOM 67 CA PHE A 18 -8.481 25.498 -34.251 1.00 6.16 C ATOM 68 C PHE A 18 -8.550 24.103 -34.860 1.00 6.23 C ATOM 69 O PHE A 18 -7.586 23.340 -34.801 1.00 5.92 O ATOM 70 CB PHE A 18 -9.041 25.482 -32.826 1.00 6.53 C ATOM 71 CG PHE A 18 -8.035 25.871 -31.781 1.00 6.46 C ATOM 72 CD1 PHE A 18 -6.776 25.292 -31.762 1.00 6.66 C ATOM 73 CD2 PHE A 18 -8.347 26.817 -30.818 1.00 6.62 C ATOM 74 CE1 PHE A 18 -5.848 25.648 -30.802 1.00 6.99 C ATOM 75 CE2 PHE A 18 -7.423 27.178 -29.855 1.00 6.96 C ATOM 76 CZ PHE A 18 -6.172 26.592 -29.847 1.00 7.13 C ATOM 0 H PHE A 18 -9.964 26.943 -34.590 1.00 6.68 H new ATOM 0 HA PHE A 18 -7.438 25.812 -34.210 1.00 6.16 H new ATOM 0 HB2 PHE A 18 -9.891 26.162 -32.771 1.00 6.53 H new ATOM 0 HB3 PHE A 18 -9.416 24.483 -32.603 1.00 6.53 H new ATOM 0 HD1 PHE A 18 -6.517 24.554 -32.506 1.00 6.66 H new ATOM 0 HD2 PHE A 18 -9.324 27.278 -30.820 1.00 6.62 H new ATOM 0 HE1 PHE A 18 -4.871 25.189 -30.798 1.00 6.99 H new ATOM 0 HE2 PHE A 18 -7.679 27.917 -29.110 1.00 6.96 H new ATOM 0 HZ PHE A 18 -5.449 26.871 -29.095 1.00 7.13 H new ATOM 86 N LEU A 19 -9.692 23.784 -35.461 1.00 6.97 N ATOM 87 CA LEU A 19 -9.881 22.487 -36.097 1.00 7.49 C ATOM 88 C LEU A 19 -8.822 22.274 -37.171 1.00 7.44 C ATOM 89 O LEU A 19 -8.340 21.160 -37.372 1.00 7.70 O ATOM 90 CB LEU A 19 -11.280 22.391 -36.710 1.00 8.56 C ATOM 91 CG LEU A 19 -12.306 21.637 -35.864 1.00 9.25 C ATOM 92 CD1 LEU A 19 -13.651 21.590 -36.572 1.00 10.01 C ATOM 93 CD2 LEU A 19 -11.814 20.230 -35.557 1.00 9.67 C ATOM 0 H LEU A 19 -10.499 24.405 -35.520 1.00 6.97 H new ATOM 0 HA LEU A 19 -9.780 21.709 -35.340 1.00 7.49 H new ATOM 0 HB2 LEU A 19 -11.651 23.400 -36.890 1.00 8.56 H new ATOM 0 HB3 LEU A 19 -11.202 21.902 -37.681 1.00 8.56 H new ATOM 0 HG LEU A 19 -12.433 22.170 -34.922 1.00 9.25 H new ATOM 0 HD11 LEU A 19 -14.368 21.049 -35.955 1.00 10.01 H new ATOM 0 HD12 LEU A 19 -14.009 22.606 -36.740 1.00 10.01 H new ATOM 0 HD13 LEU A 19 -13.540 21.081 -37.530 1.00 10.01 H new ATOM 0 HD21 LEU A 19 -12.557 19.708 -34.954 1.00 9.67 H new ATOM 0 HD22 LEU A 19 -11.658 19.688 -36.489 1.00 9.67 H new ATOM 0 HD23 LEU A 19 -10.874 20.285 -35.007 1.00 9.67 H new ATOM 105 N ILE A 20 -8.455 23.359 -37.848 1.00 7.41 N ATOM 106 CA ILE A 20 -7.440 23.300 -38.891 1.00 7.75 C ATOM 107 C ILE A 20 -6.096 22.908 -38.293 1.00 7.22 C ATOM 108 O ILE A 20 -5.408 22.021 -38.798 1.00 7.73 O ATOM 109 CB ILE A 20 -7.285 24.652 -39.620 1.00 8.18 C ATOM 110 CG1 ILE A 20 -8.655 25.290 -39.879 1.00 8.69 C ATOM 111 CG2 ILE A 20 -6.523 24.460 -40.923 1.00 9.07 C ATOM 112 CD1 ILE A 20 -8.607 26.489 -40.802 1.00 9.26 C ATOM 0 H ILE A 20 -8.846 24.288 -37.692 1.00 7.41 H new ATOM 0 HA ILE A 20 -7.765 22.552 -39.614 1.00 7.75 H new ATOM 0 HB ILE A 20 -6.716 25.328 -38.982 1.00 8.18 H new ATOM 0 HG12 ILE A 20 -9.319 24.540 -40.308 1.00 8.69 H new ATOM 0 HG13 ILE A 20 -9.090 25.594 -38.927 1.00 8.69 H new ATOM 0 HG21 ILE A 20 -6.420 25.420 -41.429 1.00 9.07 H new ATOM 0 HG22 ILE A 20 -5.534 24.054 -40.710 1.00 9.07 H new ATOM 0 HG23 ILE A 20 -7.069 23.769 -41.565 1.00 9.07 H new ATOM 0 HD11 ILE A 20 -9.614 26.885 -40.937 1.00 9.26 H new ATOM 0 HD12 ILE A 20 -7.970 27.258 -40.366 1.00 9.26 H new ATOM 0 HD13 ILE A 20 -8.203 26.188 -41.769 1.00 9.26 H new ATOM 124 N GLU A 21 -5.737 23.583 -37.207 1.00 6.46 N ATOM 125 CA GLU A 21 -4.487 23.328 -36.517 1.00 6.24 C ATOM 126 C GLU A 21 -4.512 21.971 -35.820 1.00 6.41 C ATOM 127 O GLU A 21 -3.485 21.301 -35.704 1.00 6.87 O ATOM 128 CB GLU A 21 -4.220 24.437 -35.494 1.00 5.71 C ATOM 129 CG GLU A 21 -2.825 25.032 -35.592 1.00 6.06 C ATOM 130 CD GLU A 21 -2.610 26.173 -34.616 1.00 6.37 C ATOM 131 OE1 GLU A 21 -2.348 25.896 -33.427 1.00 6.70 O ATOM 132 OE2 GLU A 21 -2.701 27.343 -35.042 1.00 6.63 O ATOM 0 H GLU A 21 -6.304 24.318 -36.785 1.00 6.46 H new ATOM 0 HA GLU A 21 -3.686 23.316 -37.256 1.00 6.24 H new ATOM 0 HB2 GLU A 21 -4.955 25.230 -35.631 1.00 5.71 H new ATOM 0 HB3 GLU A 21 -4.366 24.037 -34.491 1.00 5.71 H new ATOM 0 HG2 GLU A 21 -2.087 24.252 -35.403 1.00 6.06 H new ATOM 0 HG3 GLU A 21 -2.657 25.390 -36.608 1.00 6.06 H new ATOM 139 N LYS A 22 -5.690 21.580 -35.344 1.00 6.38 N ATOM 140 CA LYS A 22 -5.853 20.313 -34.638 1.00 6.84 C ATOM 141 C LYS A 22 -5.582 19.114 -35.545 1.00 7.74 C ATOM 142 O LYS A 22 -4.874 18.185 -35.154 1.00 8.31 O ATOM 143 CB LYS A 22 -7.264 20.214 -34.057 1.00 7.05 C ATOM 144 CG LYS A 22 -7.483 21.097 -32.839 1.00 7.00 C ATOM 145 CD LYS A 22 -6.803 20.525 -31.606 1.00 7.38 C ATOM 146 CE LYS A 22 -7.726 19.591 -30.843 1.00 7.80 C ATOM 147 NZ LYS A 22 -9.047 20.220 -30.563 1.00 8.20 N ATOM 0 H LYS A 22 -6.548 22.124 -35.435 1.00 6.38 H new ATOM 0 HA LYS A 22 -5.120 20.292 -33.831 1.00 6.84 H new ATOM 0 HB2 LYS A 22 -7.985 20.486 -34.827 1.00 7.05 H new ATOM 0 HB3 LYS A 22 -7.464 19.178 -33.785 1.00 7.05 H new ATOM 0 HG2 LYS A 22 -7.096 22.096 -33.039 1.00 7.00 H new ATOM 0 HG3 LYS A 22 -8.552 21.201 -32.651 1.00 7.00 H new ATOM 0 HD2 LYS A 22 -5.903 19.986 -31.903 1.00 7.38 H new ATOM 0 HD3 LYS A 22 -6.487 21.339 -30.953 1.00 7.38 H new ATOM 0 HE2 LYS A 22 -7.874 18.677 -31.418 1.00 7.80 H new ATOM 0 HE3 LYS A 22 -7.255 19.303 -29.903 1.00 7.80 H new ATOM 0 HZ1 LYS A 22 -9.458 19.798 -29.706 1.00 8.20 H new ATOM 0 HZ2 LYS A 22 -8.921 21.242 -30.419 1.00 8.20 H new ATOM 0 HZ3 LYS A 22 -9.686 20.060 -31.368 1.00 8.20 H new ATOM 161 N PHE A 23 -6.150 19.124 -36.748 1.00 8.07 N ATOM 162 CA PHE A 23 -5.958 18.015 -37.680 1.00 9.14 C ATOM 163 C PHE A 23 -4.537 17.999 -38.230 1.00 9.53 C ATOM 164 O PHE A 23 -3.871 16.963 -38.234 1.00 10.36 O ATOM 165 CB PHE A 23 -6.974 18.095 -38.828 1.00 9.52 C ATOM 166 CG PHE A 23 -6.544 18.943 -39.995 1.00 10.50 C ATOM 167 CD1 PHE A 23 -5.658 18.447 -40.939 1.00 10.94 C ATOM 168 CD2 PHE A 23 -7.028 20.232 -40.151 1.00 11.16 C ATOM 169 CE1 PHE A 23 -5.264 19.218 -42.014 1.00 11.97 C ATOM 170 CE2 PHE A 23 -6.636 21.009 -41.225 1.00 12.18 C ATOM 171 CZ PHE A 23 -5.753 20.501 -42.157 1.00 12.56 C ATOM 0 H PHE A 23 -6.741 19.878 -37.098 1.00 8.07 H new ATOM 0 HA PHE A 23 -6.120 17.086 -37.133 1.00 9.14 H new ATOM 0 HB2 PHE A 23 -7.177 17.086 -39.186 1.00 9.52 H new ATOM 0 HB3 PHE A 23 -7.912 18.489 -38.437 1.00 9.52 H new ATOM 0 HD1 PHE A 23 -5.271 17.444 -40.832 1.00 10.94 H new ATOM 0 HD2 PHE A 23 -7.719 20.634 -39.425 1.00 11.16 H new ATOM 0 HE1 PHE A 23 -4.574 18.818 -42.742 1.00 11.97 H new ATOM 0 HE2 PHE A 23 -7.020 22.012 -41.335 1.00 12.18 H new ATOM 0 HZ PHE A 23 -5.445 21.107 -42.997 1.00 12.56 H new ATOM 181 N SER A 24 -4.084 19.154 -38.691 1.00 9.13 N ATOM 182 CA SER A 24 -2.743 19.287 -39.246 1.00 9.75 C ATOM 183 C SER A 24 -1.691 18.876 -38.223 1.00 9.69 C ATOM 184 O SER A 24 -0.684 18.257 -38.566 1.00 10.54 O ATOM 185 CB SER A 24 -2.495 20.726 -39.701 1.00 9.62 C ATOM 186 OG SER A 24 -3.619 21.245 -40.389 1.00 10.05 O ATOM 0 H SER A 24 -4.627 20.018 -38.692 1.00 9.13 H new ATOM 0 HA SER A 24 -2.666 18.625 -40.108 1.00 9.75 H new ATOM 0 HB2 SER A 24 -2.274 21.351 -38.836 1.00 9.62 H new ATOM 0 HB3 SER A 24 -1.620 20.760 -40.350 1.00 9.62 H new ATOM 0 HG SER A 24 -4.175 20.505 -40.713 1.00 10.05 H new ATOM 192 N GLN A 25 -1.934 19.223 -36.963 1.00 8.83 N ATOM 193 CA GLN A 25 -1.012 18.889 -35.884 1.00 8.93 C ATOM 194 C GLN A 25 -1.520 19.421 -34.549 1.00 8.77 C ATOM 195 O GLN A 25 -1.190 20.537 -34.148 1.00 8.72 O ATOM 196 CB GLN A 25 0.379 19.458 -36.176 1.00 9.19 C ATOM 197 CG GLN A 25 1.514 18.534 -35.762 1.00 9.52 C ATOM 198 CD GLN A 25 1.401 17.157 -36.388 1.00 10.26 C ATOM 199 OE1 GLN A 25 1.510 17.097 -37.709 1.00 10.58 O flip ATOM 200 NE2 GLN A 25 1.220 16.159 -35.691 1.00 10.75 N flip ATOM 0 H GLN A 25 -2.763 19.736 -36.664 1.00 8.83 H new ATOM 0 HA GLN A 25 -0.947 17.803 -35.821 1.00 8.93 H new ATOM 0 HB2 GLN A 25 0.461 19.665 -37.243 1.00 9.19 H new ATOM 0 HB3 GLN A 25 0.489 20.410 -35.657 1.00 9.19 H new ATOM 0 HG2 GLN A 25 2.466 18.982 -36.048 1.00 9.52 H new ATOM 0 HG3 GLN A 25 1.521 18.436 -34.676 1.00 9.52 H new ATOM 0 HE21 GLN A 25 1.142 16.252 -34.678 1.00 10.75 H new ATOM 0 HE22 GLN A 25 1.148 15.239 -36.126 1.00 10.75 H new ATOM 209 N GLU A 26 -2.320 18.614 -33.860 1.00 8.81 N ATOM 210 CA GLU A 26 -2.868 19.004 -32.567 1.00 8.73 C ATOM 211 C GLU A 26 -1.746 19.217 -31.558 1.00 8.24 C ATOM 212 O GLU A 26 -0.662 18.652 -31.695 1.00 8.16 O ATOM 213 CB GLU A 26 -3.838 17.935 -32.055 1.00 9.14 C ATOM 214 CG GLU A 26 -4.399 18.230 -30.673 1.00 9.68 C ATOM 215 CD GLU A 26 -5.674 17.460 -30.385 1.00 10.25 C ATOM 216 OE1 GLU A 26 -6.332 17.019 -31.351 1.00 10.66 O ATOM 217 OE2 GLU A 26 -6.013 17.296 -29.194 1.00 10.48 O ATOM 0 H GLU A 26 -2.603 17.686 -34.176 1.00 8.81 H new ATOM 0 HA GLU A 26 -3.411 19.941 -32.691 1.00 8.73 H new ATOM 0 HB2 GLU A 26 -4.664 17.839 -32.760 1.00 9.14 H new ATOM 0 HB3 GLU A 26 -3.326 16.973 -32.032 1.00 9.14 H new ATOM 0 HG2 GLU A 26 -3.651 17.981 -29.920 1.00 9.68 H new ATOM 0 HG3 GLU A 26 -4.596 19.298 -30.585 1.00 9.68 H new ATOM 224 N GLN A 27 -2.008 20.036 -30.546 1.00 8.07 N ATOM 225 CA GLN A 27 -1.008 20.315 -29.523 1.00 7.71 C ATOM 226 C GLN A 27 -0.827 19.111 -28.605 1.00 7.53 C ATOM 227 O GLN A 27 -1.629 18.880 -27.699 1.00 7.57 O ATOM 228 CB GLN A 27 -1.414 21.545 -28.704 1.00 7.75 C ATOM 229 CG GLN A 27 -0.388 22.665 -28.743 1.00 7.90 C ATOM 230 CD GLN A 27 -0.212 23.340 -27.397 1.00 8.12 C ATOM 231 OE1 GLN A 27 1.035 23.610 -27.029 1.00 8.29 O flip ATOM 232 NE2 GLN A 27 -1.185 23.616 -26.696 1.00 8.40 N flip ATOM 0 H GLN A 27 -2.898 20.516 -30.412 1.00 8.07 H new ATOM 0 HA GLN A 27 -0.059 20.518 -30.019 1.00 7.71 H new ATOM 0 HB2 GLN A 27 -2.366 21.922 -29.077 1.00 7.75 H new ATOM 0 HB3 GLN A 27 -1.574 21.245 -27.668 1.00 7.75 H new ATOM 0 HG2 GLN A 27 0.570 22.264 -29.072 1.00 7.90 H new ATOM 0 HG3 GLN A 27 -0.693 23.407 -29.481 1.00 7.90 H new ATOM 0 HE21 GLN A 27 -2.126 23.390 -27.018 1.00 8.40 H new ATOM 0 HE22 GLN A 27 -1.050 24.070 -25.793 1.00 8.40 H new ATOM 241 N ILE A 28 0.231 18.344 -28.849 1.00 7.48 N ATOM 242 CA ILE A 28 0.520 17.163 -28.054 1.00 7.49 C ATOM 243 C ILE A 28 1.679 17.391 -27.108 1.00 7.26 C ATOM 244 O ILE A 28 2.674 18.032 -27.450 1.00 7.19 O ATOM 245 CB ILE A 28 0.836 15.950 -28.923 1.00 7.76 C ATOM 246 CG1 ILE A 28 -0.132 15.882 -30.088 1.00 7.99 C ATOM 247 CG2 ILE A 28 0.772 14.674 -28.098 1.00 8.05 C ATOM 248 CD1 ILE A 28 -1.581 15.762 -29.669 1.00 8.22 C ATOM 0 H ILE A 28 0.903 18.523 -29.595 1.00 7.48 H new ATOM 0 HA ILE A 28 -0.385 16.966 -27.479 1.00 7.49 H new ATOM 0 HB ILE A 28 1.848 16.051 -29.315 1.00 7.76 H new ATOM 0 HG12 ILE A 28 -0.013 16.776 -30.700 1.00 7.99 H new ATOM 0 HG13 ILE A 28 0.127 15.029 -30.715 1.00 7.99 H new ATOM 0 HG21 ILE A 28 1.000 13.818 -28.733 1.00 8.05 H new ATOM 0 HG22 ILE A 28 1.499 14.728 -27.287 1.00 8.05 H new ATOM 0 HG23 ILE A 28 -0.229 14.560 -27.681 1.00 8.05 H new ATOM 0 HD11 ILE A 28 -2.214 15.719 -30.556 1.00 8.22 H new ATOM 0 HD12 ILE A 28 -1.716 14.854 -29.082 1.00 8.22 H new ATOM 0 HD13 ILE A 28 -1.859 16.627 -29.067 1.00 8.22 H new ATOM 260 N GLY A 29 1.532 16.853 -25.916 1.00 7.28 N ATOM 261 CA GLY A 29 2.560 16.985 -24.902 1.00 7.14 C ATOM 262 C GLY A 29 2.044 17.599 -23.614 1.00 7.19 C ATOM 263 O GLY A 29 2.801 17.770 -22.658 1.00 7.25 O ATOM 0 H GLY A 29 0.712 16.321 -25.624 1.00 7.28 H new ATOM 0 HA2 GLY A 29 2.980 16.002 -24.687 1.00 7.14 H new ATOM 0 HA3 GLY A 29 3.371 17.600 -25.292 1.00 7.14 H new ATOM 267 N GLU A 30 0.754 17.929 -23.580 1.00 7.22 N ATOM 268 CA GLU A 30 0.150 18.524 -22.391 1.00 7.33 C ATOM 269 C GLU A 30 0.464 17.689 -21.153 1.00 6.81 C ATOM 270 O GLU A 30 0.668 18.224 -20.063 1.00 6.88 O ATOM 271 CB GLU A 30 -1.365 18.645 -22.569 1.00 7.58 C ATOM 272 CG GLU A 30 -2.065 19.304 -21.391 1.00 7.96 C ATOM 273 CD GLU A 30 -3.216 18.473 -20.857 1.00 8.42 C ATOM 274 OE1 GLU A 30 -3.041 17.247 -20.698 1.00 8.80 O ATOM 275 OE2 GLU A 30 -4.294 19.050 -20.598 1.00 8.62 O ATOM 0 H GLU A 30 0.110 17.795 -24.359 1.00 7.22 H new ATOM 0 HA GLU A 30 0.572 19.520 -22.255 1.00 7.33 H new ATOM 0 HB2 GLU A 30 -1.572 19.220 -23.472 1.00 7.58 H new ATOM 0 HB3 GLU A 30 -1.785 17.651 -22.721 1.00 7.58 H new ATOM 0 HG2 GLU A 30 -1.343 19.473 -20.592 1.00 7.96 H new ATOM 0 HG3 GLU A 30 -2.438 20.282 -21.696 1.00 7.96 H new ATOM 282 N ASN A 31 0.505 16.373 -21.335 1.00 6.31 N ATOM 283 CA ASN A 31 0.800 15.449 -20.247 1.00 5.81 C ATOM 284 C ASN A 31 0.833 14.050 -20.819 1.00 5.37 C ATOM 285 O ASN A 31 0.433 13.077 -20.182 1.00 5.02 O ATOM 286 CB ASN A 31 -0.264 15.547 -19.154 1.00 5.88 C ATOM 287 CG ASN A 31 0.251 16.226 -17.902 1.00 6.01 C ATOM 288 OD1 ASN A 31 1.453 16.245 -17.641 1.00 6.14 O ATOM 289 ND2 ASN A 31 -0.660 16.787 -17.116 1.00 6.20 N ATOM 0 H ASN A 31 0.336 15.920 -22.233 1.00 6.31 H new ATOM 0 HA ASN A 31 1.761 15.698 -19.798 1.00 5.81 H new ATOM 0 HB2 ASN A 31 -1.123 16.099 -19.536 1.00 5.88 H new ATOM 0 HB3 ASN A 31 -0.615 14.546 -18.902 1.00 5.88 H new ATOM 0 HD21 ASN A 31 -0.373 17.257 -16.258 1.00 6.20 H new ATOM 0 HD22 ASN A 31 -1.647 16.748 -17.371 1.00 6.20 H new ATOM 296 N ILE A 32 1.279 13.992 -22.061 1.00 5.43 N ATOM 297 CA ILE A 32 1.345 12.789 -22.816 1.00 5.08 C ATOM 298 C ILE A 32 2.692 12.097 -22.646 1.00 4.63 C ATOM 299 O ILE A 32 3.745 12.662 -22.943 1.00 4.75 O ATOM 300 CB ILE A 32 1.073 13.143 -24.283 1.00 5.37 C ATOM 301 CG1 ILE A 32 -0.416 13.436 -24.489 1.00 5.87 C ATOM 302 CG2 ILE A 32 1.532 12.050 -25.202 1.00 5.16 C ATOM 303 CD1 ILE A 32 -1.293 12.201 -24.471 1.00 5.95 C ATOM 0 H ILE A 32 1.610 14.811 -22.571 1.00 5.43 H new ATOM 0 HA ILE A 32 0.596 12.082 -22.459 1.00 5.08 H new ATOM 0 HB ILE A 32 1.643 14.039 -24.527 1.00 5.37 H new ATOM 0 HG12 ILE A 32 -0.753 14.120 -23.710 1.00 5.87 H new ATOM 0 HG13 ILE A 32 -0.547 13.949 -25.442 1.00 5.87 H new ATOM 0 HG21 ILE A 32 1.325 12.332 -26.234 1.00 5.16 H new ATOM 0 HG22 ILE A 32 2.604 11.895 -25.076 1.00 5.16 H new ATOM 0 HG23 ILE A 32 1.002 11.128 -24.964 1.00 5.16 H new ATOM 0 HD11 ILE A 32 -2.333 12.491 -24.623 1.00 5.95 H new ATOM 0 HD12 ILE A 32 -0.985 11.524 -25.268 1.00 5.95 H new ATOM 0 HD13 ILE A 32 -1.194 11.698 -23.509 1.00 5.95 H new ATOM 315 N VAL A 33 2.636 10.873 -22.146 1.00 4.17 N ATOM 316 CA VAL A 33 3.800 10.076 -21.897 1.00 3.72 C ATOM 317 C VAL A 33 4.223 9.321 -23.153 1.00 3.64 C ATOM 318 O VAL A 33 5.281 9.585 -23.724 1.00 3.70 O ATOM 319 CB VAL A 33 3.505 9.070 -20.774 1.00 3.35 C ATOM 320 CG1 VAL A 33 4.774 8.679 -20.100 1.00 2.92 C ATOM 321 CG2 VAL A 33 2.535 9.624 -19.744 1.00 3.72 C ATOM 0 H VAL A 33 1.761 10.409 -21.902 1.00 4.17 H new ATOM 0 HA VAL A 33 4.612 10.739 -21.600 1.00 3.72 H new ATOM 0 HB VAL A 33 3.038 8.199 -21.234 1.00 3.35 H new ATOM 0 HG11 VAL A 33 4.559 7.966 -19.305 1.00 2.92 H new ATOM 0 HG12 VAL A 33 5.446 8.221 -20.826 1.00 2.92 H new ATOM 0 HG13 VAL A 33 5.248 9.564 -19.675 1.00 2.92 H new ATOM 0 HG21 VAL A 33 2.358 8.876 -18.971 1.00 3.72 H new ATOM 0 HG22 VAL A 33 2.958 10.521 -19.291 1.00 3.72 H new ATOM 0 HG23 VAL A 33 1.592 9.873 -20.230 1.00 3.72 H new ATOM 331 N CYS A 34 3.383 8.381 -23.576 1.00 3.57 N ATOM 332 CA CYS A 34 3.657 7.584 -24.767 1.00 3.55 C ATOM 333 C CYS A 34 2.361 7.209 -25.479 1.00 3.76 C ATOM 334 O CYS A 34 1.289 7.202 -24.873 1.00 3.82 O ATOM 335 CB CYS A 34 4.436 6.320 -24.394 1.00 3.04 C ATOM 336 SG CYS A 34 3.794 5.458 -22.941 1.00 3.09 S ATOM 0 H CYS A 34 2.505 8.152 -23.110 1.00 3.57 H new ATOM 0 HA CYS A 34 4.262 8.185 -25.446 1.00 3.55 H new ATOM 0 HB2 CYS A 34 4.425 5.636 -25.243 1.00 3.04 H new ATOM 0 HB3 CYS A 34 5.477 6.588 -24.213 1.00 3.04 H new ATOM 0 HG CYS A 34 4.631 4.531 -22.581 1.00 3.09 H new ATOM 342 N ARG A 35 2.464 6.903 -26.771 1.00 3.97 N ATOM 343 CA ARG A 35 1.296 6.533 -27.566 1.00 4.21 C ATOM 344 C ARG A 35 1.447 5.126 -28.142 1.00 3.96 C ATOM 345 O ARG A 35 2.518 4.749 -28.611 1.00 3.90 O ATOM 346 CB ARG A 35 1.098 7.545 -28.698 1.00 4.81 C ATOM 347 CG ARG A 35 -0.353 7.951 -28.906 1.00 5.19 C ATOM 348 CD ARG A 35 -0.915 7.384 -30.200 1.00 5.57 C ATOM 349 NE ARG A 35 -1.684 8.379 -30.945 1.00 6.09 N ATOM 350 CZ ARG A 35 -1.133 9.344 -31.678 1.00 6.64 C ATOM 351 NH1 ARG A 35 0.188 9.447 -31.767 1.00 6.82 N ATOM 352 NH2 ARG A 35 -1.904 10.207 -32.324 1.00 7.13 N ATOM 0 H ARG A 35 3.343 6.904 -27.288 1.00 3.97 H new ATOM 0 HA ARG A 35 0.421 6.541 -26.916 1.00 4.21 H new ATOM 0 HB2 ARG A 35 1.689 8.436 -28.485 1.00 4.81 H new ATOM 0 HB3 ARG A 35 1.484 7.121 -29.625 1.00 4.81 H new ATOM 0 HG2 ARG A 35 -0.953 7.602 -28.065 1.00 5.19 H new ATOM 0 HG3 ARG A 35 -0.428 9.038 -28.922 1.00 5.19 H new ATOM 0 HD2 ARG A 35 -0.097 7.018 -30.821 1.00 5.57 H new ATOM 0 HD3 ARG A 35 -1.551 6.528 -29.975 1.00 5.57 H new ATOM 0 HE ARG A 35 -2.702 8.331 -30.901 1.00 6.09 H new ATOM 0 HH11 ARG A 35 0.786 8.785 -31.272 1.00 6.82 H new ATOM 0 HH12 ARG A 35 0.605 10.188 -32.330 1.00 6.82 H new ATOM 0 HH21 ARG A 35 -2.919 10.132 -32.259 1.00 7.13 H new ATOM 0 HH22 ARG A 35 -1.482 10.947 -32.886 1.00 7.13 H new ATOM 366 N VAL A 36 0.365 4.351 -28.106 1.00 3.88 N ATOM 367 CA VAL A 36 0.386 2.987 -28.631 1.00 3.65 C ATOM 368 C VAL A 36 -0.367 2.895 -29.954 1.00 4.09 C ATOM 369 O VAL A 36 -1.545 3.245 -30.036 1.00 4.40 O ATOM 370 CB VAL A 36 -0.219 1.977 -27.635 1.00 3.26 C ATOM 371 CG1 VAL A 36 0.839 1.494 -26.656 1.00 3.12 C ATOM 372 CG2 VAL A 36 -1.404 2.582 -26.896 1.00 3.35 C ATOM 0 H VAL A 36 -0.533 4.642 -27.721 1.00 3.88 H new ATOM 0 HA VAL A 36 1.434 2.733 -28.791 1.00 3.65 H new ATOM 0 HB VAL A 36 -0.581 1.118 -28.200 1.00 3.26 H new ATOM 0 HG11 VAL A 36 0.394 0.782 -25.961 1.00 3.12 H new ATOM 0 HG12 VAL A 36 1.647 1.009 -27.204 1.00 3.12 H new ATOM 0 HG13 VAL A 36 1.236 2.344 -26.100 1.00 3.12 H new ATOM 0 HG21 VAL A 36 -1.812 1.849 -26.200 1.00 3.35 H new ATOM 0 HG22 VAL A 36 -1.077 3.463 -26.344 1.00 3.35 H new ATOM 0 HG23 VAL A 36 -2.173 2.868 -27.614 1.00 3.35 H new ATOM 382 N ILE A 37 0.327 2.434 -30.991 1.00 4.18 N ATOM 383 CA ILE A 37 -0.263 2.307 -32.316 1.00 4.61 C ATOM 384 C ILE A 37 -0.078 0.900 -32.878 1.00 4.44 C ATOM 385 O ILE A 37 1.046 0.409 -32.986 1.00 4.31 O ATOM 386 CB ILE A 37 0.380 3.313 -33.286 1.00 5.06 C ATOM 387 CG1 ILE A 37 0.467 4.693 -32.634 1.00 5.18 C ATOM 388 CG2 ILE A 37 -0.401 3.376 -34.590 1.00 5.55 C ATOM 389 CD1 ILE A 37 1.168 5.725 -33.491 1.00 5.60 C ATOM 0 H ILE A 37 1.303 2.142 -30.936 1.00 4.18 H new ATOM 0 HA ILE A 37 -1.329 2.511 -32.216 1.00 4.61 H new ATOM 0 HB ILE A 37 1.391 2.978 -33.517 1.00 5.06 H new ATOM 0 HG12 ILE A 37 -0.540 5.043 -32.409 1.00 5.18 H new ATOM 0 HG13 ILE A 37 0.993 4.604 -31.684 1.00 5.18 H new ATOM 0 HG21 ILE A 37 0.070 4.093 -35.262 1.00 5.55 H new ATOM 0 HG22 ILE A 37 -0.409 2.391 -35.058 1.00 5.55 H new ATOM 0 HG23 ILE A 37 -1.425 3.689 -34.386 1.00 5.55 H new ATOM 0 HD11 ILE A 37 1.192 6.679 -32.965 1.00 5.60 H new ATOM 0 HD12 ILE A 37 2.187 5.397 -33.695 1.00 5.60 H new ATOM 0 HD13 ILE A 37 0.630 5.843 -34.432 1.00 5.60 H new ATOM 401 N CYS A 38 -1.183 0.256 -33.245 1.00 4.51 N ATOM 402 CA CYS A 38 -1.130 -1.089 -33.807 1.00 4.38 C ATOM 403 C CYS A 38 -0.780 -1.036 -35.292 1.00 4.84 C ATOM 404 O CYS A 38 -1.447 -0.354 -36.071 1.00 5.24 O ATOM 405 CB CYS A 38 -2.466 -1.804 -33.606 1.00 4.28 C ATOM 406 SG CYS A 38 -2.468 -3.530 -34.146 1.00 4.04 S ATOM 0 H CYS A 38 -2.123 0.643 -33.163 1.00 4.51 H new ATOM 0 HA CYS A 38 -0.352 -1.648 -33.286 1.00 4.38 H new ATOM 0 HB2 CYS A 38 -2.732 -1.765 -32.550 1.00 4.28 H new ATOM 0 HB3 CYS A 38 -3.241 -1.263 -34.150 1.00 4.28 H new ATOM 0 HG CYS A 38 -1.310 -4.064 -33.896 1.00 4.04 H new ATOM 412 N THR A 39 0.274 -1.749 -35.678 1.00 4.83 N ATOM 413 CA THR A 39 0.716 -1.769 -37.070 1.00 5.29 C ATOM 414 C THR A 39 0.080 -2.922 -37.843 1.00 5.33 C ATOM 415 O THR A 39 -0.065 -2.854 -39.064 1.00 5.75 O ATOM 416 CB THR A 39 2.240 -1.876 -37.139 1.00 5.37 C ATOM 417 OG1 THR A 39 2.754 -2.489 -35.969 1.00 5.20 O ATOM 418 CG2 THR A 39 2.926 -0.536 -37.294 1.00 5.77 C ATOM 0 H THR A 39 0.838 -2.320 -35.048 1.00 4.83 H new ATOM 0 HA THR A 39 0.397 -0.835 -37.532 1.00 5.29 H new ATOM 0 HB THR A 39 2.448 -2.478 -38.024 1.00 5.37 H new ATOM 0 HG1 THR A 39 3.733 -2.457 -35.986 1.00 5.20 H new ATOM 0 HG21 THR A 39 4.005 -0.683 -37.337 1.00 5.77 H new ATOM 0 HG22 THR A 39 2.588 -0.058 -38.214 1.00 5.77 H new ATOM 0 HG23 THR A 39 2.679 0.100 -36.443 1.00 5.77 H new ATOM 426 N THR A 40 -0.294 -3.981 -37.132 1.00 4.92 N ATOM 427 CA THR A 40 -0.908 -5.144 -37.766 1.00 4.94 C ATOM 428 C THR A 40 -2.390 -4.908 -38.051 1.00 5.08 C ATOM 429 O THR A 40 -3.062 -5.757 -38.637 1.00 5.14 O ATOM 430 CB THR A 40 -0.732 -6.373 -36.880 1.00 4.48 C ATOM 431 OG1 THR A 40 -1.281 -6.149 -35.593 1.00 4.09 O ATOM 432 CG2 THR A 40 0.715 -6.762 -36.698 1.00 4.40 C ATOM 0 H THR A 40 -0.184 -4.059 -36.121 1.00 4.92 H new ATOM 0 HA THR A 40 -0.408 -5.311 -38.720 1.00 4.94 H new ATOM 0 HB THR A 40 -1.254 -7.181 -37.393 1.00 4.48 H new ATOM 0 HG1 THR A 40 -1.626 -5.233 -35.539 1.00 4.09 H new ATOM 0 HG21 THR A 40 0.777 -7.643 -36.059 1.00 4.40 H new ATOM 0 HG22 THR A 40 1.156 -6.987 -37.669 1.00 4.40 H new ATOM 0 HG23 THR A 40 1.258 -5.938 -36.235 1.00 4.40 H new ATOM 440 N GLY A 41 -2.890 -3.746 -37.645 1.00 5.18 N ATOM 441 CA GLY A 41 -4.283 -3.411 -37.875 1.00 5.41 C ATOM 442 C GLY A 41 -5.244 -4.330 -37.146 1.00 5.11 C ATOM 443 O GLY A 41 -5.876 -5.190 -37.759 1.00 5.19 O ATOM 0 H GLY A 41 -2.353 -3.028 -37.159 1.00 5.18 H new ATOM 0 HA2 GLY A 41 -4.461 -2.384 -37.557 1.00 5.41 H new ATOM 0 HA3 GLY A 41 -4.489 -3.454 -38.944 1.00 5.41 H new ATOM 447 N GLN A 42 -5.357 -4.144 -35.836 1.00 4.79 N ATOM 448 CA GLN A 42 -6.251 -4.959 -35.020 1.00 4.53 C ATOM 449 C GLN A 42 -6.859 -4.138 -33.886 1.00 4.54 C ATOM 450 O GLN A 42 -8.050 -4.252 -33.595 1.00 4.68 O ATOM 451 CB GLN A 42 -5.499 -6.160 -34.447 1.00 4.04 C ATOM 452 CG GLN A 42 -5.055 -7.156 -35.504 1.00 4.10 C ATOM 453 CD GLN A 42 -5.343 -8.592 -35.112 1.00 3.81 C ATOM 454 OE1 GLN A 42 -4.300 -9.412 -35.065 1.00 3.85 O flip ATOM 455 NE2 GLN A 42 -6.489 -8.959 -34.853 1.00 3.69 N flip ATOM 0 H GLN A 42 -4.840 -3.435 -35.315 1.00 4.79 H new ATOM 0 HA GLN A 42 -7.059 -5.314 -35.659 1.00 4.53 H new ATOM 0 HB2 GLN A 42 -4.624 -5.805 -33.903 1.00 4.04 H new ATOM 0 HB3 GLN A 42 -6.138 -6.669 -33.725 1.00 4.04 H new ATOM 0 HG2 GLN A 42 -5.560 -6.932 -36.444 1.00 4.10 H new ATOM 0 HG3 GLN A 42 -3.986 -7.039 -35.681 1.00 4.10 H new ATOM 0 HE21 GLN A 42 -7.261 -8.294 -34.902 1.00 3.69 H new ATOM 0 HE22 GLN A 42 -6.667 -9.928 -34.589 1.00 3.69 H new ATOM 464 N ILE A 43 -6.035 -3.315 -33.246 1.00 4.44 N ATOM 465 CA ILE A 43 -6.492 -2.481 -32.141 1.00 4.48 C ATOM 466 C ILE A 43 -6.391 -0.998 -32.499 1.00 4.87 C ATOM 467 O ILE A 43 -5.431 -0.577 -33.145 1.00 4.91 O ATOM 468 CB ILE A 43 -5.669 -2.747 -30.863 1.00 4.00 C ATOM 469 CG1 ILE A 43 -5.486 -4.252 -30.642 1.00 3.65 C ATOM 470 CG2 ILE A 43 -6.343 -2.113 -29.658 1.00 4.07 C ATOM 471 CD1 ILE A 43 -4.071 -4.640 -30.272 1.00 3.21 C ATOM 0 H ILE A 43 -5.047 -3.208 -33.474 1.00 4.44 H new ATOM 0 HA ILE A 43 -7.534 -2.739 -31.954 1.00 4.48 H new ATOM 0 HB ILE A 43 -4.685 -2.296 -30.988 1.00 4.00 H new ATOM 0 HG12 ILE A 43 -6.162 -4.580 -29.853 1.00 3.65 H new ATOM 0 HG13 ILE A 43 -5.774 -4.782 -31.550 1.00 3.65 H new ATOM 0 HG21 ILE A 43 -5.750 -2.309 -28.764 1.00 4.07 H new ATOM 0 HG22 ILE A 43 -6.424 -1.037 -29.811 1.00 4.07 H new ATOM 0 HG23 ILE A 43 -7.339 -2.537 -29.533 1.00 4.07 H new ATOM 0 HD11 ILE A 43 -4.015 -5.719 -30.131 1.00 3.21 H new ATOM 0 HD12 ILE A 43 -3.392 -4.343 -31.071 1.00 3.21 H new ATOM 0 HD13 ILE A 43 -3.786 -4.138 -29.348 1.00 3.21 H new ATOM 483 N PRO A 44 -7.381 -0.183 -32.090 1.00 5.20 N ATOM 484 CA PRO A 44 -7.381 1.252 -32.384 1.00 5.59 C ATOM 485 C PRO A 44 -6.346 2.008 -31.559 1.00 5.38 C ATOM 486 O PRO A 44 -6.100 1.679 -30.398 1.00 5.04 O ATOM 487 CB PRO A 44 -8.798 1.696 -32.019 1.00 5.97 C ATOM 488 CG PRO A 44 -9.263 0.710 -31.003 1.00 5.69 C ATOM 489 CD PRO A 44 -8.570 -0.590 -31.316 1.00 5.26 C ATOM 0 HA PRO A 44 -7.119 1.457 -33.422 1.00 5.59 H new ATOM 0 HB2 PRO A 44 -8.803 2.709 -31.617 1.00 5.97 H new ATOM 0 HB3 PRO A 44 -9.448 1.698 -32.894 1.00 5.97 H new ATOM 0 HG2 PRO A 44 -9.018 1.047 -29.996 1.00 5.69 H new ATOM 0 HG3 PRO A 44 -10.346 0.592 -31.045 1.00 5.69 H new ATOM 0 HD2 PRO A 44 -8.291 -1.123 -30.407 1.00 5.26 H new ATOM 0 HD3 PRO A 44 -9.212 -1.256 -31.892 1.00 5.26 H new ATOM 497 N ILE A 45 -5.735 3.017 -32.170 1.00 5.62 N ATOM 498 CA ILE A 45 -4.718 3.816 -31.500 1.00 5.47 C ATOM 499 C ILE A 45 -5.259 4.464 -30.228 1.00 5.49 C ATOM 500 O ILE A 45 -6.413 4.888 -30.172 1.00 5.88 O ATOM 501 CB ILE A 45 -4.163 4.911 -32.431 1.00 5.86 C ATOM 502 CG1 ILE A 45 -3.554 4.270 -33.676 1.00 5.90 C ATOM 503 CG2 ILE A 45 -3.126 5.759 -31.707 1.00 5.73 C ATOM 504 CD1 ILE A 45 -3.510 5.194 -34.874 1.00 6.44 C ATOM 0 H ILE A 45 -5.928 3.301 -33.131 1.00 5.62 H new ATOM 0 HA ILE A 45 -3.912 3.133 -31.231 1.00 5.47 H new ATOM 0 HB ILE A 45 -4.982 5.564 -32.732 1.00 5.86 H new ATOM 0 HG12 ILE A 45 -2.541 3.939 -33.446 1.00 5.90 H new ATOM 0 HG13 ILE A 45 -4.129 3.381 -33.935 1.00 5.90 H new ATOM 0 HG21 ILE A 45 -2.747 6.526 -32.383 1.00 5.73 H new ATOM 0 HG22 ILE A 45 -3.585 6.234 -30.840 1.00 5.73 H new ATOM 0 HG23 ILE A 45 -2.302 5.125 -31.379 1.00 5.73 H new ATOM 0 HD11 ILE A 45 -3.065 4.671 -35.721 1.00 6.44 H new ATOM 0 HD12 ILE A 45 -4.523 5.505 -35.131 1.00 6.44 H new ATOM 0 HD13 ILE A 45 -2.910 6.072 -34.634 1.00 6.44 H new ATOM 516 N ARG A 46 -4.404 4.542 -29.214 1.00 5.10 N ATOM 517 CA ARG A 46 -4.771 5.144 -27.937 1.00 5.12 C ATOM 518 C ARG A 46 -3.648 6.053 -27.447 1.00 5.00 C ATOM 519 O ARG A 46 -2.524 5.981 -27.945 1.00 4.82 O ATOM 520 CB ARG A 46 -5.064 4.059 -26.899 1.00 4.77 C ATOM 521 CG ARG A 46 -6.262 4.367 -26.016 1.00 5.09 C ATOM 522 CD ARG A 46 -7.121 3.132 -25.791 1.00 5.15 C ATOM 523 NE ARG A 46 -8.050 3.305 -24.677 1.00 5.64 N ATOM 524 CZ ARG A 46 -9.041 2.460 -24.402 1.00 5.87 C ATOM 525 NH1 ARG A 46 -9.235 1.386 -25.156 1.00 5.80 N ATOM 526 NH2 ARG A 46 -9.840 2.691 -23.369 1.00 6.42 N ATOM 0 H ARG A 46 -3.446 4.194 -29.252 1.00 5.10 H new ATOM 0 HA ARG A 46 -5.673 5.740 -28.078 1.00 5.12 H new ATOM 0 HB2 ARG A 46 -5.236 3.113 -27.413 1.00 4.77 H new ATOM 0 HB3 ARG A 46 -4.185 3.924 -26.269 1.00 4.77 H new ATOM 0 HG2 ARG A 46 -5.918 4.752 -25.056 1.00 5.09 H new ATOM 0 HG3 ARG A 46 -6.863 5.151 -26.477 1.00 5.09 H new ATOM 0 HD2 ARG A 46 -7.682 2.910 -26.699 1.00 5.15 H new ATOM 0 HD3 ARG A 46 -6.478 2.274 -25.596 1.00 5.15 H new ATOM 0 HE ARG A 46 -7.933 4.120 -24.075 1.00 5.64 H new ATOM 0 HH11 ARG A 46 -8.623 1.204 -25.951 1.00 5.80 H new ATOM 0 HH12 ARG A 46 -9.996 0.742 -24.940 1.00 5.80 H new ATOM 0 HH21 ARG A 46 -9.695 3.515 -22.786 1.00 6.42 H new ATOM 0 HH22 ARG A 46 -10.600 2.044 -23.157 1.00 6.42 H new ATOM 540 N ASP A 47 -3.951 6.915 -26.482 1.00 5.15 N ATOM 541 CA ASP A 47 -2.949 7.834 -25.954 1.00 5.07 C ATOM 542 C ASP A 47 -2.717 7.627 -24.461 1.00 4.76 C ATOM 543 O ASP A 47 -3.626 7.795 -23.648 1.00 4.97 O ATOM 544 CB ASP A 47 -3.365 9.283 -26.214 1.00 5.62 C ATOM 545 CG ASP A 47 -3.565 9.572 -27.689 1.00 6.15 C ATOM 546 OD1 ASP A 47 -4.409 8.897 -28.316 1.00 6.50 O ATOM 547 OD2 ASP A 47 -2.878 10.472 -28.217 1.00 6.49 O ATOM 0 H ASP A 47 -4.873 6.997 -26.053 1.00 5.15 H new ATOM 0 HA ASP A 47 -2.013 7.624 -26.472 1.00 5.07 H new ATOM 0 HB2 ASP A 47 -4.289 9.495 -25.677 1.00 5.62 H new ATOM 0 HB3 ASP A 47 -2.604 9.954 -25.815 1.00 5.62 H new ATOM 552 N LEU A 48 -1.481 7.289 -24.113 1.00 4.31 N ATOM 553 CA LEU A 48 -1.098 7.089 -22.722 1.00 4.01 C ATOM 554 C LEU A 48 -0.553 8.398 -22.168 1.00 4.16 C ATOM 555 O LEU A 48 0.199 9.093 -22.854 1.00 4.22 O ATOM 556 CB LEU A 48 -0.043 5.983 -22.619 1.00 3.44 C ATOM 557 CG LEU A 48 -0.230 4.816 -23.591 1.00 3.13 C ATOM 558 CD1 LEU A 48 1.066 4.033 -23.738 1.00 2.94 C ATOM 559 CD2 LEU A 48 -1.354 3.906 -23.119 1.00 3.38 C ATOM 0 H LEU A 48 -0.723 7.147 -24.781 1.00 4.31 H new ATOM 0 HA LEU A 48 -1.968 6.784 -22.141 1.00 4.01 H new ATOM 0 HB2 LEU A 48 0.940 6.423 -22.788 1.00 3.44 H new ATOM 0 HB3 LEU A 48 -0.047 5.592 -21.601 1.00 3.44 H new ATOM 0 HG LEU A 48 -0.501 5.219 -24.567 1.00 3.13 H new ATOM 0 HD11 LEU A 48 0.915 3.207 -24.433 1.00 2.94 H new ATOM 0 HD12 LEU A 48 1.847 4.690 -24.120 1.00 2.94 H new ATOM 0 HD13 LEU A 48 1.366 3.640 -22.767 1.00 2.94 H new ATOM 0 HD21 LEU A 48 -1.474 3.081 -23.822 1.00 3.38 H new ATOM 0 HD22 LEU A 48 -1.112 3.510 -22.133 1.00 3.38 H new ATOM 0 HD23 LEU A 48 -2.283 4.474 -23.064 1.00 3.38 H new ATOM 571 N SER A 49 -0.936 8.761 -20.945 1.00 4.30 N ATOM 572 CA SER A 49 -0.471 10.012 -20.377 1.00 4.47 C ATOM 573 C SER A 49 -0.334 9.996 -18.872 1.00 4.37 C ATOM 574 O SER A 49 -0.955 9.203 -18.168 1.00 4.36 O ATOM 575 CB SER A 49 -1.385 11.151 -20.759 1.00 5.05 C ATOM 576 OG SER A 49 -2.493 10.705 -21.521 1.00 5.29 O ATOM 0 H SER A 49 -1.554 8.216 -20.344 1.00 4.30 H new ATOM 0 HA SER A 49 0.525 10.153 -20.796 1.00 4.47 H new ATOM 0 HB2 SER A 49 -1.741 11.649 -19.857 1.00 5.05 H new ATOM 0 HB3 SER A 49 -0.825 11.890 -21.331 1.00 5.05 H new ATOM 0 HG SER A 49 -3.063 11.469 -21.748 1.00 5.29 H new ATOM 582 N ALA A 50 0.485 10.918 -18.406 1.00 4.38 N ATOM 583 CA ALA A 50 0.743 11.078 -16.980 1.00 4.35 C ATOM 584 C ALA A 50 0.938 12.547 -16.620 1.00 4.61 C ATOM 585 O ALA A 50 1.467 13.326 -17.413 1.00 4.61 O ATOM 586 CB ALA A 50 1.959 10.261 -16.571 1.00 3.87 C ATOM 0 H ALA A 50 0.991 11.577 -18.998 1.00 4.38 H new ATOM 0 HA ALA A 50 -0.125 10.712 -16.432 1.00 4.35 H new ATOM 0 HB1 ALA A 50 2.141 10.389 -15.504 1.00 3.87 H new ATOM 0 HB2 ALA A 50 1.778 9.208 -16.784 1.00 3.87 H new ATOM 0 HB3 ALA A 50 2.830 10.600 -17.131 1.00 3.87 H new ATOM 592 N ASP A 51 0.502 12.921 -15.421 1.00 4.89 N ATOM 593 CA ASP A 51 0.624 14.299 -14.958 1.00 5.17 C ATOM 594 C ASP A 51 2.063 14.624 -14.567 1.00 4.82 C ATOM 595 O ASP A 51 2.672 13.926 -13.757 1.00 4.58 O ATOM 596 CB ASP A 51 -0.311 14.544 -13.775 1.00 5.65 C ATOM 597 CG ASP A 51 -1.606 15.213 -14.190 1.00 6.19 C ATOM 598 OD1 ASP A 51 -1.650 16.461 -14.211 1.00 6.64 O ATOM 599 OD2 ASP A 51 -2.577 14.489 -14.496 1.00 6.36 O ATOM 0 H ASP A 51 0.061 12.289 -14.753 1.00 4.89 H new ATOM 0 HA ASP A 51 0.339 14.957 -15.779 1.00 5.17 H new ATOM 0 HB2 ASP A 51 -0.535 13.594 -13.290 1.00 5.65 H new ATOM 0 HB3 ASP A 51 0.196 15.166 -13.038 1.00 5.65 H new ATOM 604 N ILE A 52 2.596 15.687 -15.157 1.00 4.84 N ATOM 605 CA ILE A 52 3.964 16.121 -14.892 1.00 4.56 C ATOM 606 C ILE A 52 4.152 16.570 -13.444 1.00 4.64 C ATOM 607 O ILE A 52 5.167 16.264 -12.819 1.00 4.38 O ATOM 608 CB ILE A 52 4.359 17.276 -15.838 1.00 4.70 C ATOM 609 CG1 ILE A 52 4.574 16.744 -17.254 1.00 4.65 C ATOM 610 CG2 ILE A 52 5.608 17.989 -15.339 1.00 4.50 C ATOM 611 CD1 ILE A 52 4.936 17.819 -18.256 1.00 4.99 C ATOM 0 H ILE A 52 2.097 16.270 -15.829 1.00 4.84 H new ATOM 0 HA ILE A 52 4.609 15.261 -15.070 1.00 4.56 H new ATOM 0 HB ILE A 52 3.545 18.001 -15.854 1.00 4.70 H new ATOM 0 HG12 ILE A 52 5.365 15.995 -17.235 1.00 4.65 H new ATOM 0 HG13 ILE A 52 3.666 16.240 -17.586 1.00 4.65 H new ATOM 0 HG21 ILE A 52 5.864 18.798 -16.024 1.00 4.50 H new ATOM 0 HG22 ILE A 52 5.421 18.399 -14.347 1.00 4.50 H new ATOM 0 HG23 ILE A 52 6.435 17.281 -15.289 1.00 4.50 H new ATOM 0 HD11 ILE A 52 5.074 17.369 -19.239 1.00 4.99 H new ATOM 0 HD12 ILE A 52 4.135 18.557 -18.304 1.00 4.99 H new ATOM 0 HD13 ILE A 52 5.861 18.307 -17.948 1.00 4.99 H new ATOM 623 N SER A 53 3.181 17.308 -12.925 1.00 5.08 N ATOM 624 CA SER A 53 3.253 17.809 -11.563 1.00 5.27 C ATOM 625 C SER A 53 3.312 16.657 -10.574 1.00 5.17 C ATOM 626 O SER A 53 4.044 16.699 -9.585 1.00 5.15 O ATOM 627 CB SER A 53 2.049 18.701 -11.257 1.00 5.80 C ATOM 628 OG SER A 53 2.056 19.864 -12.067 1.00 6.07 O ATOM 0 H SER A 53 2.334 17.572 -13.428 1.00 5.08 H new ATOM 0 HA SER A 53 4.163 18.401 -11.465 1.00 5.27 H new ATOM 0 HB2 SER A 53 1.128 18.143 -11.424 1.00 5.80 H new ATOM 0 HB3 SER A 53 2.062 18.987 -10.205 1.00 5.80 H new ATOM 0 HG SER A 53 1.275 20.416 -11.853 1.00 6.07 H new ATOM 634 N GLN A 54 2.531 15.629 -10.862 1.00 5.18 N ATOM 635 CA GLN A 54 2.471 14.446 -10.020 1.00 5.16 C ATOM 636 C GLN A 54 3.775 13.660 -10.099 1.00 4.71 C ATOM 637 O GLN A 54 4.238 13.101 -9.106 1.00 4.76 O ATOM 638 CB GLN A 54 1.291 13.573 -10.446 1.00 5.27 C ATOM 639 CG GLN A 54 0.019 14.366 -10.712 1.00 5.70 C ATOM 640 CD GLN A 54 -0.790 14.603 -9.451 1.00 6.28 C ATOM 641 OE1 GLN A 54 -0.499 14.037 -8.398 1.00 6.63 O ATOM 642 NE2 GLN A 54 -1.814 15.443 -9.554 1.00 6.62 N ATOM 0 H GLN A 54 1.924 15.591 -11.681 1.00 5.18 H new ATOM 0 HA GLN A 54 2.329 14.756 -8.985 1.00 5.16 H new ATOM 0 HB2 GLN A 54 1.562 13.022 -11.347 1.00 5.27 H new ATOM 0 HB3 GLN A 54 1.095 12.835 -9.668 1.00 5.27 H new ATOM 0 HG2 GLN A 54 0.279 15.325 -11.159 1.00 5.70 H new ATOM 0 HG3 GLN A 54 -0.594 13.832 -11.438 1.00 5.70 H new ATOM 0 HE21 GLN A 54 -2.019 15.890 -10.448 1.00 6.62 H new ATOM 0 HE22 GLN A 54 -2.395 15.641 -8.740 1.00 6.62 H new ATOM 651 N VAL A 55 4.366 13.627 -11.291 1.00 4.34 N ATOM 652 CA VAL A 55 5.620 12.916 -11.504 1.00 3.94 C ATOM 653 C VAL A 55 6.760 13.583 -10.740 1.00 3.94 C ATOM 654 O VAL A 55 7.554 12.912 -10.081 1.00 3.88 O ATOM 655 CB VAL A 55 5.981 12.852 -13.003 1.00 3.63 C ATOM 656 CG1 VAL A 55 7.260 12.055 -13.218 1.00 3.29 C ATOM 657 CG2 VAL A 55 4.831 12.255 -13.803 1.00 3.70 C ATOM 0 H VAL A 55 3.995 14.085 -12.123 1.00 4.34 H new ATOM 0 HA VAL A 55 5.482 11.901 -11.131 1.00 3.94 H new ATOM 0 HB VAL A 55 6.154 13.868 -13.357 1.00 3.63 H new ATOM 0 HG11 VAL A 55 7.495 12.023 -14.282 1.00 3.29 H new ATOM 0 HG12 VAL A 55 8.080 12.530 -12.680 1.00 3.29 H new ATOM 0 HG13 VAL A 55 7.123 11.039 -12.847 1.00 3.29 H new ATOM 0 HG21 VAL A 55 5.103 12.217 -14.858 1.00 3.70 H new ATOM 0 HG22 VAL A 55 4.624 11.246 -13.445 1.00 3.70 H new ATOM 0 HG23 VAL A 55 3.942 12.873 -13.679 1.00 3.70 H new ATOM 667 N LEU A 56 6.831 14.907 -10.832 1.00 4.07 N ATOM 668 CA LEU A 56 7.872 15.664 -10.147 1.00 4.10 C ATOM 669 C LEU A 56 7.635 15.670 -8.641 1.00 4.45 C ATOM 670 O LEU A 56 8.571 15.529 -7.854 1.00 4.46 O ATOM 671 CB LEU A 56 7.919 17.100 -10.674 1.00 4.23 C ATOM 672 CG LEU A 56 9.216 17.855 -10.381 1.00 4.08 C ATOM 673 CD1 LEU A 56 9.576 18.770 -11.541 1.00 4.10 C ATOM 674 CD2 LEU A 56 9.090 18.650 -9.091 1.00 4.46 C ATOM 0 H LEU A 56 6.181 15.477 -11.373 1.00 4.07 H new ATOM 0 HA LEU A 56 8.829 15.181 -10.345 1.00 4.10 H new ATOM 0 HB2 LEU A 56 7.764 17.080 -11.753 1.00 4.23 H new ATOM 0 HB3 LEU A 56 7.087 17.657 -10.242 1.00 4.23 H new ATOM 0 HG LEU A 56 10.018 17.127 -10.259 1.00 4.08 H new ATOM 0 HD11 LEU A 56 10.502 19.299 -11.314 1.00 4.10 H new ATOM 0 HD12 LEU A 56 9.710 18.176 -12.445 1.00 4.10 H new ATOM 0 HD13 LEU A 56 8.775 19.492 -11.697 1.00 4.10 H new ATOM 0 HD21 LEU A 56 10.022 19.181 -8.898 1.00 4.46 H new ATOM 0 HD22 LEU A 56 8.276 19.369 -9.185 1.00 4.46 H new ATOM 0 HD23 LEU A 56 8.881 17.971 -8.264 1.00 4.46 H new ATOM 686 N LYS A 57 6.376 15.832 -8.246 1.00 4.80 N ATOM 687 CA LYS A 57 6.013 15.855 -6.835 1.00 5.23 C ATOM 688 C LYS A 57 6.185 14.474 -6.210 1.00 5.23 C ATOM 689 O LYS A 57 6.609 14.351 -5.060 1.00 5.46 O ATOM 690 CB LYS A 57 4.568 16.327 -6.665 1.00 5.64 C ATOM 691 CG LYS A 57 4.419 17.840 -6.657 1.00 6.24 C ATOM 692 CD LYS A 57 2.970 18.257 -6.848 1.00 6.99 C ATOM 693 CE LYS A 57 2.279 18.501 -5.516 1.00 7.34 C ATOM 694 NZ LYS A 57 2.179 19.952 -5.200 1.00 7.88 N ATOM 0 H LYS A 57 5.590 15.949 -8.885 1.00 4.80 H new ATOM 0 HA LYS A 57 6.677 16.553 -6.325 1.00 5.23 H new ATOM 0 HB2 LYS A 57 3.963 15.915 -7.472 1.00 5.64 H new ATOM 0 HB3 LYS A 57 4.171 15.926 -5.732 1.00 5.64 H new ATOM 0 HG2 LYS A 57 4.792 18.239 -5.714 1.00 6.24 H new ATOM 0 HG3 LYS A 57 5.031 18.271 -7.450 1.00 6.24 H new ATOM 0 HD2 LYS A 57 2.928 19.163 -7.452 1.00 6.99 H new ATOM 0 HD3 LYS A 57 2.437 17.482 -7.399 1.00 6.99 H new ATOM 0 HE2 LYS A 57 1.280 18.065 -5.540 1.00 7.34 H new ATOM 0 HE3 LYS A 57 2.829 17.994 -4.723 1.00 7.34 H new ATOM 0 HZ1 LYS A 57 1.702 20.076 -4.284 1.00 7.88 H new ATOM 0 HZ2 LYS A 57 3.133 20.363 -5.152 1.00 7.88 H new ATOM 0 HZ3 LYS A 57 1.632 20.432 -5.943 1.00 7.88 H new ATOM 708 N GLU A 58 5.856 13.440 -6.974 1.00 5.03 N ATOM 709 CA GLU A 58 5.974 12.067 -6.496 1.00 5.07 C ATOM 710 C GLU A 58 7.407 11.564 -6.636 1.00 4.86 C ATOM 711 O GLU A 58 7.835 11.170 -7.721 1.00 4.45 O ATOM 712 CB GLU A 58 5.023 11.150 -7.269 1.00 4.92 C ATOM 713 CG GLU A 58 4.835 9.787 -6.625 1.00 4.89 C ATOM 714 CD GLU A 58 3.599 9.068 -7.132 1.00 5.24 C ATOM 715 OE1 GLU A 58 3.513 8.828 -8.355 1.00 5.46 O ATOM 716 OE2 GLU A 58 2.719 8.746 -6.307 1.00 5.64 O ATOM 0 H GLU A 58 5.505 13.525 -7.928 1.00 5.03 H new ATOM 0 HA GLU A 58 5.703 12.053 -5.440 1.00 5.07 H new ATOM 0 HB2 GLU A 58 4.052 11.638 -7.357 1.00 4.92 H new ATOM 0 HB3 GLU A 58 5.405 11.015 -8.281 1.00 4.92 H new ATOM 0 HG2 GLU A 58 5.714 9.173 -6.820 1.00 4.89 H new ATOM 0 HG3 GLU A 58 4.763 9.907 -5.544 1.00 4.89 H new ATOM 723 N LYS A 59 8.145 11.583 -5.531 1.00 5.20 N ATOM 724 CA LYS A 59 9.531 11.129 -5.530 1.00 5.13 C ATOM 725 C LYS A 59 9.622 9.661 -5.120 1.00 5.20 C ATOM 726 O LYS A 59 10.452 9.287 -4.292 1.00 5.39 O ATOM 727 CB LYS A 59 10.370 11.992 -4.585 1.00 5.48 C ATOM 728 CG LYS A 59 11.719 12.392 -5.161 1.00 5.67 C ATOM 729 CD LYS A 59 12.763 11.311 -4.935 1.00 5.78 C ATOM 730 CE LYS A 59 13.023 11.086 -3.455 1.00 6.30 C ATOM 731 NZ LYS A 59 13.166 12.370 -2.713 1.00 6.68 N ATOM 0 H LYS A 59 7.807 11.908 -4.625 1.00 5.20 H new ATOM 0 HA LYS A 59 9.923 11.228 -6.542 1.00 5.13 H new ATOM 0 HB2 LYS A 59 9.809 12.893 -4.336 1.00 5.48 H new ATOM 0 HB3 LYS A 59 10.529 11.447 -3.654 1.00 5.48 H new ATOM 0 HG2 LYS A 59 11.617 12.584 -6.229 1.00 5.67 H new ATOM 0 HG3 LYS A 59 12.051 13.322 -4.700 1.00 5.67 H new ATOM 0 HD2 LYS A 59 12.428 10.380 -5.392 1.00 5.78 H new ATOM 0 HD3 LYS A 59 13.693 11.593 -5.430 1.00 5.78 H new ATOM 0 HE2 LYS A 59 12.204 10.509 -3.026 1.00 6.30 H new ATOM 0 HE3 LYS A 59 13.929 10.493 -3.332 1.00 6.30 H new ATOM 0 HZ1 LYS A 59 13.587 12.187 -1.780 1.00 6.68 H new ATOM 0 HZ2 LYS A 59 13.781 13.015 -3.250 1.00 6.68 H new ATOM 0 HZ3 LYS A 59 12.230 12.806 -2.590 1.00 6.68 H new ATOM 745 N ARG A 60 8.764 8.834 -5.709 1.00 5.21 N ATOM 746 CA ARG A 60 8.747 7.408 -5.406 1.00 5.35 C ATOM 747 C ARG A 60 9.446 6.611 -6.503 1.00 4.93 C ATOM 748 O ARG A 60 10.092 7.181 -7.384 1.00 4.97 O ATOM 749 CB ARG A 60 7.305 6.920 -5.238 1.00 5.99 C ATOM 750 CG ARG A 60 6.941 6.588 -3.798 1.00 6.41 C ATOM 751 CD ARG A 60 6.800 5.090 -3.588 1.00 6.96 C ATOM 752 NE ARG A 60 7.265 4.676 -2.265 1.00 7.46 N ATOM 753 CZ ARG A 60 8.546 4.513 -1.947 1.00 7.92 C ATOM 754 NH1 ARG A 60 9.495 4.728 -2.851 1.00 7.98 N ATOM 755 NH2 ARG A 60 8.882 4.134 -0.722 1.00 8.57 N ATOM 0 H ARG A 60 8.072 9.127 -6.399 1.00 5.21 H new ATOM 0 HA ARG A 60 9.286 7.251 -4.472 1.00 5.35 H new ATOM 0 HB2 ARG A 60 6.625 7.687 -5.609 1.00 5.99 H new ATOM 0 HB3 ARG A 60 7.155 6.035 -5.856 1.00 5.99 H new ATOM 0 HG2 ARG A 60 7.707 6.979 -3.129 1.00 6.41 H new ATOM 0 HG3 ARG A 60 6.006 7.082 -3.535 1.00 6.41 H new ATOM 0 HD2 ARG A 60 5.756 4.803 -3.711 1.00 6.96 H new ATOM 0 HD3 ARG A 60 7.368 4.562 -4.354 1.00 6.96 H new ATOM 0 HE ARG A 60 6.566 4.502 -1.543 1.00 7.46 H new ATOM 0 HH11 ARG A 60 9.243 5.020 -3.795 1.00 7.98 H new ATOM 0 HH12 ARG A 60 10.476 4.601 -2.601 1.00 7.98 H new ATOM 0 HH21 ARG A 60 8.158 3.967 -0.023 1.00 8.57 H new ATOM 0 HH22 ARG A 60 9.865 4.009 -0.478 1.00 8.57 H new ATOM 769 N SER A 61 9.315 5.290 -6.443 1.00 4.83 N ATOM 770 CA SER A 61 9.936 4.413 -7.429 1.00 4.61 C ATOM 771 C SER A 61 9.295 4.593 -8.802 1.00 4.13 C ATOM 772 O SER A 61 9.988 4.806 -9.798 1.00 4.03 O ATOM 773 CB SER A 61 9.820 2.953 -6.987 1.00 5.04 C ATOM 774 OG SER A 61 10.822 2.627 -6.039 1.00 5.24 O ATOM 0 H SER A 61 8.784 4.803 -5.721 1.00 4.83 H new ATOM 0 HA SER A 61 10.990 4.682 -7.504 1.00 4.61 H new ATOM 0 HB2 SER A 61 8.835 2.778 -6.555 1.00 5.04 H new ATOM 0 HB3 SER A 61 9.909 2.299 -7.854 1.00 5.04 H new ATOM 0 HG SER A 61 10.726 1.689 -5.771 1.00 5.24 H new ATOM 780 N ILE A 62 7.970 4.505 -8.849 1.00 4.14 N ATOM 781 CA ILE A 62 7.239 4.656 -10.103 1.00 3.76 C ATOM 782 C ILE A 62 6.089 5.649 -9.956 1.00 3.85 C ATOM 783 O ILE A 62 5.605 5.893 -8.851 1.00 4.26 O ATOM 784 CB ILE A 62 6.690 3.300 -10.596 1.00 3.79 C ATOM 785 CG1 ILE A 62 6.185 3.423 -12.035 1.00 3.63 C ATOM 786 CG2 ILE A 62 5.581 2.801 -9.678 1.00 4.21 C ATOM 787 CD1 ILE A 62 7.247 3.887 -13.008 1.00 3.32 C ATOM 0 H ILE A 62 7.381 4.330 -8.035 1.00 4.14 H new ATOM 0 HA ILE A 62 7.944 5.040 -10.840 1.00 3.76 H new ATOM 0 HB ILE A 62 7.500 2.571 -10.574 1.00 3.79 H new ATOM 0 HG12 ILE A 62 5.802 2.456 -12.361 1.00 3.63 H new ATOM 0 HG13 ILE A 62 5.349 4.122 -12.060 1.00 3.63 H new ATOM 0 HG21 ILE A 62 5.209 1.844 -10.044 1.00 4.21 H new ATOM 0 HG22 ILE A 62 5.973 2.676 -8.669 1.00 4.21 H new ATOM 0 HG23 ILE A 62 4.767 3.526 -9.664 1.00 4.21 H new ATOM 0 HD11 ILE A 62 6.820 3.952 -14.009 1.00 3.32 H new ATOM 0 HD12 ILE A 62 7.614 4.868 -12.706 1.00 3.32 H new ATOM 0 HD13 ILE A 62 8.073 3.176 -13.011 1.00 3.32 H new ATOM 799 N LYS A 63 5.658 6.222 -11.077 1.00 3.56 N ATOM 800 CA LYS A 63 4.567 7.190 -11.069 1.00 3.75 C ATOM 801 C LYS A 63 3.269 6.560 -11.570 1.00 3.83 C ATOM 802 O LYS A 63 2.394 6.209 -10.779 1.00 4.22 O ATOM 803 CB LYS A 63 4.926 8.402 -11.930 1.00 3.56 C ATOM 804 CG LYS A 63 5.878 9.371 -11.250 1.00 3.63 C ATOM 805 CD LYS A 63 7.173 8.687 -10.842 1.00 3.59 C ATOM 806 CE LYS A 63 8.268 9.699 -10.545 1.00 3.88 C ATOM 807 NZ LYS A 63 9.339 9.123 -9.687 1.00 4.11 N ATOM 0 H LYS A 63 6.047 6.033 -12.000 1.00 3.56 H new ATOM 0 HA LYS A 63 4.414 7.516 -10.040 1.00 3.75 H new ATOM 0 HB2 LYS A 63 5.377 8.056 -12.860 1.00 3.56 H new ATOM 0 HB3 LYS A 63 4.011 8.931 -12.197 1.00 3.56 H new ATOM 0 HG2 LYS A 63 6.099 10.198 -11.924 1.00 3.63 H new ATOM 0 HG3 LYS A 63 5.397 9.797 -10.369 1.00 3.63 H new ATOM 0 HD2 LYS A 63 6.998 8.070 -9.961 1.00 3.59 H new ATOM 0 HD3 LYS A 63 7.500 8.019 -11.639 1.00 3.59 H new ATOM 0 HE2 LYS A 63 8.702 10.049 -11.481 1.00 3.88 H new ATOM 0 HE3 LYS A 63 7.835 10.568 -10.050 1.00 3.88 H new ATOM 0 HZ1 LYS A 63 9.805 9.885 -9.155 1.00 4.11 H new ATOM 0 HZ2 LYS A 63 8.922 8.441 -9.022 1.00 4.11 H new ATOM 0 HZ3 LYS A 63 10.040 8.640 -10.284 1.00 4.11 H new ATOM 821 N LYS A 64 3.149 6.421 -12.888 1.00 3.50 N ATOM 822 CA LYS A 64 1.955 5.835 -13.488 1.00 3.58 C ATOM 823 C LYS A 64 2.315 4.708 -14.447 1.00 3.18 C ATOM 824 O LYS A 64 3.249 4.830 -15.240 1.00 2.82 O ATOM 825 CB LYS A 64 1.149 6.901 -14.221 1.00 3.72 C ATOM 826 CG LYS A 64 -0.347 6.687 -14.106 1.00 4.13 C ATOM 827 CD LYS A 64 -1.106 7.991 -14.214 1.00 4.51 C ATOM 828 CE LYS A 64 -1.380 8.315 -15.661 1.00 4.52 C ATOM 829 NZ LYS A 64 -2.336 9.447 -15.815 1.00 4.99 N ATOM 0 H LYS A 64 3.863 6.706 -13.559 1.00 3.50 H new ATOM 0 HA LYS A 64 1.349 5.419 -12.683 1.00 3.58 H new ATOM 0 HB2 LYS A 64 1.403 7.882 -13.820 1.00 3.72 H new ATOM 0 HB3 LYS A 64 1.431 6.904 -15.274 1.00 3.72 H new ATOM 0 HG2 LYS A 64 -0.679 6.006 -14.890 1.00 4.13 H new ATOM 0 HG3 LYS A 64 -0.575 6.211 -13.152 1.00 4.13 H new ATOM 0 HD2 LYS A 64 -2.045 7.920 -13.665 1.00 4.51 H new ATOM 0 HD3 LYS A 64 -0.529 8.795 -13.756 1.00 4.51 H new ATOM 0 HE2 LYS A 64 -0.443 8.563 -16.159 1.00 4.52 H new ATOM 0 HE3 LYS A 64 -1.782 7.433 -16.159 1.00 4.52 H new ATOM 0 HZ1 LYS A 64 -2.206 9.887 -16.749 1.00 4.99 H new ATOM 0 HZ2 LYS A 64 -3.310 9.092 -15.732 1.00 4.99 H new ATOM 0 HZ3 LYS A 64 -2.160 10.153 -15.072 1.00 4.99 H new ATOM 843 N VAL A 65 1.573 3.608 -14.365 1.00 3.28 N ATOM 844 CA VAL A 65 1.821 2.459 -15.219 1.00 2.94 C ATOM 845 C VAL A 65 0.565 2.040 -15.979 1.00 3.04 C ATOM 846 O VAL A 65 -0.534 2.020 -15.427 1.00 3.44 O ATOM 847 CB VAL A 65 2.303 1.261 -14.395 1.00 3.02 C ATOM 848 CG1 VAL A 65 2.891 0.184 -15.290 1.00 2.74 C ATOM 849 CG2 VAL A 65 3.308 1.695 -13.336 1.00 3.19 C ATOM 0 H VAL A 65 0.796 3.491 -13.715 1.00 3.28 H new ATOM 0 HA VAL A 65 2.590 2.760 -15.930 1.00 2.94 H new ATOM 0 HB VAL A 65 1.438 0.838 -13.885 1.00 3.02 H new ATOM 0 HG11 VAL A 65 3.225 -0.654 -14.679 1.00 2.74 H new ATOM 0 HG12 VAL A 65 2.132 -0.159 -15.993 1.00 2.74 H new ATOM 0 HG13 VAL A 65 3.738 0.592 -15.841 1.00 2.74 H new ATOM 0 HG21 VAL A 65 3.634 0.825 -12.765 1.00 3.19 H new ATOM 0 HG22 VAL A 65 4.170 2.156 -13.819 1.00 3.19 H new ATOM 0 HG23 VAL A 65 2.841 2.415 -12.664 1.00 3.19 H new ATOM 859 N TRP A 66 0.751 1.701 -17.246 1.00 2.69 N ATOM 860 CA TRP A 66 -0.356 1.267 -18.106 1.00 2.79 C ATOM 861 C TRP A 66 -0.392 -0.240 -18.274 1.00 2.61 C ATOM 862 O TRP A 66 0.638 -0.871 -18.479 1.00 2.27 O ATOM 863 CB TRP A 66 -0.242 1.872 -19.497 1.00 2.65 C ATOM 864 CG TRP A 66 -0.572 3.314 -19.536 1.00 2.99 C ATOM 865 CD1 TRP A 66 -1.707 3.939 -19.969 1.00 3.43 C ATOM 866 CD2 TRP A 66 0.295 4.308 -19.099 1.00 2.95 C ATOM 867 NE1 TRP A 66 -1.562 5.302 -19.812 1.00 3.66 N ATOM 868 CE2 TRP A 66 -0.322 5.544 -19.274 1.00 3.36 C ATOM 869 CE3 TRP A 66 1.554 4.235 -18.573 1.00 2.64 C ATOM 870 CZ2 TRP A 66 0.310 6.729 -18.926 1.00 3.44 C ATOM 871 CZ3 TRP A 66 2.191 5.390 -18.223 1.00 2.71 C ATOM 872 CH2 TRP A 66 1.573 6.636 -18.398 1.00 3.10 C ATOM 0 H TRP A 66 1.660 1.716 -17.709 1.00 2.69 H new ATOM 0 HA TRP A 66 -1.266 1.606 -17.610 1.00 2.79 H new ATOM 0 HB2 TRP A 66 0.774 1.728 -19.866 1.00 2.65 H new ATOM 0 HB3 TRP A 66 -0.906 1.336 -20.175 1.00 2.65 H new ATOM 0 HD1 TRP A 66 -2.579 3.445 -20.370 1.00 3.43 H new ATOM 0 HE1 TRP A 66 -2.257 6.009 -20.054 1.00 3.66 H new ATOM 0 HE3 TRP A 66 2.037 3.279 -18.436 1.00 2.64 H new ATOM 0 HZ2 TRP A 66 -0.172 7.685 -19.065 1.00 3.44 H new ATOM 0 HZ3 TRP A 66 3.186 5.343 -17.805 1.00 2.71 H new ATOM 0 HH2 TRP A 66 2.098 7.536 -18.113 1.00 3.10 H new ATOM 883 N THR A 67 -1.590 -0.805 -18.249 1.00 2.89 N ATOM 884 CA THR A 67 -1.757 -2.235 -18.461 1.00 2.80 C ATOM 885 C THR A 67 -2.511 -2.462 -19.764 1.00 2.75 C ATOM 886 O THR A 67 -3.573 -1.885 -19.989 1.00 3.08 O ATOM 887 CB THR A 67 -2.486 -2.891 -17.290 1.00 3.23 C ATOM 888 OG1 THR A 67 -2.604 -1.993 -16.200 1.00 3.54 O ATOM 889 CG2 THR A 67 -1.787 -4.138 -16.787 1.00 3.19 C ATOM 0 H THR A 67 -2.459 -0.297 -18.084 1.00 2.89 H new ATOM 0 HA THR A 67 -0.773 -2.699 -18.526 1.00 2.80 H new ATOM 0 HB THR A 67 -3.468 -3.167 -17.674 1.00 3.23 H new ATOM 0 HG1 THR A 67 -3.075 -2.434 -15.463 1.00 3.54 H new ATOM 0 HG21 THR A 67 -2.351 -4.560 -15.955 1.00 3.19 H new ATOM 0 HG22 THR A 67 -1.725 -4.870 -17.592 1.00 3.19 H new ATOM 0 HG23 THR A 67 -0.782 -3.882 -16.451 1.00 3.19 H new ATOM 897 N PHE A 68 -1.939 -3.281 -20.633 1.00 2.38 N ATOM 898 CA PHE A 68 -2.537 -3.561 -21.931 1.00 2.35 C ATOM 899 C PHE A 68 -2.938 -5.024 -22.050 1.00 2.38 C ATOM 900 O PHE A 68 -2.266 -5.906 -21.517 1.00 2.27 O ATOM 901 CB PHE A 68 -1.555 -3.211 -23.058 1.00 1.97 C ATOM 902 CG PHE A 68 -0.920 -1.848 -22.941 1.00 2.03 C ATOM 903 CD1 PHE A 68 -0.169 -1.497 -21.827 1.00 2.37 C ATOM 904 CD2 PHE A 68 -1.070 -0.918 -23.957 1.00 2.39 C ATOM 905 CE1 PHE A 68 0.413 -0.246 -21.732 1.00 2.48 C ATOM 906 CE2 PHE A 68 -0.491 0.333 -23.866 1.00 2.49 C ATOM 907 CZ PHE A 68 0.250 0.670 -22.753 1.00 2.27 C ATOM 0 H PHE A 68 -1.058 -3.766 -20.463 1.00 2.38 H new ATOM 0 HA PHE A 68 -3.432 -2.945 -22.021 1.00 2.35 H new ATOM 0 HB2 PHE A 68 -0.767 -3.963 -23.081 1.00 1.97 H new ATOM 0 HB3 PHE A 68 -2.081 -3.271 -24.011 1.00 1.97 H new ATOM 0 HD1 PHE A 68 -0.038 -2.209 -21.026 1.00 2.37 H new ATOM 0 HD2 PHE A 68 -1.648 -1.175 -24.833 1.00 2.39 H new ATOM 0 HE1 PHE A 68 0.995 0.015 -20.860 1.00 2.48 H new ATOM 0 HE2 PHE A 68 -0.619 1.047 -24.666 1.00 2.49 H new ATOM 0 HZ PHE A 68 0.702 1.648 -22.680 1.00 2.27 H new ATOM 917 N GLY A 69 -4.036 -5.278 -22.758 1.00 2.62 N ATOM 918 CA GLY A 69 -4.499 -6.639 -22.937 1.00 2.68 C ATOM 919 C GLY A 69 -5.956 -6.712 -23.353 1.00 3.09 C ATOM 920 O GLY A 69 -6.557 -5.701 -23.719 1.00 3.33 O ATOM 0 H GLY A 69 -4.610 -4.566 -23.209 1.00 2.62 H new ATOM 0 HA2 GLY A 69 -3.885 -7.131 -23.691 1.00 2.68 H new ATOM 0 HA3 GLY A 69 -4.363 -7.190 -22.006 1.00 2.68 H new ATOM 924 N ARG A 70 -6.523 -7.913 -23.299 1.00 3.22 N ATOM 925 CA ARG A 70 -7.919 -8.122 -23.676 1.00 3.61 C ATOM 926 C ARG A 70 -8.870 -7.797 -22.523 1.00 4.09 C ATOM 927 O ARG A 70 -10.080 -7.994 -22.636 1.00 4.52 O ATOM 928 CB ARG A 70 -8.131 -9.569 -24.120 1.00 3.58 C ATOM 929 CG ARG A 70 -7.611 -9.855 -25.518 1.00 3.22 C ATOM 930 CD ARG A 70 -6.859 -11.175 -25.576 1.00 3.15 C ATOM 931 NE ARG A 70 -7.729 -12.315 -25.286 1.00 3.68 N ATOM 932 CZ ARG A 70 -7.787 -12.931 -24.104 1.00 3.99 C ATOM 933 NH1 ARG A 70 -7.033 -12.523 -23.091 1.00 3.97 N ATOM 934 NH2 ARG A 70 -8.605 -13.962 -23.937 1.00 4.70 N ATOM 0 H ARG A 70 -6.038 -8.758 -22.998 1.00 3.22 H new ATOM 0 HA ARG A 70 -8.142 -7.446 -24.501 1.00 3.61 H new ATOM 0 HB2 ARG A 70 -7.635 -10.234 -23.413 1.00 3.58 H new ATOM 0 HB3 ARG A 70 -9.196 -9.800 -24.082 1.00 3.58 H new ATOM 0 HG2 ARG A 70 -8.445 -9.880 -26.219 1.00 3.22 H new ATOM 0 HG3 ARG A 70 -6.952 -9.046 -25.834 1.00 3.22 H new ATOM 0 HD2 ARG A 70 -6.418 -11.298 -26.565 1.00 3.15 H new ATOM 0 HD3 ARG A 70 -6.037 -11.155 -24.861 1.00 3.15 H new ATOM 0 HE ARG A 70 -8.329 -12.661 -26.035 1.00 3.68 H new ATOM 0 HH11 ARG A 70 -6.401 -11.731 -23.212 1.00 3.97 H new ATOM 0 HH12 ARG A 70 -7.085 -13.001 -22.191 1.00 3.97 H new ATOM 0 HH21 ARG A 70 -9.187 -14.282 -24.711 1.00 4.70 H new ATOM 0 HH22 ARG A 70 -8.652 -14.435 -23.035 1.00 4.70 H new ATOM 948 N ASN A 71 -8.322 -7.305 -21.415 1.00 4.05 N ATOM 949 CA ASN A 71 -9.133 -6.967 -20.251 1.00 4.52 C ATOM 950 C ASN A 71 -9.715 -5.559 -20.373 1.00 4.74 C ATOM 951 O ASN A 71 -9.004 -4.613 -20.715 1.00 4.50 O ATOM 952 CB ASN A 71 -8.295 -7.070 -18.976 1.00 4.52 C ATOM 953 CG ASN A 71 -9.148 -7.120 -17.725 1.00 4.98 C ATOM 954 OD1 ASN A 71 -8.964 -6.329 -16.800 1.00 5.21 O ATOM 955 ND2 ASN A 71 -10.091 -8.055 -17.689 1.00 5.40 N ATOM 0 H ASN A 71 -7.323 -7.132 -21.300 1.00 4.05 H new ATOM 0 HA ASN A 71 -9.959 -7.677 -20.201 1.00 4.52 H new ATOM 0 HB2 ASN A 71 -7.674 -7.964 -19.024 1.00 4.52 H new ATOM 0 HB3 ASN A 71 -7.620 -6.216 -18.918 1.00 4.52 H new ATOM 0 HD21 ASN A 71 -10.697 -8.137 -16.872 1.00 5.40 H new ATOM 0 HD22 ASN A 71 -10.209 -8.691 -18.478 1.00 5.40 H new ATOM 962 N PRO A 72 -11.020 -5.395 -20.085 1.00 5.25 N ATOM 963 CA PRO A 72 -11.687 -4.092 -20.154 1.00 5.56 C ATOM 964 C PRO A 72 -11.171 -3.135 -19.085 1.00 5.60 C ATOM 965 O PRO A 72 -11.419 -1.930 -19.142 1.00 5.80 O ATOM 966 CB PRO A 72 -13.169 -4.415 -19.905 1.00 6.09 C ATOM 967 CG PRO A 72 -13.285 -5.898 -20.034 1.00 6.05 C ATOM 968 CD PRO A 72 -11.943 -6.456 -19.661 1.00 5.59 C ATOM 0 HA PRO A 72 -11.508 -3.597 -21.109 1.00 5.56 H new ATOM 0 HB2 PRO A 72 -13.482 -4.082 -18.915 1.00 6.09 H new ATOM 0 HB3 PRO A 72 -13.807 -3.908 -20.628 1.00 6.09 H new ATOM 0 HG2 PRO A 72 -14.064 -6.286 -19.378 1.00 6.05 H new ATOM 0 HG3 PRO A 72 -13.555 -6.180 -21.052 1.00 6.05 H new ATOM 0 HD2 PRO A 72 -11.870 -6.652 -18.591 1.00 5.59 H new ATOM 0 HD3 PRO A 72 -11.740 -7.397 -20.172 1.00 5.59 H new ATOM 976 N ALA A 73 -10.432 -3.678 -18.122 1.00 5.45 N ATOM 977 CA ALA A 73 -9.858 -2.885 -17.057 1.00 5.49 C ATOM 978 C ALA A 73 -8.563 -2.292 -17.531 1.00 5.04 C ATOM 979 O ALA A 73 -8.260 -1.121 -17.297 1.00 5.09 O ATOM 980 CB ALA A 73 -9.608 -3.728 -15.822 1.00 5.58 C ATOM 0 H ALA A 73 -10.219 -4.674 -18.064 1.00 5.45 H new ATOM 0 HA ALA A 73 -10.561 -2.095 -16.793 1.00 5.49 H new ATOM 0 HB1 ALA A 73 -9.176 -3.106 -15.038 1.00 5.58 H new ATOM 0 HB2 ALA A 73 -10.550 -4.150 -15.473 1.00 5.58 H new ATOM 0 HB3 ALA A 73 -8.917 -4.535 -16.066 1.00 5.58 H new ATOM 986 N CYS A 74 -7.807 -3.136 -18.213 1.00 4.62 N ATOM 987 CA CYS A 74 -6.533 -2.765 -18.760 1.00 4.16 C ATOM 988 C CYS A 74 -6.583 -1.383 -19.373 1.00 4.23 C ATOM 989 O CYS A 74 -7.519 -1.042 -20.096 1.00 4.51 O ATOM 990 CB CYS A 74 -6.133 -3.769 -19.816 1.00 3.77 C ATOM 991 SG CYS A 74 -4.645 -4.715 -19.425 1.00 3.33 S ATOM 0 H CYS A 74 -8.071 -4.104 -18.399 1.00 4.62 H new ATOM 0 HA CYS A 74 -5.801 -2.755 -17.953 1.00 4.16 H new ATOM 0 HB2 CYS A 74 -6.959 -4.463 -19.971 1.00 3.77 H new ATOM 0 HB3 CYS A 74 -5.977 -3.244 -20.758 1.00 3.77 H new ATOM 0 HG CYS A 74 -4.424 -4.667 -18.145 1.00 3.33 H new ATOM 997 N ASP A 75 -5.561 -0.605 -19.099 1.00 4.03 N ATOM 998 CA ASP A 75 -5.474 0.736 -19.650 1.00 4.13 C ATOM 999 C ASP A 75 -5.573 0.682 -21.176 1.00 4.04 C ATOM 1000 O ASP A 75 -5.871 1.685 -21.824 1.00 4.31 O ATOM 1001 CB ASP A 75 -4.164 1.403 -19.228 1.00 3.85 C ATOM 1002 CG ASP A 75 -4.055 1.565 -17.725 1.00 4.37 C ATOM 1003 OD1 ASP A 75 -3.591 0.617 -17.057 1.00 4.99 O ATOM 1004 OD2 ASP A 75 -4.437 2.639 -17.214 1.00 4.46 O ATOM 0 H ASP A 75 -4.779 -0.872 -18.501 1.00 4.03 H new ATOM 0 HA ASP A 75 -6.303 1.328 -19.263 1.00 4.13 H new ATOM 0 HB2 ASP A 75 -3.324 0.808 -19.588 1.00 3.85 H new ATOM 0 HB3 ASP A 75 -4.089 2.381 -19.702 1.00 3.85 H new ATOM 1009 N TYR A 76 -5.334 -0.506 -21.746 1.00 3.73 N ATOM 1010 CA TYR A 76 -5.412 -0.691 -23.191 1.00 3.69 C ATOM 1011 C TYR A 76 -6.262 -1.910 -23.529 1.00 3.76 C ATOM 1012 O TYR A 76 -5.909 -3.038 -23.182 1.00 3.51 O ATOM 1013 CB TYR A 76 -4.012 -0.850 -23.782 1.00 3.22 C ATOM 1014 CG TYR A 76 -3.949 -0.639 -25.277 1.00 3.30 C ATOM 1015 CD1 TYR A 76 -3.944 0.640 -25.820 1.00 3.60 C ATOM 1016 CD2 TYR A 76 -3.883 -1.719 -26.147 1.00 3.54 C ATOM 1017 CE1 TYR A 76 -3.876 0.834 -27.187 1.00 3.79 C ATOM 1018 CE2 TYR A 76 -3.816 -1.534 -27.514 1.00 3.70 C ATOM 1019 CZ TYR A 76 -3.812 -0.256 -28.028 1.00 3.67 C ATOM 1020 OH TYR A 76 -3.743 -0.066 -29.390 1.00 3.95 O ATOM 0 H TYR A 76 -5.086 -1.348 -21.226 1.00 3.73 H new ATOM 0 HA TYR A 76 -5.880 0.192 -23.625 1.00 3.69 H new ATOM 0 HB2 TYR A 76 -3.341 -0.141 -23.297 1.00 3.22 H new ATOM 0 HB3 TYR A 76 -3.642 -1.849 -23.550 1.00 3.22 H new ATOM 0 HD1 TYR A 76 -3.994 1.496 -25.164 1.00 3.60 H new ATOM 0 HD2 TYR A 76 -3.884 -2.722 -25.747 1.00 3.54 H new ATOM 0 HE1 TYR A 76 -3.873 1.834 -27.594 1.00 3.79 H new ATOM 0 HE2 TYR A 76 -3.767 -2.386 -28.176 1.00 3.70 H new ATOM 0 HH TYR A 76 -4.498 0.487 -29.682 1.00 3.95 H new ATOM 1030 N HIS A 77 -7.384 -1.682 -24.201 1.00 4.12 N ATOM 1031 CA HIS A 77 -8.279 -2.772 -24.573 1.00 4.23 C ATOM 1032 C HIS A 77 -8.071 -3.179 -26.028 1.00 4.06 C ATOM 1033 O HIS A 77 -8.267 -2.379 -26.942 1.00 4.28 O ATOM 1034 CB HIS A 77 -9.736 -2.364 -24.348 1.00 4.81 C ATOM 1035 CG HIS A 77 -10.647 -3.521 -24.082 1.00 4.94 C ATOM 1036 ND1 HIS A 77 -10.440 -4.673 -23.400 1.00 5.37 N flip ATOM 1037 CD2 HIS A 77 -11.947 -3.578 -24.540 1.00 4.74 C flip ATOM 1038 CE1 HIS A 77 -11.607 -5.395 -23.458 1.00 5.42 C flip ATOM 1039 NE2 HIS A 77 -12.500 -4.713 -24.150 1.00 5.06 N flip ATOM 0 H HIS A 77 -7.695 -0.757 -24.498 1.00 4.12 H new ATOM 0 HA HIS A 77 -8.047 -3.629 -23.940 1.00 4.23 H new ATOM 0 HB2 HIS A 77 -9.785 -1.672 -23.507 1.00 4.81 H new ATOM 0 HB3 HIS A 77 -10.093 -1.825 -25.225 1.00 4.81 H new ATOM 0 HD2 HIS A 77 -12.436 -2.814 -25.126 1.00 4.74 H new ATOM 0 HE1 HIS A 77 -11.768 -6.364 -23.010 1.00 5.42 H new ATOM 0 HE2 HIS A 77 -13.455 -5.011 -24.350 1.00 5.06 H new ATOM 1048 N LEU A 78 -7.680 -4.433 -26.235 1.00 3.73 N ATOM 1049 CA LEU A 78 -7.451 -4.951 -27.578 1.00 3.59 C ATOM 1050 C LEU A 78 -8.748 -5.491 -28.174 1.00 3.85 C ATOM 1051 O LEU A 78 -9.832 -5.252 -27.642 1.00 4.29 O ATOM 1052 CB LEU A 78 -6.392 -6.056 -27.552 1.00 3.08 C ATOM 1053 CG LEU A 78 -5.220 -5.815 -26.599 1.00 2.88 C ATOM 1054 CD1 LEU A 78 -4.585 -7.135 -26.191 1.00 2.85 C ATOM 1055 CD2 LEU A 78 -4.187 -4.904 -27.245 1.00 3.03 C ATOM 0 H LEU A 78 -7.515 -5.109 -25.489 1.00 3.73 H new ATOM 0 HA LEU A 78 -7.093 -4.132 -28.201 1.00 3.59 H new ATOM 0 HB2 LEU A 78 -6.875 -6.994 -27.277 1.00 3.08 H new ATOM 0 HB3 LEU A 78 -5.999 -6.184 -28.561 1.00 3.08 H new ATOM 0 HG LEU A 78 -5.600 -5.324 -25.703 1.00 2.88 H new ATOM 0 HD11 LEU A 78 -3.753 -6.944 -25.513 1.00 2.85 H new ATOM 0 HD12 LEU A 78 -5.327 -7.756 -25.689 1.00 2.85 H new ATOM 0 HD13 LEU A 78 -4.219 -7.652 -27.078 1.00 2.85 H new ATOM 0 HD21 LEU A 78 -3.360 -4.743 -26.553 1.00 3.03 H new ATOM 0 HD22 LEU A 78 -3.812 -5.368 -28.157 1.00 3.03 H new ATOM 0 HD23 LEU A 78 -4.648 -3.947 -27.488 1.00 3.03 H new ATOM 1067 N GLY A 79 -8.630 -6.221 -29.277 1.00 3.85 N ATOM 1068 CA GLY A 79 -9.801 -6.784 -29.921 1.00 4.10 C ATOM 1069 C GLY A 79 -10.305 -8.028 -29.215 1.00 4.04 C ATOM 1070 O GLY A 79 -11.300 -7.980 -28.491 1.00 4.49 O ATOM 0 H GLY A 79 -7.744 -6.433 -29.737 1.00 3.85 H new ATOM 0 HA2 GLY A 79 -10.594 -6.037 -29.945 1.00 4.10 H new ATOM 0 HA3 GLY A 79 -9.561 -7.028 -30.956 1.00 4.10 H new ATOM 1074 N ASN A 80 -9.613 -9.144 -29.422 1.00 3.75 N ATOM 1075 CA ASN A 80 -9.989 -10.410 -28.801 1.00 3.74 C ATOM 1076 C ASN A 80 -9.101 -11.544 -29.302 1.00 3.42 C ATOM 1077 O ASN A 80 -9.506 -12.331 -30.156 1.00 3.54 O ATOM 1078 CB ASN A 80 -11.458 -10.735 -29.087 1.00 4.26 C ATOM 1079 CG ASN A 80 -11.820 -10.541 -30.547 1.00 4.72 C ATOM 1080 OD1 ASN A 80 -12.610 -9.513 -30.830 1.00 5.14 O flip ATOM 1081 ND2 ASN A 80 -11.394 -11.309 -31.411 1.00 5.02 N flip ATOM 0 H ASN A 80 -8.786 -9.197 -30.017 1.00 3.75 H new ATOM 0 HA ASN A 80 -9.853 -10.309 -27.724 1.00 3.74 H new ATOM 0 HB2 ASN A 80 -11.662 -11.766 -28.799 1.00 4.26 H new ATOM 0 HB3 ASN A 80 -12.094 -10.100 -28.470 1.00 4.26 H new ATOM 0 HD21 ASN A 80 -10.789 -12.087 -31.148 1.00 5.02 H new ATOM 0 HD22 ASN A 80 -11.646 -11.167 -32.389 1.00 5.02 H new ATOM 1088 N ILE A 81 -7.886 -11.620 -28.767 1.00 3.05 N ATOM 1089 CA ILE A 81 -6.941 -12.657 -29.167 1.00 2.81 C ATOM 1090 C ILE A 81 -6.724 -13.672 -28.047 1.00 2.80 C ATOM 1091 O ILE A 81 -6.133 -13.358 -27.016 1.00 2.76 O ATOM 1092 CB ILE A 81 -5.583 -12.053 -29.567 1.00 2.54 C ATOM 1093 CG1 ILE A 81 -5.782 -10.896 -30.547 1.00 2.70 C ATOM 1094 CG2 ILE A 81 -4.686 -13.121 -30.176 1.00 2.50 C ATOM 1095 CD1 ILE A 81 -6.528 -11.291 -31.804 1.00 2.80 C ATOM 0 H ILE A 81 -7.534 -10.978 -28.057 1.00 3.05 H new ATOM 0 HA ILE A 81 -7.375 -13.163 -30.029 1.00 2.81 H new ATOM 0 HB ILE A 81 -5.098 -11.666 -28.671 1.00 2.54 H new ATOM 0 HG12 ILE A 81 -6.328 -10.096 -30.046 1.00 2.70 H new ATOM 0 HG13 ILE A 81 -4.808 -10.493 -30.824 1.00 2.70 H new ATOM 0 HG21 ILE A 81 -3.730 -12.678 -30.454 1.00 2.50 H new ATOM 0 HG22 ILE A 81 -4.520 -13.915 -29.448 1.00 2.50 H new ATOM 0 HG23 ILE A 81 -5.165 -13.536 -31.063 1.00 2.50 H new ATOM 0 HD11 ILE A 81 -6.633 -10.422 -32.453 1.00 2.80 H new ATOM 0 HD12 ILE A 81 -5.973 -12.070 -32.327 1.00 2.80 H new ATOM 0 HD13 ILE A 81 -7.516 -11.666 -31.538 1.00 2.80 H new ATOM 1107 N SER A 82 -7.202 -14.893 -28.260 1.00 2.92 N ATOM 1108 CA SER A 82 -7.060 -15.953 -27.266 1.00 3.06 C ATOM 1109 C SER A 82 -5.599 -16.152 -26.877 1.00 2.92 C ATOM 1110 O SER A 82 -5.295 -16.542 -25.749 1.00 3.12 O ATOM 1111 CB SER A 82 -7.640 -17.263 -27.803 1.00 3.24 C ATOM 1112 OG SER A 82 -9.054 -17.273 -27.706 1.00 3.52 O ATOM 0 H SER A 82 -7.691 -15.174 -29.110 1.00 2.92 H new ATOM 0 HA SER A 82 -7.612 -15.654 -26.375 1.00 3.06 H new ATOM 0 HB2 SER A 82 -7.343 -17.396 -28.843 1.00 3.24 H new ATOM 0 HB3 SER A 82 -7.228 -18.103 -27.244 1.00 3.24 H new ATOM 0 HG SER A 82 -9.400 -18.120 -28.057 1.00 3.52 H new ATOM 1118 N ARG A 83 -4.696 -15.882 -27.814 1.00 2.68 N ATOM 1119 CA ARG A 83 -3.267 -16.031 -27.561 1.00 2.66 C ATOM 1120 C ARG A 83 -2.781 -14.988 -26.560 1.00 2.53 C ATOM 1121 O ARG A 83 -1.853 -15.239 -25.790 1.00 2.65 O ATOM 1122 CB ARG A 83 -2.479 -15.911 -28.866 1.00 2.61 C ATOM 1123 CG ARG A 83 -2.537 -17.161 -29.731 1.00 2.92 C ATOM 1124 CD ARG A 83 -1.155 -17.581 -30.204 1.00 3.06 C ATOM 1125 NE ARG A 83 -1.084 -19.012 -30.487 1.00 3.38 N ATOM 1126 CZ ARG A 83 -1.205 -19.958 -29.559 1.00 3.62 C ATOM 1127 NH1 ARG A 83 -1.403 -19.631 -28.289 1.00 3.91 N ATOM 1128 NH2 ARG A 83 -1.128 -21.236 -29.903 1.00 3.96 N ATOM 0 H ARG A 83 -4.927 -15.560 -28.754 1.00 2.68 H new ATOM 0 HA ARG A 83 -3.100 -17.021 -27.137 1.00 2.66 H new ATOM 0 HB2 ARG A 83 -2.865 -15.066 -29.437 1.00 2.61 H new ATOM 0 HB3 ARG A 83 -1.438 -15.689 -28.633 1.00 2.61 H new ATOM 0 HG2 ARG A 83 -2.991 -17.975 -29.165 1.00 2.92 H new ATOM 0 HG3 ARG A 83 -3.177 -16.977 -30.594 1.00 2.92 H new ATOM 0 HD2 ARG A 83 -0.893 -17.021 -31.102 1.00 3.06 H new ATOM 0 HD3 ARG A 83 -0.418 -17.325 -29.443 1.00 3.06 H new ATOM 0 HE ARG A 83 -0.933 -19.303 -31.453 1.00 3.38 H new ATOM 0 HH11 ARG A 83 -1.463 -18.649 -28.019 1.00 3.91 H new ATOM 0 HH12 ARG A 83 -1.495 -20.361 -27.583 1.00 3.91 H new ATOM 0 HH21 ARG A 83 -0.976 -21.493 -30.878 1.00 3.96 H new ATOM 0 HH22 ARG A 83 -1.221 -21.962 -29.192 1.00 3.96 H new ATOM 1142 N LEU A 84 -3.413 -13.820 -26.574 1.00 2.35 N ATOM 1143 CA LEU A 84 -3.044 -12.743 -25.663 1.00 2.23 C ATOM 1144 C LEU A 84 -3.808 -12.863 -24.348 1.00 2.52 C ATOM 1145 O LEU A 84 -4.913 -13.404 -24.313 1.00 2.76 O ATOM 1146 CB LEU A 84 -3.317 -11.382 -26.306 1.00 2.05 C ATOM 1147 CG LEU A 84 -2.765 -11.211 -27.722 1.00 1.95 C ATOM 1148 CD1 LEU A 84 -3.191 -9.872 -28.303 1.00 2.13 C ATOM 1149 CD2 LEU A 84 -1.248 -11.334 -27.719 1.00 1.97 C ATOM 0 H LEU A 84 -4.182 -13.595 -27.205 1.00 2.35 H new ATOM 0 HA LEU A 84 -1.978 -12.826 -25.454 1.00 2.23 H new ATOM 0 HB2 LEU A 84 -4.394 -11.219 -26.331 1.00 2.05 H new ATOM 0 HB3 LEU A 84 -2.891 -10.605 -25.671 1.00 2.05 H new ATOM 0 HG LEU A 84 -3.174 -12.003 -28.350 1.00 1.95 H new ATOM 0 HD11 LEU A 84 -2.789 -9.768 -29.311 1.00 2.13 H new ATOM 0 HD12 LEU A 84 -4.279 -9.821 -28.339 1.00 2.13 H new ATOM 0 HD13 LEU A 84 -2.811 -9.066 -27.676 1.00 2.13 H new ATOM 0 HD21 LEU A 84 -0.871 -11.210 -28.734 1.00 1.97 H new ATOM 0 HD22 LEU A 84 -0.822 -10.563 -27.077 1.00 1.97 H new ATOM 0 HD23 LEU A 84 -0.963 -12.317 -27.344 1.00 1.97 H new ATOM 1161 N SER A 85 -3.214 -12.366 -23.266 1.00 2.56 N ATOM 1162 CA SER A 85 -3.852 -12.436 -21.951 1.00 2.93 C ATOM 1163 C SER A 85 -4.596 -11.146 -21.613 1.00 2.97 C ATOM 1164 O SER A 85 -4.327 -10.095 -22.196 1.00 2.69 O ATOM 1165 CB SER A 85 -2.806 -12.728 -20.874 1.00 3.11 C ATOM 1166 OG SER A 85 -1.729 -11.811 -20.948 1.00 3.01 O ATOM 0 H SER A 85 -2.300 -11.914 -23.271 1.00 2.56 H new ATOM 0 HA SER A 85 -4.582 -13.245 -21.982 1.00 2.93 H new ATOM 0 HB2 SER A 85 -3.269 -12.672 -19.889 1.00 3.11 H new ATOM 0 HB3 SER A 85 -2.431 -13.745 -20.993 1.00 3.11 H new ATOM 0 HG SER A 85 -1.660 -11.318 -20.104 1.00 3.01 H new ATOM 1172 N ASN A 86 -5.529 -11.237 -20.653 1.00 3.40 N ATOM 1173 CA ASN A 86 -6.315 -10.080 -20.207 1.00 3.60 C ATOM 1174 C ASN A 86 -5.439 -8.836 -20.177 1.00 3.34 C ATOM 1175 O ASN A 86 -5.747 -7.822 -20.798 1.00 3.26 O ATOM 1176 CB ASN A 86 -6.884 -10.347 -18.813 1.00 4.08 C ATOM 1177 CG ASN A 86 -8.366 -10.655 -18.841 1.00 4.47 C ATOM 1178 OD1 ASN A 86 -9.171 -9.855 -19.315 1.00 4.79 O ATOM 1179 ND2 ASN A 86 -8.735 -11.824 -18.329 1.00 4.67 N ATOM 0 H ASN A 86 -5.757 -12.106 -20.169 1.00 3.40 H new ATOM 0 HA ASN A 86 -7.137 -9.919 -20.905 1.00 3.60 H new ATOM 0 HB2 ASN A 86 -6.351 -11.183 -18.361 1.00 4.08 H new ATOM 0 HB3 ASN A 86 -6.709 -9.477 -18.180 1.00 4.08 H new ATOM 0 HD21 ASN A 86 -9.720 -12.088 -18.319 1.00 4.67 H new ATOM 0 HD22 ASN A 86 -8.033 -12.457 -17.946 1.00 4.67 H new ATOM 1186 N LYS A 87 -4.322 -8.964 -19.479 1.00 3.26 N ATOM 1187 CA LYS A 87 -3.327 -7.908 -19.378 1.00 3.00 C ATOM 1188 C LYS A 87 -2.037 -8.460 -19.946 1.00 2.66 C ATOM 1189 O LYS A 87 -1.186 -8.972 -19.220 1.00 2.79 O ATOM 1190 CB LYS A 87 -3.137 -7.465 -17.924 1.00 3.32 C ATOM 1191 CG LYS A 87 -4.438 -7.340 -17.147 1.00 3.65 C ATOM 1192 CD LYS A 87 -4.210 -7.488 -15.651 1.00 4.00 C ATOM 1193 CE LYS A 87 -4.986 -6.445 -14.862 1.00 4.63 C ATOM 1194 NZ LYS A 87 -4.486 -6.321 -13.466 1.00 4.87 N ATOM 0 H LYS A 87 -4.078 -9.809 -18.963 1.00 3.26 H new ATOM 0 HA LYS A 87 -3.648 -7.027 -19.933 1.00 3.00 H new ATOM 0 HB2 LYS A 87 -2.489 -8.180 -17.417 1.00 3.32 H new ATOM 0 HB3 LYS A 87 -2.623 -6.504 -17.911 1.00 3.32 H new ATOM 0 HG2 LYS A 87 -4.894 -6.372 -17.353 1.00 3.65 H new ATOM 0 HG3 LYS A 87 -5.140 -8.102 -17.486 1.00 3.65 H new ATOM 0 HD2 LYS A 87 -4.513 -8.486 -15.333 1.00 4.00 H new ATOM 0 HD3 LYS A 87 -3.146 -7.393 -15.433 1.00 4.00 H new ATOM 0 HE2 LYS A 87 -4.909 -5.480 -15.362 1.00 4.63 H new ATOM 0 HE3 LYS A 87 -6.042 -6.713 -14.847 1.00 4.63 H new ATOM 0 HZ1 LYS A 87 -5.041 -5.600 -12.961 1.00 4.87 H new ATOM 0 HZ2 LYS A 87 -4.583 -7.235 -12.980 1.00 4.87 H new ATOM 0 HZ3 LYS A 87 -3.485 -6.040 -13.480 1.00 4.87 H new ATOM 1208 N HIS A 88 -1.932 -8.399 -21.264 1.00 2.31 N ATOM 1209 CA HIS A 88 -0.790 -8.938 -21.966 1.00 2.05 C ATOM 1210 C HIS A 88 0.508 -8.254 -21.585 1.00 1.93 C ATOM 1211 O HIS A 88 1.516 -8.913 -21.340 1.00 2.10 O ATOM 1212 CB HIS A 88 -0.987 -8.834 -23.469 1.00 1.78 C ATOM 1213 CG HIS A 88 -0.023 -9.698 -24.189 1.00 1.73 C ATOM 1214 ND1 HIS A 88 -0.350 -10.948 -24.643 1.00 1.90 N ATOM 1215 CD2 HIS A 88 1.294 -9.537 -24.426 1.00 1.72 C ATOM 1216 CE1 HIS A 88 0.725 -11.533 -25.118 1.00 2.02 C ATOM 1217 NE2 HIS A 88 1.747 -10.695 -25.002 1.00 1.96 N ATOM 0 H HIS A 88 -2.635 -7.976 -21.870 1.00 2.31 H new ATOM 0 HA HIS A 88 -0.715 -9.985 -21.671 1.00 2.05 H new ATOM 0 HB2 HIS A 88 -2.005 -9.124 -23.727 1.00 1.78 H new ATOM 0 HB3 HIS A 88 -0.861 -7.799 -23.786 1.00 1.78 H new ATOM 0 HD2 HIS A 88 1.882 -8.659 -24.203 1.00 1.72 H new ATOM 0 HE1 HIS A 88 0.770 -12.529 -25.533 1.00 2.02 H new ATOM 0 HE2 HIS A 88 2.707 -10.881 -25.292 1.00 1.96 H new ATOM 1226 N PHE A 89 0.491 -6.936 -21.544 1.00 1.75 N ATOM 1227 CA PHE A 89 1.702 -6.194 -21.197 1.00 1.65 C ATOM 1228 C PHE A 89 1.387 -4.926 -20.414 1.00 1.72 C ATOM 1229 O PHE A 89 0.254 -4.455 -20.411 1.00 1.87 O ATOM 1230 CB PHE A 89 2.520 -5.865 -22.448 1.00 1.35 C ATOM 1231 CG PHE A 89 1.753 -5.156 -23.526 1.00 1.19 C ATOM 1232 CD1 PHE A 89 0.949 -5.866 -24.402 1.00 1.65 C ATOM 1233 CD2 PHE A 89 1.844 -3.782 -23.671 1.00 1.74 C ATOM 1234 CE1 PHE A 89 0.252 -5.220 -25.403 1.00 1.81 C ATOM 1235 CE2 PHE A 89 1.149 -3.129 -24.669 1.00 1.88 C ATOM 1236 CZ PHE A 89 0.351 -3.849 -25.537 1.00 1.57 C ATOM 0 H PHE A 89 -0.327 -6.360 -21.741 1.00 1.75 H new ATOM 0 HA PHE A 89 2.299 -6.838 -20.552 1.00 1.65 H new ATOM 0 HB2 PHE A 89 3.370 -5.247 -22.158 1.00 1.35 H new ATOM 0 HB3 PHE A 89 2.924 -6.791 -22.856 1.00 1.35 H new ATOM 0 HD1 PHE A 89 0.866 -6.938 -24.301 1.00 1.65 H new ATOM 0 HD2 PHE A 89 2.466 -3.214 -22.995 1.00 1.74 H new ATOM 0 HE1 PHE A 89 -0.370 -5.786 -26.081 1.00 1.81 H new ATOM 0 HE2 PHE A 89 1.229 -2.057 -24.771 1.00 1.88 H new ATOM 0 HZ PHE A 89 -0.194 -3.341 -26.319 1.00 1.57 H new ATOM 1246 N GLN A 90 2.396 -4.392 -19.729 1.00 1.76 N ATOM 1247 CA GLN A 90 2.224 -3.191 -18.918 1.00 1.90 C ATOM 1248 C GLN A 90 3.383 -2.212 -19.117 1.00 1.68 C ATOM 1249 O GLN A 90 4.532 -2.627 -19.243 1.00 1.67 O ATOM 1250 CB GLN A 90 2.126 -3.587 -17.442 1.00 2.38 C ATOM 1251 CG GLN A 90 1.290 -2.641 -16.598 1.00 2.70 C ATOM 1252 CD GLN A 90 1.356 -2.968 -15.120 1.00 3.08 C ATOM 1253 OE1 GLN A 90 0.329 -3.138 -14.464 1.00 3.38 O ATOM 1254 NE2 GLN A 90 2.569 -3.059 -14.589 1.00 3.17 N ATOM 0 H GLN A 90 3.342 -4.773 -19.720 1.00 1.76 H new ATOM 0 HA GLN A 90 1.307 -2.692 -19.232 1.00 1.90 H new ATOM 0 HB2 GLN A 90 1.701 -4.589 -17.374 1.00 2.38 H new ATOM 0 HB3 GLN A 90 3.131 -3.638 -17.023 1.00 2.38 H new ATOM 0 HG2 GLN A 90 1.634 -1.619 -16.756 1.00 2.70 H new ATOM 0 HG3 GLN A 90 0.253 -2.684 -16.930 1.00 2.70 H new ATOM 0 HE21 GLN A 90 3.393 -2.910 -15.171 1.00 3.17 H new ATOM 0 HE22 GLN A 90 2.677 -3.278 -13.599 1.00 3.17 H new ATOM 1263 N ILE A 91 3.086 -0.913 -19.132 1.00 1.66 N ATOM 1264 CA ILE A 91 4.129 0.099 -19.301 1.00 1.53 C ATOM 1265 C ILE A 91 4.220 0.998 -18.070 1.00 1.80 C ATOM 1266 O ILE A 91 3.209 1.486 -17.582 1.00 2.07 O ATOM 1267 CB ILE A 91 3.878 0.977 -20.539 1.00 1.47 C ATOM 1268 CG1 ILE A 91 3.757 0.107 -21.792 1.00 1.33 C ATOM 1269 CG2 ILE A 91 5.000 1.993 -20.695 1.00 1.50 C ATOM 1270 CD1 ILE A 91 3.460 0.896 -23.049 1.00 1.63 C ATOM 0 H ILE A 91 2.142 -0.539 -19.030 1.00 1.66 H new ATOM 0 HA ILE A 91 5.068 -0.439 -19.435 1.00 1.53 H new ATOM 0 HB ILE A 91 2.940 1.516 -20.406 1.00 1.47 H new ATOM 0 HG12 ILE A 91 4.685 -0.447 -21.931 1.00 1.33 H new ATOM 0 HG13 ILE A 91 2.967 -0.628 -21.639 1.00 1.33 H new ATOM 0 HG21 ILE A 91 4.813 2.610 -21.574 1.00 1.50 H new ATOM 0 HG22 ILE A 91 5.042 2.627 -19.809 1.00 1.50 H new ATOM 0 HG23 ILE A 91 5.950 1.471 -20.813 1.00 1.50 H new ATOM 0 HD11 ILE A 91 3.388 0.215 -23.897 1.00 1.63 H new ATOM 0 HD12 ILE A 91 2.517 1.429 -22.930 1.00 1.63 H new ATOM 0 HD13 ILE A 91 4.262 1.613 -23.226 1.00 1.63 H new ATOM 1282 N LEU A 92 5.435 1.216 -17.571 1.00 1.84 N ATOM 1283 CA LEU A 92 5.628 2.054 -16.391 1.00 2.11 C ATOM 1284 C LEU A 92 6.366 3.347 -16.727 1.00 2.01 C ATOM 1285 O LEU A 92 7.277 3.361 -17.555 1.00 1.86 O ATOM 1286 CB LEU A 92 6.403 1.283 -15.322 1.00 2.42 C ATOM 1287 CG LEU A 92 7.760 0.740 -15.776 1.00 2.47 C ATOM 1288 CD1 LEU A 92 8.841 1.072 -14.757 1.00 2.85 C ATOM 1289 CD2 LEU A 92 7.684 -0.763 -16.003 1.00 2.69 C ATOM 0 H LEU A 92 6.293 0.828 -17.962 1.00 1.84 H new ATOM 0 HA LEU A 92 4.641 2.320 -16.012 1.00 2.11 H new ATOM 0 HB2 LEU A 92 6.558 1.937 -14.464 1.00 2.42 H new ATOM 0 HB3 LEU A 92 5.790 0.449 -14.980 1.00 2.42 H new ATOM 0 HG LEU A 92 8.022 1.219 -16.720 1.00 2.47 H new ATOM 0 HD11 LEU A 92 9.797 0.677 -15.099 1.00 2.85 H new ATOM 0 HD12 LEU A 92 8.915 2.154 -14.644 1.00 2.85 H new ATOM 0 HD13 LEU A 92 8.586 0.624 -13.797 1.00 2.85 H new ATOM 0 HD21 LEU A 92 8.658 -1.132 -16.325 1.00 2.69 H new ATOM 0 HD22 LEU A 92 7.398 -1.257 -15.075 1.00 2.69 H new ATOM 0 HD23 LEU A 92 6.942 -0.978 -16.772 1.00 2.69 H new ATOM 1301 N LEU A 93 5.968 4.430 -16.064 1.00 2.22 N ATOM 1302 CA LEU A 93 6.587 5.734 -16.269 1.00 2.22 C ATOM 1303 C LEU A 93 7.074 6.307 -14.939 1.00 2.50 C ATOM 1304 O LEU A 93 6.317 6.374 -13.969 1.00 2.80 O ATOM 1305 CB LEU A 93 5.596 6.700 -16.925 1.00 2.38 C ATOM 1306 CG LEU A 93 6.036 8.167 -16.965 1.00 2.54 C ATOM 1307 CD1 LEU A 93 6.987 8.407 -18.127 1.00 2.52 C ATOM 1308 CD2 LEU A 93 4.826 9.084 -17.066 1.00 2.99 C ATOM 0 H LEU A 93 5.215 4.428 -15.376 1.00 2.22 H new ATOM 0 HA LEU A 93 7.443 5.607 -16.932 1.00 2.22 H new ATOM 0 HB2 LEU A 93 5.411 6.366 -17.946 1.00 2.38 H new ATOM 0 HB3 LEU A 93 4.647 6.637 -16.392 1.00 2.38 H new ATOM 0 HG LEU A 93 6.563 8.394 -16.038 1.00 2.54 H new ATOM 0 HD11 LEU A 93 7.289 9.454 -18.140 1.00 2.52 H new ATOM 0 HD12 LEU A 93 7.869 7.776 -18.012 1.00 2.52 H new ATOM 0 HD13 LEU A 93 6.486 8.163 -19.064 1.00 2.52 H new ATOM 0 HD21 LEU A 93 5.157 10.122 -17.093 1.00 2.99 H new ATOM 0 HD22 LEU A 93 4.272 8.856 -17.976 1.00 2.99 H new ATOM 0 HD23 LEU A 93 4.181 8.932 -16.201 1.00 2.99 H new ATOM 1320 N GLY A 94 8.337 6.720 -14.900 1.00 2.49 N ATOM 1321 CA GLY A 94 8.893 7.281 -13.683 1.00 2.79 C ATOM 1322 C GLY A 94 10.409 7.311 -13.696 1.00 2.71 C ATOM 1323 O GLY A 94 11.020 7.797 -14.647 1.00 2.69 O ATOM 0 H GLY A 94 8.984 6.676 -15.688 1.00 2.49 H new ATOM 0 HA2 GLY A 94 8.514 8.294 -13.548 1.00 2.79 H new ATOM 0 HA3 GLY A 94 8.552 6.696 -12.829 1.00 2.79 H new ATOM 1327 N GLU A 95 11.018 6.789 -12.634 1.00 3.07 N ATOM 1328 CA GLU A 95 12.472 6.756 -12.520 1.00 3.38 C ATOM 1329 C GLU A 95 13.042 8.167 -12.403 1.00 3.26 C ATOM 1330 O GLU A 95 13.429 8.602 -11.318 1.00 3.79 O ATOM 1331 CB GLU A 95 13.086 6.038 -13.726 1.00 3.85 C ATOM 1332 CG GLU A 95 13.860 4.784 -13.355 1.00 4.44 C ATOM 1333 CD GLU A 95 15.069 5.081 -12.490 1.00 5.14 C ATOM 1334 OE1 GLU A 95 14.943 5.900 -11.557 1.00 5.65 O ATOM 1335 OE2 GLU A 95 16.141 4.492 -12.745 1.00 5.54 O ATOM 0 H GLU A 95 10.525 6.382 -11.839 1.00 3.07 H new ATOM 0 HA GLU A 95 12.728 6.206 -11.614 1.00 3.38 H new ATOM 0 HB2 GLU A 95 12.292 5.772 -14.424 1.00 3.85 H new ATOM 0 HB3 GLU A 95 13.752 6.725 -14.248 1.00 3.85 H new ATOM 0 HG2 GLU A 95 13.199 4.097 -12.826 1.00 4.44 H new ATOM 0 HG3 GLU A 95 14.184 4.279 -14.265 1.00 4.44 H new ATOM 1342 N ASP A 96 13.092 8.877 -13.525 1.00 3.01 N ATOM 1343 CA ASP A 96 13.615 10.238 -13.546 1.00 3.11 C ATOM 1344 C ASP A 96 13.096 11.003 -14.758 1.00 3.09 C ATOM 1345 O ASP A 96 12.313 11.943 -14.623 1.00 3.64 O ATOM 1346 CB ASP A 96 15.145 10.217 -13.558 1.00 3.50 C ATOM 1347 CG ASP A 96 15.745 11.359 -12.760 1.00 3.94 C ATOM 1348 OD1 ASP A 96 15.541 11.394 -11.529 1.00 4.45 O ATOM 1349 OD2 ASP A 96 16.421 12.217 -13.367 1.00 4.24 O ATOM 0 H ASP A 96 12.777 8.532 -14.432 1.00 3.01 H new ATOM 0 HA ASP A 96 13.271 10.747 -12.645 1.00 3.11 H new ATOM 0 HB2 ASP A 96 15.496 9.269 -13.151 1.00 3.50 H new ATOM 0 HB3 ASP A 96 15.498 10.272 -14.588 1.00 3.50 H new ATOM 1354 N GLY A 97 13.537 10.593 -15.943 1.00 2.92 N ATOM 1355 CA GLY A 97 13.105 11.251 -17.163 1.00 3.18 C ATOM 1356 C GLY A 97 13.043 10.301 -18.343 1.00 3.12 C ATOM 1357 O GLY A 97 13.212 10.713 -19.490 1.00 3.67 O ATOM 0 H GLY A 97 14.185 9.818 -16.080 1.00 2.92 H new ATOM 0 HA2 GLY A 97 12.122 11.694 -17.005 1.00 3.18 H new ATOM 0 HA3 GLY A 97 13.789 12.068 -17.394 1.00 3.18 H new ATOM 1361 N ASN A 98 12.800 9.025 -18.060 1.00 2.82 N ATOM 1362 CA ASN A 98 12.716 8.013 -19.106 1.00 2.78 C ATOM 1363 C ASN A 98 11.474 7.145 -18.925 1.00 2.48 C ATOM 1364 O ASN A 98 10.680 7.363 -18.010 1.00 2.37 O ATOM 1365 CB ASN A 98 13.970 7.137 -19.100 1.00 2.97 C ATOM 1366 CG ASN A 98 15.200 7.885 -19.575 1.00 3.35 C ATOM 1367 OD1 ASN A 98 15.137 8.670 -20.522 1.00 3.65 O ATOM 1368 ND2 ASN A 98 16.329 7.647 -18.918 1.00 3.80 N ATOM 0 H ASN A 98 12.658 8.668 -17.115 1.00 2.82 H new ATOM 0 HA ASN A 98 12.643 8.524 -20.066 1.00 2.78 H new ATOM 0 HB2 ASN A 98 14.143 6.762 -18.091 1.00 2.97 H new ATOM 0 HB3 ASN A 98 13.807 6.269 -19.739 1.00 2.97 H new ATOM 0 HD21 ASN A 98 17.189 8.122 -19.192 1.00 3.80 H new ATOM 0 HD22 ASN A 98 16.337 6.989 -18.139 1.00 3.80 H new ATOM 1375 N LEU A 99 11.316 6.160 -19.802 1.00 2.45 N ATOM 1376 CA LEU A 99 10.173 5.257 -19.741 1.00 2.19 C ATOM 1377 C LEU A 99 10.631 3.804 -19.689 1.00 2.20 C ATOM 1378 O LEU A 99 11.727 3.472 -20.141 1.00 2.47 O ATOM 1379 CB LEU A 99 9.262 5.472 -20.951 1.00 2.19 C ATOM 1380 CG LEU A 99 8.075 6.405 -20.711 1.00 2.31 C ATOM 1381 CD1 LEU A 99 7.749 7.188 -21.974 1.00 2.72 C ATOM 1382 CD2 LEU A 99 6.862 5.611 -20.246 1.00 2.80 C ATOM 0 H LEU A 99 11.966 5.966 -20.564 1.00 2.45 H new ATOM 0 HA LEU A 99 9.616 5.477 -18.831 1.00 2.19 H new ATOM 0 HB2 LEU A 99 9.860 5.873 -21.770 1.00 2.19 H new ATOM 0 HB3 LEU A 99 8.883 4.504 -21.278 1.00 2.19 H new ATOM 0 HG LEU A 99 8.344 7.114 -19.928 1.00 2.31 H new ATOM 0 HD11 LEU A 99 6.902 7.847 -21.785 1.00 2.72 H new ATOM 0 HD12 LEU A 99 8.614 7.784 -22.266 1.00 2.72 H new ATOM 0 HD13 LEU A 99 7.498 6.495 -22.777 1.00 2.72 H new ATOM 0 HD21 LEU A 99 6.025 6.289 -20.079 1.00 2.80 H new ATOM 0 HD22 LEU A 99 6.591 4.881 -21.009 1.00 2.80 H new ATOM 0 HD23 LEU A 99 7.100 5.094 -19.317 1.00 2.80 H new ATOM 1394 N LEU A 100 9.785 2.940 -19.138 1.00 2.02 N ATOM 1395 CA LEU A 100 10.104 1.524 -19.032 1.00 2.14 C ATOM 1396 C LEU A 100 8.922 0.678 -19.493 1.00 1.91 C ATOM 1397 O LEU A 100 7.766 1.057 -19.308 1.00 1.68 O ATOM 1398 CB LEU A 100 10.469 1.171 -17.588 1.00 2.38 C ATOM 1399 CG LEU A 100 11.939 1.381 -17.222 1.00 2.73 C ATOM 1400 CD1 LEU A 100 12.069 1.837 -15.776 1.00 3.34 C ATOM 1401 CD2 LEU A 100 12.736 0.104 -17.456 1.00 3.27 C ATOM 0 H LEU A 100 8.874 3.197 -18.758 1.00 2.02 H new ATOM 0 HA LEU A 100 10.959 1.312 -19.674 1.00 2.14 H new ATOM 0 HB2 LEU A 100 9.854 1.771 -16.917 1.00 2.38 H new ATOM 0 HB3 LEU A 100 10.211 0.127 -17.409 1.00 2.38 H new ATOM 0 HG LEU A 100 12.346 2.161 -17.865 1.00 2.73 H new ATOM 0 HD11 LEU A 100 13.122 1.981 -15.533 1.00 3.34 H new ATOM 0 HD12 LEU A 100 11.533 2.777 -15.641 1.00 3.34 H new ATOM 0 HD13 LEU A 100 11.645 1.080 -15.116 1.00 3.34 H new ATOM 0 HD21 LEU A 100 13.780 0.273 -17.190 1.00 3.27 H new ATOM 0 HD22 LEU A 100 12.329 -0.697 -16.839 1.00 3.27 H new ATOM 0 HD23 LEU A 100 12.670 -0.178 -18.507 1.00 3.27 H new ATOM 1413 N LEU A 101 9.217 -0.468 -20.093 1.00 2.06 N ATOM 1414 CA LEU A 101 8.176 -1.366 -20.578 1.00 1.88 C ATOM 1415 C LEU A 101 8.170 -2.655 -19.769 1.00 2.14 C ATOM 1416 O LEU A 101 9.206 -3.298 -19.607 1.00 2.54 O ATOM 1417 CB LEU A 101 8.388 -1.678 -22.060 1.00 1.96 C ATOM 1418 CG LEU A 101 7.108 -1.939 -22.854 1.00 2.36 C ATOM 1419 CD1 LEU A 101 6.615 -0.656 -23.507 1.00 2.97 C ATOM 1420 CD2 LEU A 101 7.342 -3.016 -23.902 1.00 2.86 C ATOM 0 H LEU A 101 10.168 -0.798 -20.256 1.00 2.06 H new ATOM 0 HA LEU A 101 7.212 -0.872 -20.459 1.00 1.88 H new ATOM 0 HB2 LEU A 101 8.919 -0.844 -22.519 1.00 1.96 H new ATOM 0 HB3 LEU A 101 9.034 -2.552 -22.143 1.00 1.96 H new ATOM 0 HG LEU A 101 6.340 -2.291 -22.165 1.00 2.36 H new ATOM 0 HD11 LEU A 101 5.703 -0.860 -24.068 1.00 2.97 H new ATOM 0 HD12 LEU A 101 6.409 0.088 -22.737 1.00 2.97 H new ATOM 0 HD13 LEU A 101 7.380 -0.275 -24.184 1.00 2.97 H new ATOM 0 HD21 LEU A 101 6.421 -3.189 -24.458 1.00 2.86 H new ATOM 0 HD22 LEU A 101 8.124 -2.692 -24.588 1.00 2.86 H new ATOM 0 HD23 LEU A 101 7.649 -3.940 -23.412 1.00 2.86 H new ATOM 1432 N ASN A 102 7.003 -3.027 -19.252 1.00 2.03 N ATOM 1433 CA ASN A 102 6.892 -4.240 -18.450 1.00 2.40 C ATOM 1434 C ASN A 102 5.950 -5.252 -19.088 1.00 2.30 C ATOM 1435 O ASN A 102 4.752 -5.018 -19.193 1.00 2.08 O ATOM 1436 CB ASN A 102 6.391 -3.901 -17.048 1.00 2.60 C ATOM 1437 CG ASN A 102 6.753 -4.962 -16.038 1.00 3.11 C ATOM 1438 OD1 ASN A 102 7.808 -5.590 -16.126 1.00 3.36 O ATOM 1439 ND2 ASN A 102 5.876 -5.168 -15.070 1.00 3.34 N ATOM 0 H ASN A 102 6.130 -2.513 -19.372 1.00 2.03 H new ATOM 0 HA ASN A 102 7.886 -4.684 -18.392 1.00 2.40 H new ATOM 0 HB2 ASN A 102 6.813 -2.946 -16.735 1.00 2.60 H new ATOM 0 HB3 ASN A 102 5.308 -3.779 -17.071 1.00 2.60 H new ATOM 0 HD21 ASN A 102 6.061 -5.872 -14.355 1.00 3.34 H new ATOM 0 HD22 ASN A 102 5.014 -4.623 -15.038 1.00 3.34 H new ATOM 1446 N ASP A 103 6.497 -6.390 -19.486 1.00 2.56 N ATOM 1447 CA ASP A 103 5.692 -7.444 -20.085 1.00 2.54 C ATOM 1448 C ASP A 103 4.920 -8.191 -18.998 1.00 2.82 C ATOM 1449 O ASP A 103 5.426 -8.383 -17.895 1.00 3.22 O ATOM 1450 CB ASP A 103 6.581 -8.404 -20.879 1.00 2.82 C ATOM 1451 CG ASP A 103 7.848 -8.783 -20.142 1.00 3.32 C ATOM 1452 OD1 ASP A 103 7.994 -8.396 -18.964 1.00 3.62 O ATOM 1453 OD2 ASP A 103 8.695 -9.471 -20.748 1.00 3.75 O ATOM 0 H ASP A 103 7.490 -6.607 -19.406 1.00 2.56 H new ATOM 0 HA ASP A 103 4.975 -6.997 -20.774 1.00 2.54 H new ATOM 0 HB2 ASP A 103 6.016 -9.308 -21.108 1.00 2.82 H new ATOM 0 HB3 ASP A 103 6.845 -7.943 -21.831 1.00 2.82 H new ATOM 1458 N ILE A 104 3.687 -8.589 -19.300 1.00 2.67 N ATOM 1459 CA ILE A 104 2.860 -9.291 -18.320 1.00 3.02 C ATOM 1460 C ILE A 104 1.877 -10.256 -18.985 1.00 3.00 C ATOM 1461 O ILE A 104 0.729 -10.371 -18.553 1.00 3.12 O ATOM 1462 CB ILE A 104 2.059 -8.295 -17.448 1.00 3.04 C ATOM 1463 CG1 ILE A 104 1.138 -7.445 -18.321 1.00 2.63 C ATOM 1464 CG2 ILE A 104 2.992 -7.398 -16.651 1.00 3.16 C ATOM 1465 CD1 ILE A 104 -0.062 -6.898 -17.580 1.00 2.85 C ATOM 0 H ILE A 104 3.241 -8.440 -20.205 1.00 2.67 H new ATOM 0 HA ILE A 104 3.547 -9.861 -17.694 1.00 3.02 H new ATOM 0 HB ILE A 104 1.454 -8.871 -16.748 1.00 3.04 H new ATOM 0 HG12 ILE A 104 1.709 -6.614 -18.735 1.00 2.63 H new ATOM 0 HG13 ILE A 104 0.792 -8.045 -19.163 1.00 2.63 H new ATOM 0 HG21 ILE A 104 2.404 -6.707 -16.046 1.00 3.16 H new ATOM 0 HG22 ILE A 104 3.616 -8.010 -16.000 1.00 3.16 H new ATOM 0 HG23 ILE A 104 3.626 -6.833 -17.335 1.00 3.16 H new ATOM 0 HD11 ILE A 104 -0.671 -6.305 -18.262 1.00 2.85 H new ATOM 0 HD12 ILE A 104 -0.656 -7.724 -17.189 1.00 2.85 H new ATOM 0 HD13 ILE A 104 0.275 -6.270 -16.755 1.00 2.85 H new ATOM 1477 N SER A 105 2.311 -10.938 -20.041 1.00 2.91 N ATOM 1478 CA SER A 105 1.458 -11.856 -20.749 1.00 2.89 C ATOM 1479 C SER A 105 1.718 -13.297 -20.332 1.00 3.35 C ATOM 1480 O SER A 105 2.824 -13.649 -19.926 1.00 3.64 O ATOM 1481 CB SER A 105 1.734 -11.724 -22.229 1.00 2.58 C ATOM 1482 OG SER A 105 2.671 -10.710 -22.496 1.00 2.53 O ATOM 0 H SER A 105 3.256 -10.864 -20.418 1.00 2.91 H new ATOM 0 HA SER A 105 0.421 -11.613 -20.515 1.00 2.89 H new ATOM 0 HB2 SER A 105 2.105 -12.673 -22.616 1.00 2.58 H new ATOM 0 HB3 SER A 105 0.804 -11.507 -22.755 1.00 2.58 H new ATOM 0 HG SER A 105 2.345 -9.860 -22.134 1.00 2.53 H new ATOM 1488 N THR A 106 0.699 -14.132 -20.473 1.00 3.44 N ATOM 1489 CA THR A 106 0.825 -15.542 -20.151 1.00 3.86 C ATOM 1490 C THR A 106 1.727 -16.232 -21.173 1.00 3.93 C ATOM 1491 O THR A 106 2.425 -17.195 -20.854 1.00 4.33 O ATOM 1492 CB THR A 106 -0.553 -16.209 -20.131 1.00 3.94 C ATOM 1493 OG1 THR A 106 -1.376 -15.625 -19.137 1.00 4.00 O ATOM 1494 CG2 THR A 106 -0.497 -17.697 -19.865 1.00 4.36 C ATOM 0 H THR A 106 -0.224 -13.856 -20.809 1.00 3.44 H new ATOM 0 HA THR A 106 1.272 -15.637 -19.161 1.00 3.86 H new ATOM 0 HB THR A 106 -0.964 -16.052 -21.128 1.00 3.94 H new ATOM 0 HG1 THR A 106 -2.272 -16.020 -19.181 1.00 4.00 H new ATOM 0 HG21 THR A 106 -1.508 -18.105 -19.865 1.00 4.36 H new ATOM 0 HG22 THR A 106 0.090 -18.184 -20.643 1.00 4.36 H new ATOM 0 HG23 THR A 106 -0.033 -17.876 -18.895 1.00 4.36 H new ATOM 1502 N ASN A 107 1.687 -15.740 -22.414 1.00 3.59 N ATOM 1503 CA ASN A 107 2.470 -16.312 -23.490 1.00 3.72 C ATOM 1504 C ASN A 107 3.797 -15.584 -23.710 1.00 3.71 C ATOM 1505 O ASN A 107 4.722 -16.148 -24.295 1.00 3.98 O ATOM 1506 CB ASN A 107 1.657 -16.302 -24.771 1.00 3.47 C ATOM 1507 CG ASN A 107 1.036 -17.643 -25.074 1.00 3.55 C ATOM 1508 OD1 ASN A 107 1.629 -18.690 -24.819 1.00 4.07 O ATOM 1509 ND2 ASN A 107 -0.166 -17.615 -25.625 1.00 3.34 N ATOM 0 H ASN A 107 1.114 -14.942 -22.690 1.00 3.59 H new ATOM 0 HA ASN A 107 2.713 -17.335 -23.204 1.00 3.72 H new ATOM 0 HB2 ASN A 107 0.871 -15.551 -24.692 1.00 3.47 H new ATOM 0 HB3 ASN A 107 2.298 -16.006 -25.602 1.00 3.47 H new ATOM 0 HD21 ASN A 107 -0.641 -18.487 -25.857 1.00 3.34 H new ATOM 0 HD22 ASN A 107 -0.618 -16.721 -25.818 1.00 3.34 H new ATOM 1516 N GLY A 108 3.899 -14.339 -23.245 1.00 3.45 N ATOM 1517 CA GLY A 108 5.120 -13.597 -23.413 1.00 3.48 C ATOM 1518 C GLY A 108 4.951 -12.342 -24.248 1.00 3.04 C ATOM 1519 O GLY A 108 4.011 -12.222 -25.034 1.00 2.75 O ATOM 0 H GLY A 108 3.155 -13.840 -22.757 1.00 3.45 H new ATOM 0 HA2 GLY A 108 5.508 -13.323 -22.432 1.00 3.48 H new ATOM 0 HA3 GLY A 108 5.865 -14.239 -23.882 1.00 3.48 H new ATOM 1523 N THR A 109 5.880 -11.413 -24.070 1.00 3.05 N ATOM 1524 CA THR A 109 5.879 -10.145 -24.795 1.00 2.73 C ATOM 1525 C THR A 109 7.138 -10.043 -25.645 1.00 3.08 C ATOM 1526 O THR A 109 8.219 -10.438 -25.207 1.00 3.48 O ATOM 1527 CB THR A 109 5.805 -8.972 -23.818 1.00 2.47 C ATOM 1528 OG1 THR A 109 4.793 -9.192 -22.855 1.00 2.34 O ATOM 1529 CG2 THR A 109 5.521 -7.643 -24.484 1.00 2.11 C ATOM 0 H THR A 109 6.658 -11.515 -23.418 1.00 3.05 H new ATOM 0 HA THR A 109 5.004 -10.107 -25.443 1.00 2.73 H new ATOM 0 HB THR A 109 6.792 -8.920 -23.358 1.00 2.47 H new ATOM 0 HG1 THR A 109 4.159 -9.858 -23.193 1.00 2.34 H new ATOM 0 HG21 THR A 109 5.483 -6.858 -23.729 1.00 2.11 H new ATOM 0 HG22 THR A 109 6.311 -7.419 -25.201 1.00 2.11 H new ATOM 0 HG23 THR A 109 4.564 -7.693 -25.003 1.00 2.11 H new ATOM 1537 N TRP A 110 6.999 -9.549 -26.867 1.00 3.03 N ATOM 1538 CA TRP A 110 8.142 -9.452 -27.764 1.00 3.46 C ATOM 1539 C TRP A 110 8.497 -8.029 -28.142 1.00 3.42 C ATOM 1540 O TRP A 110 7.635 -7.161 -28.260 1.00 3.09 O ATOM 1541 CB TRP A 110 7.878 -10.247 -29.034 1.00 3.66 C ATOM 1542 CG TRP A 110 8.328 -11.644 -28.924 1.00 4.00 C ATOM 1543 CD1 TRP A 110 9.419 -12.192 -29.510 1.00 4.49 C ATOM 1544 CD2 TRP A 110 7.700 -12.673 -28.165 1.00 3.91 C ATOM 1545 NE1 TRP A 110 9.518 -13.505 -29.162 1.00 4.71 N ATOM 1546 CE2 TRP A 110 8.466 -13.834 -28.339 1.00 4.38 C ATOM 1547 CE3 TRP A 110 6.561 -12.722 -27.356 1.00 3.53 C ATOM 1548 CZ2 TRP A 110 8.133 -15.040 -27.730 1.00 4.49 C ATOM 1549 CZ3 TRP A 110 6.230 -13.916 -26.751 1.00 3.67 C ATOM 1550 CH2 TRP A 110 7.014 -15.063 -26.940 1.00 4.15 C ATOM 0 H TRP A 110 6.118 -9.213 -27.257 1.00 3.03 H new ATOM 0 HA TRP A 110 8.990 -9.862 -27.216 1.00 3.46 H new ATOM 0 HB2 TRP A 110 6.811 -10.228 -29.256 1.00 3.66 H new ATOM 0 HB3 TRP A 110 8.387 -9.769 -29.871 1.00 3.66 H new ATOM 0 HD1 TRP A 110 10.107 -11.667 -30.156 1.00 4.49 H new ATOM 0 HE1 TRP A 110 10.255 -14.143 -29.464 1.00 4.71 H new ATOM 0 HE3 TRP A 110 5.952 -11.842 -27.208 1.00 3.53 H new ATOM 0 HZ2 TRP A 110 8.734 -15.925 -27.875 1.00 4.49 H new ATOM 0 HZ3 TRP A 110 5.354 -13.969 -26.122 1.00 3.67 H new ATOM 0 HH2 TRP A 110 6.730 -15.984 -26.453 1.00 4.15 H new ATOM 1561 N LEU A 111 9.787 -7.823 -28.374 1.00 3.83 N ATOM 1562 CA LEU A 111 10.299 -6.537 -28.796 1.00 3.92 C ATOM 1563 C LEU A 111 11.071 -6.731 -30.098 1.00 4.42 C ATOM 1564 O LEU A 111 12.124 -7.368 -30.121 1.00 4.80 O ATOM 1565 CB LEU A 111 11.191 -5.934 -27.699 1.00 3.96 C ATOM 1566 CG LEU A 111 12.488 -5.277 -28.177 1.00 4.32 C ATOM 1567 CD1 LEU A 111 12.189 -4.135 -29.137 1.00 4.33 C ATOM 1568 CD2 LEU A 111 13.299 -4.778 -26.990 1.00 4.50 C ATOM 0 H LEU A 111 10.502 -8.544 -28.274 1.00 3.83 H new ATOM 0 HA LEU A 111 9.479 -5.839 -28.966 1.00 3.92 H new ATOM 0 HB2 LEU A 111 10.610 -5.191 -27.153 1.00 3.96 H new ATOM 0 HB3 LEU A 111 11.446 -6.722 -26.991 1.00 3.96 H new ATOM 0 HG LEU A 111 13.077 -6.025 -28.708 1.00 4.32 H new ATOM 0 HD11 LEU A 111 13.124 -3.681 -29.465 1.00 4.33 H new ATOM 0 HD12 LEU A 111 11.649 -4.519 -30.002 1.00 4.33 H new ATOM 0 HD13 LEU A 111 11.580 -3.385 -28.632 1.00 4.33 H new ATOM 0 HD21 LEU A 111 14.218 -4.313 -27.347 1.00 4.50 H new ATOM 0 HD22 LEU A 111 12.715 -4.046 -26.432 1.00 4.50 H new ATOM 0 HD23 LEU A 111 13.545 -5.617 -26.339 1.00 4.50 H new ATOM 1580 N ASN A 112 10.533 -6.186 -31.179 1.00 4.46 N ATOM 1581 CA ASN A 112 11.153 -6.298 -32.497 1.00 4.94 C ATOM 1582 C ASN A 112 11.640 -7.720 -32.790 1.00 5.23 C ATOM 1583 O ASN A 112 12.729 -7.910 -33.333 1.00 5.68 O ATOM 1584 CB ASN A 112 12.313 -5.309 -32.620 1.00 5.26 C ATOM 1585 CG ASN A 112 11.863 -3.949 -33.118 1.00 5.18 C ATOM 1586 OD1 ASN A 112 11.178 -3.843 -34.135 1.00 5.32 O ATOM 1587 ND2 ASN A 112 12.249 -2.899 -32.402 1.00 5.08 N ATOM 0 H ASN A 112 9.661 -5.657 -31.171 1.00 4.46 H new ATOM 0 HA ASN A 112 10.389 -6.057 -33.236 1.00 4.94 H new ATOM 0 HB2 ASN A 112 12.795 -5.196 -31.649 1.00 5.26 H new ATOM 0 HB3 ASN A 112 13.061 -5.713 -33.302 1.00 5.26 H new ATOM 0 HD21 ASN A 112 11.978 -1.959 -32.689 1.00 5.08 H new ATOM 0 HD22 ASN A 112 12.817 -3.033 -31.565 1.00 5.08 H new ATOM 1594 N GLY A 113 10.822 -8.716 -32.453 1.00 4.98 N ATOM 1595 CA GLY A 113 11.183 -10.087 -32.713 1.00 5.26 C ATOM 1596 C GLY A 113 11.958 -10.731 -31.584 1.00 5.37 C ATOM 1597 O GLY A 113 12.145 -11.949 -31.574 1.00 5.60 O ATOM 0 H GLY A 113 9.915 -8.590 -32.004 1.00 4.98 H new ATOM 0 HA2 GLY A 113 10.277 -10.664 -32.897 1.00 5.26 H new ATOM 0 HA3 GLY A 113 11.780 -10.131 -33.624 1.00 5.26 H new ATOM 1601 N GLN A 114 12.413 -9.930 -30.627 1.00 5.26 N ATOM 1602 CA GLN A 114 13.165 -10.463 -29.502 1.00 5.42 C ATOM 1603 C GLN A 114 12.304 -10.502 -28.246 1.00 5.00 C ATOM 1604 O GLN A 114 11.856 -9.467 -27.751 1.00 4.62 O ATOM 1605 CB GLN A 114 14.419 -9.619 -29.254 1.00 5.68 C ATOM 1606 CG GLN A 114 15.708 -10.308 -29.671 1.00 5.97 C ATOM 1607 CD GLN A 114 16.927 -9.430 -29.476 1.00 6.29 C ATOM 1608 OE1 GLN A 114 16.945 -8.271 -29.888 1.00 6.54 O ATOM 1609 NE2 GLN A 114 17.958 -9.980 -28.843 1.00 6.58 N ATOM 0 H GLN A 114 12.275 -8.920 -30.609 1.00 5.26 H new ATOM 0 HA GLN A 114 13.466 -11.482 -29.745 1.00 5.42 H new ATOM 0 HB2 GLN A 114 14.327 -8.679 -29.797 1.00 5.68 H new ATOM 0 HB3 GLN A 114 14.476 -9.371 -28.194 1.00 5.68 H new ATOM 0 HG2 GLN A 114 15.829 -11.225 -29.094 1.00 5.97 H new ATOM 0 HG3 GLN A 114 15.638 -10.598 -30.719 1.00 5.97 H new ATOM 0 HE21 GLN A 114 17.901 -10.945 -28.518 1.00 6.58 H new ATOM 0 HE22 GLN A 114 18.806 -9.437 -28.682 1.00 6.58 H new ATOM 1618 N LYS A 115 12.077 -11.706 -27.737 1.00 5.10 N ATOM 1619 CA LYS A 115 11.278 -11.903 -26.551 1.00 4.81 C ATOM 1620 C LYS A 115 12.020 -11.436 -25.301 1.00 4.91 C ATOM 1621 O LYS A 115 13.185 -11.777 -25.091 1.00 5.37 O ATOM 1622 CB LYS A 115 10.909 -13.384 -26.470 1.00 5.01 C ATOM 1623 CG LYS A 115 10.746 -13.936 -25.060 1.00 5.08 C ATOM 1624 CD LYS A 115 9.525 -13.346 -24.370 1.00 4.82 C ATOM 1625 CE LYS A 115 9.148 -14.136 -23.128 1.00 4.71 C ATOM 1626 NZ LYS A 115 8.515 -15.440 -23.469 1.00 5.00 N ATOM 0 H LYS A 115 12.445 -12.568 -28.140 1.00 5.10 H new ATOM 0 HA LYS A 115 10.369 -11.303 -26.608 1.00 4.81 H new ATOM 0 HB2 LYS A 115 9.977 -13.540 -27.014 1.00 5.01 H new ATOM 0 HB3 LYS A 115 11.678 -13.962 -26.983 1.00 5.01 H new ATOM 0 HG2 LYS A 115 10.654 -15.021 -25.101 1.00 5.08 H new ATOM 0 HG3 LYS A 115 11.639 -13.714 -24.475 1.00 5.08 H new ATOM 0 HD2 LYS A 115 9.726 -12.310 -24.096 1.00 4.82 H new ATOM 0 HD3 LYS A 115 8.684 -13.335 -25.064 1.00 4.82 H new ATOM 0 HE2 LYS A 115 10.039 -14.312 -22.525 1.00 4.71 H new ATOM 0 HE3 LYS A 115 8.462 -13.548 -22.518 1.00 4.71 H new ATOM 0 HZ1 LYS A 115 8.106 -15.862 -22.611 1.00 5.00 H new ATOM 0 HZ2 LYS A 115 7.764 -15.288 -24.172 1.00 5.00 H new ATOM 0 HZ3 LYS A 115 9.232 -16.082 -23.863 1.00 5.00 H new ATOM 1640 N VAL A 116 11.335 -10.648 -24.477 1.00 4.49 N ATOM 1641 CA VAL A 116 11.924 -10.127 -23.250 1.00 4.56 C ATOM 1642 C VAL A 116 11.415 -10.883 -22.026 1.00 4.63 C ATOM 1643 O VAL A 116 10.424 -11.609 -22.099 1.00 4.50 O ATOM 1644 CB VAL A 116 11.624 -8.621 -23.079 1.00 4.15 C ATOM 1645 CG1 VAL A 116 12.051 -7.851 -24.320 1.00 4.13 C ATOM 1646 CG2 VAL A 116 10.146 -8.387 -22.780 1.00 3.65 C ATOM 0 H VAL A 116 10.371 -10.357 -24.638 1.00 4.49 H new ATOM 0 HA VAL A 116 13.002 -10.268 -23.332 1.00 4.56 H new ATOM 0 HB VAL A 116 12.199 -8.254 -22.229 1.00 4.15 H new ATOM 0 HG11 VAL A 116 11.833 -6.792 -24.184 1.00 4.13 H new ATOM 0 HG12 VAL A 116 13.121 -7.984 -24.480 1.00 4.13 H new ATOM 0 HG13 VAL A 116 11.505 -8.225 -25.186 1.00 4.13 H new ATOM 0 HG21 VAL A 116 9.963 -7.319 -22.664 1.00 3.65 H new ATOM 0 HG22 VAL A 116 9.543 -8.772 -23.603 1.00 3.65 H new ATOM 0 HG23 VAL A 116 9.875 -8.903 -21.859 1.00 3.65 H new ATOM 1656 N GLU A 117 12.098 -10.703 -20.901 1.00 4.86 N ATOM 1657 CA GLU A 117 11.713 -11.363 -19.659 1.00 5.03 C ATOM 1658 C GLU A 117 10.409 -10.784 -19.124 1.00 4.61 C ATOM 1659 O GLU A 117 10.290 -9.573 -18.941 1.00 4.30 O ATOM 1660 CB GLU A 117 12.818 -11.207 -18.612 1.00 5.42 C ATOM 1661 CG GLU A 117 12.727 -12.212 -17.475 1.00 6.06 C ATOM 1662 CD GLU A 117 14.013 -12.311 -16.681 1.00 6.45 C ATOM 1663 OE1 GLU A 117 15.075 -11.940 -17.222 1.00 6.90 O ATOM 1664 OE2 GLU A 117 13.959 -12.761 -15.516 1.00 6.56 O ATOM 0 H GLU A 117 12.921 -10.106 -20.824 1.00 4.86 H new ATOM 0 HA GLU A 117 11.565 -12.423 -19.867 1.00 5.03 H new ATOM 0 HB2 GLU A 117 13.787 -11.311 -19.101 1.00 5.42 H new ATOM 0 HB3 GLU A 117 12.776 -10.199 -18.199 1.00 5.42 H new ATOM 0 HG2 GLU A 117 11.913 -11.928 -16.808 1.00 6.06 H new ATOM 0 HG3 GLU A 117 12.478 -13.193 -17.881 1.00 6.06 H new ATOM 1671 N LYS A 118 9.431 -11.650 -18.877 1.00 4.62 N ATOM 1672 CA LYS A 118 8.137 -11.208 -18.363 1.00 4.30 C ATOM 1673 C LYS A 118 8.314 -10.364 -17.105 1.00 4.37 C ATOM 1674 O LYS A 118 9.370 -10.385 -16.474 1.00 4.73 O ATOM 1675 CB LYS A 118 7.236 -12.407 -18.069 1.00 4.47 C ATOM 1676 CG LYS A 118 5.819 -12.027 -17.677 1.00 4.21 C ATOM 1677 CD LYS A 118 4.945 -13.256 -17.487 1.00 4.36 C ATOM 1678 CE LYS A 118 3.529 -12.876 -17.088 1.00 4.33 C ATOM 1679 NZ LYS A 118 2.752 -14.053 -16.610 1.00 4.66 N ATOM 0 H LYS A 118 9.508 -12.657 -19.023 1.00 4.62 H new ATOM 0 HA LYS A 118 7.663 -10.594 -19.128 1.00 4.30 H new ATOM 0 HB2 LYS A 118 7.200 -13.047 -18.950 1.00 4.47 H new ATOM 0 HB3 LYS A 118 7.680 -12.995 -17.266 1.00 4.47 H new ATOM 0 HG2 LYS A 118 5.839 -11.447 -16.754 1.00 4.21 H new ATOM 0 HG3 LYS A 118 5.387 -11.387 -18.446 1.00 4.21 H new ATOM 0 HD2 LYS A 118 4.921 -13.833 -18.411 1.00 4.36 H new ATOM 0 HD3 LYS A 118 5.380 -13.898 -16.721 1.00 4.36 H new ATOM 0 HE2 LYS A 118 3.563 -12.121 -16.303 1.00 4.33 H new ATOM 0 HE3 LYS A 118 3.020 -12.427 -17.941 1.00 4.33 H new ATOM 0 HZ1 LYS A 118 1.792 -13.752 -16.348 1.00 4.66 H new ATOM 0 HZ2 LYS A 118 2.697 -14.764 -17.367 1.00 4.66 H new ATOM 0 HZ3 LYS A 118 3.224 -14.467 -15.781 1.00 4.66 H new ATOM 1693 N ASN A 119 7.267 -9.620 -16.761 1.00 4.07 N ATOM 1694 CA ASN A 119 7.260 -8.739 -15.591 1.00 4.15 C ATOM 1695 C ASN A 119 8.628 -8.123 -15.321 1.00 4.30 C ATOM 1696 O ASN A 119 9.010 -7.900 -14.171 1.00 4.60 O ATOM 1697 CB ASN A 119 6.767 -9.486 -14.354 1.00 4.59 C ATOM 1698 CG ASN A 119 5.592 -10.399 -14.645 1.00 4.83 C ATOM 1699 OD1 ASN A 119 4.528 -9.945 -15.065 1.00 4.95 O ATOM 1700 ND2 ASN A 119 5.781 -11.695 -14.422 1.00 5.13 N ATOM 0 H ASN A 119 6.393 -9.609 -17.287 1.00 4.07 H new ATOM 0 HA ASN A 119 6.572 -7.924 -15.815 1.00 4.15 H new ATOM 0 HB2 ASN A 119 7.586 -10.076 -13.942 1.00 4.59 H new ATOM 0 HB3 ASN A 119 6.479 -8.764 -13.590 1.00 4.59 H new ATOM 0 HD21 ASN A 119 5.027 -12.358 -14.599 1.00 5.13 H new ATOM 0 HD22 ASN A 119 6.680 -12.027 -14.073 1.00 5.13 H new ATOM 1707 N SER A 120 9.351 -7.840 -16.391 1.00 4.11 N ATOM 1708 CA SER A 120 10.673 -7.233 -16.292 1.00 4.29 C ATOM 1709 C SER A 120 10.673 -5.825 -16.876 1.00 3.85 C ATOM 1710 O SER A 120 9.976 -5.548 -17.852 1.00 3.43 O ATOM 1711 CB SER A 120 11.711 -8.100 -16.986 1.00 4.60 C ATOM 1712 OG SER A 120 12.885 -8.217 -16.200 1.00 5.02 O ATOM 0 H SER A 120 9.044 -8.022 -17.347 1.00 4.11 H new ATOM 0 HA SER A 120 10.933 -7.160 -15.236 1.00 4.29 H new ATOM 0 HB2 SER A 120 11.295 -9.090 -17.174 1.00 4.60 H new ATOM 0 HB3 SER A 120 11.960 -7.669 -17.956 1.00 4.60 H new ATOM 0 HG SER A 120 13.537 -8.781 -16.667 1.00 5.02 H new ATOM 1718 N ASN A 121 11.457 -4.936 -16.275 1.00 3.97 N ATOM 1719 CA ASN A 121 11.543 -3.557 -16.743 1.00 3.62 C ATOM 1720 C ASN A 121 12.591 -3.419 -17.842 1.00 3.72 C ATOM 1721 O ASN A 121 13.699 -3.941 -17.727 1.00 4.17 O ATOM 1722 CB ASN A 121 11.882 -2.619 -15.584 1.00 3.73 C ATOM 1723 CG ASN A 121 10.979 -2.829 -14.385 1.00 3.90 C ATOM 1724 OD1 ASN A 121 9.974 -1.975 -14.247 1.00 4.47 O flip ATOM 1725 ND2 ASN A 121 11.184 -3.748 -13.592 1.00 3.54 N flip ATOM 0 H ASN A 121 12.041 -5.145 -15.465 1.00 3.97 H new ATOM 0 HA ASN A 121 10.571 -3.281 -17.152 1.00 3.62 H new ATOM 0 HB2 ASN A 121 12.919 -2.775 -15.286 1.00 3.73 H new ATOM 0 HB3 ASN A 121 11.799 -1.586 -15.921 1.00 3.73 H new ATOM 0 HD21 ASN A 121 11.970 -4.382 -13.738 1.00 3.54 H new ATOM 0 HD22 ASN A 121 10.568 -3.876 -12.789 1.00 3.54 H new ATOM 1732 N GLN A 122 12.234 -2.706 -18.904 1.00 3.37 N ATOM 1733 CA GLN A 122 13.142 -2.491 -20.023 1.00 3.56 C ATOM 1734 C GLN A 122 13.221 -1.009 -20.367 1.00 3.31 C ATOM 1735 O GLN A 122 12.267 -0.266 -20.149 1.00 2.89 O ATOM 1736 CB GLN A 122 12.683 -3.288 -21.246 1.00 3.57 C ATOM 1737 CG GLN A 122 12.255 -4.710 -20.922 1.00 3.72 C ATOM 1738 CD GLN A 122 13.433 -5.645 -20.729 1.00 4.32 C ATOM 1739 OE1 GLN A 122 14.291 -5.770 -21.603 1.00 4.63 O ATOM 1740 NE2 GLN A 122 13.480 -6.308 -19.580 1.00 4.52 N ATOM 0 H GLN A 122 11.320 -2.266 -19.013 1.00 3.37 H new ATOM 0 HA GLN A 122 14.133 -2.837 -19.731 1.00 3.56 H new ATOM 0 HB2 GLN A 122 11.851 -2.766 -21.718 1.00 3.57 H new ATOM 0 HB3 GLN A 122 13.494 -3.319 -21.974 1.00 3.57 H new ATOM 0 HG2 GLN A 122 11.648 -4.705 -20.017 1.00 3.72 H new ATOM 0 HG3 GLN A 122 11.624 -5.088 -21.727 1.00 3.72 H new ATOM 0 HE21 GLN A 122 12.747 -6.174 -18.883 1.00 4.52 H new ATOM 0 HE22 GLN A 122 14.249 -6.952 -19.394 1.00 4.52 H new ATOM 1749 N LEU A 123 14.357 -0.584 -20.906 1.00 3.63 N ATOM 1750 CA LEU A 123 14.544 0.812 -21.277 1.00 3.53 C ATOM 1751 C LEU A 123 13.728 1.152 -22.517 1.00 3.40 C ATOM 1752 O LEU A 123 13.685 0.380 -23.475 1.00 3.66 O ATOM 1753 CB LEU A 123 16.021 1.100 -21.534 1.00 3.98 C ATOM 1754 CG LEU A 123 16.412 2.578 -21.479 1.00 3.91 C ATOM 1755 CD1 LEU A 123 16.701 3.001 -20.047 1.00 4.28 C ATOM 1756 CD2 LEU A 123 17.617 2.844 -22.368 1.00 4.26 C ATOM 0 H LEU A 123 15.160 -1.184 -21.095 1.00 3.63 H new ATOM 0 HA LEU A 123 14.199 1.433 -20.450 1.00 3.53 H new ATOM 0 HB2 LEU A 123 16.615 0.555 -20.800 1.00 3.98 H new ATOM 0 HB3 LEU A 123 16.287 0.706 -22.515 1.00 3.98 H new ATOM 0 HG LEU A 123 15.574 3.169 -21.849 1.00 3.91 H new ATOM 0 HD11 LEU A 123 16.977 4.055 -20.028 1.00 4.28 H new ATOM 0 HD12 LEU A 123 15.812 2.848 -19.436 1.00 4.28 H new ATOM 0 HD13 LEU A 123 17.521 2.403 -19.650 1.00 4.28 H new ATOM 0 HD21 LEU A 123 17.881 3.900 -22.317 1.00 4.26 H new ATOM 0 HD22 LEU A 123 18.460 2.242 -22.028 1.00 4.26 H new ATOM 0 HD23 LEU A 123 17.375 2.580 -23.398 1.00 4.26 H new ATOM 1768 N LEU A 124 13.071 2.306 -22.490 1.00 3.08 N ATOM 1769 CA LEU A 124 12.246 2.739 -23.610 1.00 3.06 C ATOM 1770 C LEU A 124 13.077 2.965 -24.862 1.00 3.54 C ATOM 1771 O LEU A 124 14.256 3.315 -24.800 1.00 3.83 O ATOM 1772 CB LEU A 124 11.492 4.016 -23.261 1.00 2.80 C ATOM 1773 CG LEU A 124 10.674 4.636 -24.396 1.00 3.16 C ATOM 1774 CD1 LEU A 124 9.348 3.908 -24.560 1.00 3.63 C ATOM 1775 CD2 LEU A 124 10.446 6.119 -24.131 1.00 3.54 C ATOM 0 H LEU A 124 13.094 2.957 -21.705 1.00 3.08 H new ATOM 0 HA LEU A 124 11.531 1.941 -23.811 1.00 3.06 H new ATOM 0 HB2 LEU A 124 10.821 3.804 -22.429 1.00 2.80 H new ATOM 0 HB3 LEU A 124 12.211 4.756 -22.910 1.00 2.80 H new ATOM 0 HG LEU A 124 11.234 4.533 -25.326 1.00 3.16 H new ATOM 0 HD11 LEU A 124 8.781 4.364 -25.372 1.00 3.63 H new ATOM 0 HD12 LEU A 124 9.535 2.859 -24.792 1.00 3.63 H new ATOM 0 HD13 LEU A 124 8.777 3.979 -23.634 1.00 3.63 H new ATOM 0 HD21 LEU A 124 9.863 6.549 -24.946 1.00 3.54 H new ATOM 0 HD22 LEU A 124 9.905 6.242 -23.193 1.00 3.54 H new ATOM 0 HD23 LEU A 124 11.407 6.629 -24.065 1.00 3.54 H new ATOM 1787 N SER A 125 12.429 2.769 -25.993 1.00 3.65 N ATOM 1788 CA SER A 125 13.053 2.952 -27.298 1.00 4.15 C ATOM 1789 C SER A 125 12.218 3.889 -28.166 1.00 4.24 C ATOM 1790 O SER A 125 11.002 3.974 -28.002 1.00 3.97 O ATOM 1791 CB SER A 125 13.233 1.603 -27.997 1.00 4.38 C ATOM 1792 OG SER A 125 14.562 1.131 -27.862 1.00 4.97 O ATOM 0 H SER A 125 11.453 2.478 -26.038 1.00 3.65 H new ATOM 0 HA SER A 125 14.034 3.402 -27.148 1.00 4.15 H new ATOM 0 HB2 SER A 125 12.541 0.875 -27.573 1.00 4.38 H new ATOM 0 HB3 SER A 125 12.985 1.702 -29.054 1.00 4.38 H new ATOM 0 HG SER A 125 14.650 0.267 -28.316 1.00 4.97 H new ATOM 1798 N GLN A 126 12.867 4.582 -29.097 1.00 4.69 N ATOM 1799 CA GLN A 126 12.162 5.498 -29.988 1.00 4.90 C ATOM 1800 C GLN A 126 11.335 4.717 -31.004 1.00 5.02 C ATOM 1801 O GLN A 126 11.855 3.849 -31.706 1.00 5.28 O ATOM 1802 CB GLN A 126 13.151 6.411 -30.711 1.00 5.38 C ATOM 1803 CG GLN A 126 13.510 7.662 -29.926 1.00 5.30 C ATOM 1804 CD GLN A 126 12.645 8.850 -30.296 1.00 5.50 C ATOM 1805 OE1 GLN A 126 11.385 8.818 -29.876 1.00 5.93 O flip ATOM 1806 NE2 GLN A 126 13.102 9.787 -30.950 1.00 5.29 N flip ATOM 0 H GLN A 126 13.873 4.528 -29.254 1.00 4.69 H new ATOM 0 HA GLN A 126 11.493 6.114 -29.387 1.00 4.90 H new ATOM 0 HB2 GLN A 126 14.062 5.851 -30.922 1.00 5.38 H new ATOM 0 HB3 GLN A 126 12.727 6.704 -31.671 1.00 5.38 H new ATOM 0 HG2 GLN A 126 13.406 7.460 -28.860 1.00 5.30 H new ATOM 0 HG3 GLN A 126 14.557 7.910 -30.103 1.00 5.30 H new ATOM 0 HE21 GLN A 126 14.076 9.771 -31.252 1.00 5.29 H new ATOM 0 HE22 GLN A 126 12.507 10.580 -31.190 1.00 5.29 H new ATOM 1815 N GLY A 127 10.041 5.020 -31.070 1.00 4.87 N ATOM 1816 CA GLY A 127 9.164 4.328 -31.991 1.00 4.98 C ATOM 1817 C GLY A 127 9.207 2.826 -31.800 1.00 4.76 C ATOM 1818 O GLY A 127 8.904 2.064 -32.718 1.00 4.95 O ATOM 0 H GLY A 127 9.587 5.734 -30.500 1.00 4.87 H new ATOM 0 HA2 GLY A 127 8.142 4.681 -31.853 1.00 4.98 H new ATOM 0 HA3 GLY A 127 9.449 4.571 -33.014 1.00 4.98 H new ATOM 1822 N ASP A 128 9.591 2.403 -30.598 1.00 4.38 N ATOM 1823 CA ASP A 128 9.685 0.985 -30.271 1.00 4.21 C ATOM 1824 C ASP A 128 8.424 0.239 -30.687 1.00 4.01 C ATOM 1825 O ASP A 128 7.383 0.845 -30.940 1.00 4.01 O ATOM 1826 CB ASP A 128 9.925 0.806 -28.770 1.00 3.83 C ATOM 1827 CG ASP A 128 9.993 -0.651 -28.354 1.00 3.84 C ATOM 1828 OD1 ASP A 128 10.521 -1.468 -29.136 1.00 4.13 O ATOM 1829 OD2 ASP A 128 9.517 -0.975 -27.245 1.00 3.89 O ATOM 0 H ASP A 128 9.843 3.027 -29.831 1.00 4.38 H new ATOM 0 HA ASP A 128 10.526 0.567 -30.824 1.00 4.21 H new ATOM 0 HB2 ASP A 128 10.856 1.301 -28.494 1.00 3.83 H new ATOM 0 HB3 ASP A 128 9.125 1.300 -28.218 1.00 3.83 H new ATOM 1834 N GLU A 129 8.527 -1.080 -30.753 1.00 3.91 N ATOM 1835 CA GLU A 129 7.399 -1.915 -31.134 1.00 3.74 C ATOM 1836 C GLU A 129 7.389 -3.209 -30.329 1.00 3.41 C ATOM 1837 O GLU A 129 8.423 -3.856 -30.163 1.00 3.59 O ATOM 1838 CB GLU A 129 7.462 -2.230 -32.631 1.00 4.17 C ATOM 1839 CG GLU A 129 6.183 -2.836 -33.185 1.00 4.22 C ATOM 1840 CD GLU A 129 6.339 -3.314 -34.615 1.00 4.69 C ATOM 1841 OE1 GLU A 129 6.726 -4.486 -34.811 1.00 4.93 O ATOM 1842 OE2 GLU A 129 6.073 -2.518 -35.539 1.00 5.08 O ATOM 0 H GLU A 129 9.383 -1.596 -30.547 1.00 3.91 H new ATOM 0 HA GLU A 129 6.480 -1.370 -30.921 1.00 3.74 H new ATOM 0 HB2 GLU A 129 7.684 -1.313 -33.177 1.00 4.17 H new ATOM 0 HB3 GLU A 129 8.288 -2.918 -32.814 1.00 4.17 H new ATOM 0 HG2 GLU A 129 5.880 -3.673 -32.557 1.00 4.22 H new ATOM 0 HG3 GLU A 129 5.384 -2.096 -33.138 1.00 4.22 H new ATOM 1849 N ILE A 130 6.215 -3.586 -29.831 1.00 3.02 N ATOM 1850 CA ILE A 130 6.079 -4.804 -29.048 1.00 2.73 C ATOM 1851 C ILE A 130 5.188 -5.813 -29.759 1.00 2.74 C ATOM 1852 O ILE A 130 4.073 -5.492 -30.171 1.00 2.67 O ATOM 1853 CB ILE A 130 5.499 -4.521 -27.647 1.00 2.25 C ATOM 1854 CG1 ILE A 130 6.215 -3.335 -26.996 1.00 2.24 C ATOM 1855 CG2 ILE A 130 5.607 -5.758 -26.770 1.00 2.11 C ATOM 1856 CD1 ILE A 130 5.273 -2.352 -26.334 1.00 2.04 C ATOM 0 H ILE A 130 5.347 -3.065 -29.957 1.00 3.02 H new ATOM 0 HA ILE A 130 7.081 -5.218 -28.936 1.00 2.73 H new ATOM 0 HB ILE A 130 4.445 -4.265 -27.755 1.00 2.25 H new ATOM 0 HG12 ILE A 130 6.919 -3.709 -26.252 1.00 2.24 H new ATOM 0 HG13 ILE A 130 6.799 -2.813 -27.754 1.00 2.24 H new ATOM 0 HG21 ILE A 130 5.194 -5.543 -25.785 1.00 2.11 H new ATOM 0 HG22 ILE A 130 5.051 -6.577 -27.226 1.00 2.11 H new ATOM 0 HG23 ILE A 130 6.654 -6.043 -26.670 1.00 2.11 H new ATOM 0 HD11 ILE A 130 5.848 -1.537 -25.893 1.00 2.04 H new ATOM 0 HD12 ILE A 130 4.585 -1.950 -27.078 1.00 2.04 H new ATOM 0 HD13 ILE A 130 4.707 -2.860 -25.553 1.00 2.04 H new ATOM 1868 N THR A 131 5.686 -7.034 -29.898 1.00 2.91 N ATOM 1869 CA THR A 131 4.939 -8.096 -30.555 1.00 2.95 C ATOM 1870 C THR A 131 4.375 -9.054 -29.512 1.00 2.65 C ATOM 1871 O THR A 131 5.022 -9.338 -28.506 1.00 2.66 O ATOM 1872 CB THR A 131 5.842 -8.844 -31.536 1.00 3.44 C ATOM 1873 OG1 THR A 131 6.572 -7.932 -32.339 1.00 3.74 O ATOM 1874 CG2 THR A 131 5.086 -9.765 -32.464 1.00 3.61 C ATOM 0 H THR A 131 6.608 -7.314 -29.563 1.00 2.91 H new ATOM 0 HA THR A 131 4.111 -7.658 -31.112 1.00 2.95 H new ATOM 0 HB THR A 131 6.505 -9.446 -30.915 1.00 3.44 H new ATOM 0 HG1 THR A 131 7.145 -8.429 -32.959 1.00 3.74 H new ATOM 0 HG21 THR A 131 5.788 -10.264 -33.133 1.00 3.61 H new ATOM 0 HG22 THR A 131 4.550 -10.512 -31.878 1.00 3.61 H new ATOM 0 HG23 THR A 131 4.374 -9.185 -33.052 1.00 3.61 H new ATOM 1882 N VAL A 132 3.156 -9.529 -29.738 1.00 2.47 N ATOM 1883 CA VAL A 132 2.515 -10.431 -28.790 1.00 2.26 C ATOM 1884 C VAL A 132 1.732 -11.541 -29.483 1.00 2.37 C ATOM 1885 O VAL A 132 1.355 -11.420 -30.648 1.00 2.51 O ATOM 1886 CB VAL A 132 1.573 -9.658 -27.854 1.00 1.85 C ATOM 1887 CG1 VAL A 132 2.349 -8.632 -27.044 1.00 1.72 C ATOM 1888 CG2 VAL A 132 0.457 -8.988 -28.644 1.00 1.84 C ATOM 0 H VAL A 132 2.596 -9.307 -30.561 1.00 2.47 H new ATOM 0 HA VAL A 132 3.316 -10.891 -28.211 1.00 2.26 H new ATOM 0 HB VAL A 132 1.119 -10.368 -27.163 1.00 1.85 H new ATOM 0 HG11 VAL A 132 1.665 -8.094 -26.387 1.00 1.72 H new ATOM 0 HG12 VAL A 132 3.105 -9.138 -26.444 1.00 1.72 H new ATOM 0 HG13 VAL A 132 2.833 -7.926 -27.719 1.00 1.72 H new ATOM 0 HG21 VAL A 132 -0.198 -8.447 -27.961 1.00 1.84 H new ATOM 0 HG22 VAL A 132 0.888 -8.291 -29.363 1.00 1.84 H new ATOM 0 HG23 VAL A 132 -0.119 -9.746 -29.174 1.00 1.84 H new ATOM 1898 N GLY A 133 1.492 -12.626 -28.749 1.00 2.39 N ATOM 1899 CA GLY A 133 0.761 -13.746 -29.287 1.00 2.51 C ATOM 1900 C GLY A 133 1.635 -14.633 -30.142 1.00 2.89 C ATOM 1901 O GLY A 133 1.243 -15.043 -31.234 1.00 2.98 O ATOM 0 H GLY A 133 1.797 -12.743 -27.783 1.00 2.39 H new ATOM 0 HA2 GLY A 133 0.340 -14.331 -28.469 1.00 2.51 H new ATOM 0 HA3 GLY A 133 -0.077 -13.381 -29.881 1.00 2.51 H new ATOM 1905 N VAL A 134 2.833 -14.909 -29.650 1.00 3.17 N ATOM 1906 CA VAL A 134 3.782 -15.724 -30.369 1.00 3.61 C ATOM 1907 C VAL A 134 3.569 -17.214 -30.134 1.00 3.82 C ATOM 1908 O VAL A 134 3.246 -17.655 -29.031 1.00 3.79 O ATOM 1909 CB VAL A 134 5.225 -15.327 -30.025 1.00 3.86 C ATOM 1910 CG1 VAL A 134 6.224 -16.327 -30.598 1.00 4.36 C ATOM 1911 CG2 VAL A 134 5.497 -13.927 -30.547 1.00 3.74 C ATOM 0 H VAL A 134 3.167 -14.574 -28.746 1.00 3.17 H new ATOM 0 HA VAL A 134 3.610 -15.537 -31.429 1.00 3.61 H new ATOM 0 HB VAL A 134 5.346 -15.336 -28.942 1.00 3.86 H new ATOM 0 HG11 VAL A 134 7.237 -16.019 -30.338 1.00 4.36 H new ATOM 0 HG12 VAL A 134 6.028 -17.316 -30.183 1.00 4.36 H new ATOM 0 HG13 VAL A 134 6.123 -16.362 -31.683 1.00 4.36 H new ATOM 0 HG21 VAL A 134 6.521 -13.641 -30.305 1.00 3.74 H new ATOM 0 HG22 VAL A 134 5.361 -13.909 -31.628 1.00 3.74 H new ATOM 0 HG23 VAL A 134 4.805 -13.225 -30.083 1.00 3.74 H new ATOM 1921 N GLY A 135 3.737 -17.969 -31.209 1.00 4.09 N ATOM 1922 CA GLY A 135 3.554 -19.394 -31.188 1.00 4.33 C ATOM 1923 C GLY A 135 3.089 -19.867 -32.544 1.00 4.42 C ATOM 1924 O GLY A 135 3.551 -20.883 -33.065 1.00 4.77 O ATOM 0 H GLY A 135 4.006 -17.599 -32.121 1.00 4.09 H new ATOM 0 HA2 GLY A 135 4.489 -19.887 -30.921 1.00 4.33 H new ATOM 0 HA3 GLY A 135 2.822 -19.665 -30.427 1.00 4.33 H new ATOM 1928 N VAL A 136 2.192 -19.080 -33.126 1.00 4.15 N ATOM 1929 CA VAL A 136 1.657 -19.332 -34.438 1.00 4.26 C ATOM 1930 C VAL A 136 1.835 -18.084 -35.296 1.00 4.26 C ATOM 1931 O VAL A 136 1.357 -17.008 -34.939 1.00 3.97 O ATOM 1932 CB VAL A 136 0.166 -19.717 -34.387 1.00 4.03 C ATOM 1933 CG1 VAL A 136 -0.353 -20.041 -35.780 1.00 4.19 C ATOM 1934 CG2 VAL A 136 -0.050 -20.890 -33.444 1.00 4.07 C ATOM 0 H VAL A 136 1.817 -18.240 -32.685 1.00 4.15 H new ATOM 0 HA VAL A 136 2.199 -20.173 -34.870 1.00 4.26 H new ATOM 0 HB VAL A 136 -0.396 -18.865 -34.006 1.00 4.03 H new ATOM 0 HG11 VAL A 136 -1.408 -20.310 -35.722 1.00 4.19 H new ATOM 0 HG12 VAL A 136 -0.236 -19.169 -36.424 1.00 4.19 H new ATOM 0 HG13 VAL A 136 0.212 -20.876 -36.194 1.00 4.19 H new ATOM 0 HG21 VAL A 136 -1.109 -21.148 -33.421 1.00 4.07 H new ATOM 0 HG22 VAL A 136 0.525 -21.748 -33.793 1.00 4.07 H new ATOM 0 HG23 VAL A 136 0.279 -20.616 -32.441 1.00 4.07 H new ATOM 1944 N GLU A 137 2.542 -18.221 -36.410 1.00 4.65 N ATOM 1945 CA GLU A 137 2.798 -17.087 -37.294 1.00 4.78 C ATOM 1946 C GLU A 137 1.512 -16.332 -37.621 1.00 4.53 C ATOM 1947 O GLU A 137 1.540 -15.137 -37.915 1.00 4.50 O ATOM 1948 CB GLU A 137 3.463 -17.566 -38.586 1.00 5.27 C ATOM 1949 CG GLU A 137 4.299 -16.498 -39.271 1.00 5.65 C ATOM 1950 CD GLU A 137 5.325 -17.084 -40.222 1.00 5.71 C ATOM 1951 OE1 GLU A 137 5.910 -18.136 -39.890 1.00 5.73 O ATOM 1952 OE2 GLU A 137 5.542 -16.490 -41.299 1.00 6.05 O ATOM 0 H GLU A 137 2.948 -19.102 -36.724 1.00 4.65 H new ATOM 0 HA GLU A 137 3.468 -16.403 -36.773 1.00 4.78 H new ATOM 0 HB2 GLU A 137 4.097 -18.424 -38.362 1.00 5.27 H new ATOM 0 HB3 GLU A 137 2.692 -17.910 -39.276 1.00 5.27 H new ATOM 0 HG2 GLU A 137 3.642 -15.824 -39.821 1.00 5.65 H new ATOM 0 HG3 GLU A 137 4.809 -15.900 -38.515 1.00 5.65 H new ATOM 1959 N SER A 138 0.388 -17.038 -37.578 1.00 4.41 N ATOM 1960 CA SER A 138 -0.898 -16.447 -37.880 1.00 4.27 C ATOM 1961 C SER A 138 -1.624 -15.954 -36.626 1.00 3.83 C ATOM 1962 O SER A 138 -2.791 -15.569 -36.703 1.00 3.75 O ATOM 1963 CB SER A 138 -1.778 -17.454 -38.623 1.00 4.45 C ATOM 1964 OG SER A 138 -2.561 -16.812 -39.616 1.00 4.92 O ATOM 0 H SER A 138 0.348 -18.028 -37.334 1.00 4.41 H new ATOM 0 HA SER A 138 -0.710 -15.579 -38.512 1.00 4.27 H new ATOM 0 HB2 SER A 138 -1.152 -18.217 -39.086 1.00 4.45 H new ATOM 0 HB3 SER A 138 -2.430 -17.964 -37.914 1.00 4.45 H new ATOM 0 HG SER A 138 -3.113 -17.477 -40.078 1.00 4.92 H new ATOM 1970 N ASP A 139 -0.958 -15.979 -35.471 1.00 3.61 N ATOM 1971 CA ASP A 139 -1.596 -15.545 -34.239 1.00 3.23 C ATOM 1972 C ASP A 139 -0.767 -14.548 -33.451 1.00 3.08 C ATOM 1973 O ASP A 139 -0.904 -14.430 -32.233 1.00 2.82 O ATOM 1974 CB ASP A 139 -1.931 -16.741 -33.366 1.00 3.14 C ATOM 1975 CG ASP A 139 -2.830 -17.738 -34.070 1.00 3.23 C ATOM 1976 OD1 ASP A 139 -3.746 -17.300 -34.797 1.00 3.57 O ATOM 1977 OD2 ASP A 139 -2.618 -18.955 -33.895 1.00 3.45 O ATOM 0 H ASP A 139 0.008 -16.291 -35.368 1.00 3.61 H new ATOM 0 HA ASP A 139 -2.511 -15.031 -34.534 1.00 3.23 H new ATOM 0 HB2 ASP A 139 -1.008 -17.237 -33.065 1.00 3.14 H new ATOM 0 HB3 ASP A 139 -2.419 -16.396 -32.454 1.00 3.14 H new ATOM 1982 N ILE A 140 0.059 -13.816 -34.155 1.00 3.29 N ATOM 1983 CA ILE A 140 0.891 -12.799 -33.546 1.00 3.21 C ATOM 1984 C ILE A 140 0.391 -11.401 -33.890 1.00 3.18 C ATOM 1985 O ILE A 140 -0.016 -11.127 -35.019 1.00 3.45 O ATOM 1986 CB ILE A 140 2.370 -12.904 -33.951 1.00 3.56 C ATOM 1987 CG1 ILE A 140 2.899 -14.322 -33.737 1.00 3.74 C ATOM 1988 CG2 ILE A 140 3.200 -11.908 -33.157 1.00 3.48 C ATOM 1989 CD1 ILE A 140 3.777 -14.819 -34.863 1.00 4.22 C ATOM 0 H ILE A 140 0.177 -13.905 -35.164 1.00 3.29 H new ATOM 0 HA ILE A 140 0.821 -12.972 -32.472 1.00 3.21 H new ATOM 0 HB ILE A 140 2.451 -12.670 -35.012 1.00 3.56 H new ATOM 0 HG12 ILE A 140 3.465 -14.353 -32.806 1.00 3.74 H new ATOM 0 HG13 ILE A 140 2.055 -15.001 -33.619 1.00 3.74 H new ATOM 0 HG21 ILE A 140 4.246 -11.990 -33.451 1.00 3.48 H new ATOM 0 HG22 ILE A 140 2.845 -10.897 -33.357 1.00 3.48 H new ATOM 0 HG23 ILE A 140 3.105 -12.122 -32.092 1.00 3.48 H new ATOM 0 HD11 ILE A 140 4.115 -15.831 -34.641 1.00 4.22 H new ATOM 0 HD12 ILE A 140 3.209 -14.822 -35.793 1.00 4.22 H new ATOM 0 HD13 ILE A 140 4.641 -14.163 -34.967 1.00 4.22 H new ATOM 2001 N LEU A 141 0.434 -10.530 -32.899 1.00 2.92 N ATOM 2002 CA LEU A 141 -0.004 -9.146 -33.054 1.00 2.95 C ATOM 2003 C LEU A 141 1.109 -8.186 -32.641 1.00 2.97 C ATOM 2004 O LEU A 141 1.747 -8.378 -31.606 1.00 2.75 O ATOM 2005 CB LEU A 141 -1.255 -8.887 -32.214 1.00 2.69 C ATOM 2006 CG LEU A 141 -2.262 -7.916 -32.833 1.00 2.94 C ATOM 2007 CD1 LEU A 141 -3.658 -8.177 -32.289 1.00 3.05 C ATOM 2008 CD2 LEU A 141 -1.845 -6.478 -32.568 1.00 3.19 C ATOM 0 H LEU A 141 0.772 -10.757 -31.964 1.00 2.92 H new ATOM 0 HA LEU A 141 -0.243 -8.976 -34.104 1.00 2.95 H new ATOM 0 HB2 LEU A 141 -1.755 -9.838 -32.032 1.00 2.69 H new ATOM 0 HB3 LEU A 141 -0.948 -8.498 -31.243 1.00 2.69 H new ATOM 0 HG LEU A 141 -2.279 -8.076 -33.911 1.00 2.94 H new ATOM 0 HD11 LEU A 141 -4.361 -7.477 -32.740 1.00 3.05 H new ATOM 0 HD12 LEU A 141 -3.957 -9.197 -32.529 1.00 3.05 H new ATOM 0 HD13 LEU A 141 -3.658 -8.044 -31.207 1.00 3.05 H new ATOM 0 HD21 LEU A 141 -2.572 -5.800 -33.015 1.00 3.19 H new ATOM 0 HD22 LEU A 141 -1.800 -6.304 -31.493 1.00 3.19 H new ATOM 0 HD23 LEU A 141 -0.863 -6.297 -33.006 1.00 3.19 H new ATOM 2020 N SER A 142 1.345 -7.158 -33.451 1.00 3.29 N ATOM 2021 CA SER A 142 2.389 -6.188 -33.149 1.00 3.38 C ATOM 2022 C SER A 142 1.822 -4.836 -32.762 1.00 3.35 C ATOM 2023 O SER A 142 0.743 -4.439 -33.202 1.00 3.56 O ATOM 2024 CB SER A 142 3.332 -6.020 -34.316 1.00 3.86 C ATOM 2025 OG SER A 142 4.367 -5.102 -34.011 1.00 4.19 O ATOM 0 H SER A 142 0.832 -6.977 -34.314 1.00 3.29 H new ATOM 0 HA SER A 142 2.938 -6.585 -32.295 1.00 3.38 H new ATOM 0 HB2 SER A 142 3.765 -6.985 -34.579 1.00 3.86 H new ATOM 0 HB3 SER A 142 2.778 -5.671 -35.187 1.00 3.86 H new ATOM 0 HG SER A 142 5.210 -5.419 -34.397 1.00 4.19 H new ATOM 2031 N LEU A 143 2.578 -4.137 -31.934 1.00 3.18 N ATOM 2032 CA LEU A 143 2.196 -2.812 -31.459 1.00 3.18 C ATOM 2033 C LEU A 143 3.390 -1.862 -31.481 1.00 3.38 C ATOM 2034 O LEU A 143 4.499 -2.244 -31.117 1.00 3.34 O ATOM 2035 CB LEU A 143 1.629 -2.907 -30.040 1.00 2.71 C ATOM 2036 CG LEU A 143 0.127 -3.189 -29.954 1.00 2.66 C ATOM 2037 CD1 LEU A 143 -0.650 -2.255 -30.867 1.00 3.08 C ATOM 2038 CD2 LEU A 143 -0.161 -4.642 -30.305 1.00 3.22 C ATOM 0 H LEU A 143 3.472 -4.468 -31.571 1.00 3.18 H new ATOM 0 HA LEU A 143 1.430 -2.416 -32.126 1.00 3.18 H new ATOM 0 HB2 LEU A 143 2.161 -3.694 -29.506 1.00 2.71 H new ATOM 0 HB3 LEU A 143 1.837 -1.972 -29.520 1.00 2.71 H new ATOM 0 HG LEU A 143 -0.197 -3.009 -28.929 1.00 2.66 H new ATOM 0 HD11 LEU A 143 -1.715 -2.473 -30.790 1.00 3.08 H new ATOM 0 HD12 LEU A 143 -0.469 -1.222 -30.570 1.00 3.08 H new ATOM 0 HD13 LEU A 143 -0.324 -2.399 -31.897 1.00 3.08 H new ATOM 0 HD21 LEU A 143 -1.233 -4.827 -30.239 1.00 3.22 H new ATOM 0 HD22 LEU A 143 0.181 -4.846 -31.320 1.00 3.22 H new ATOM 0 HD23 LEU A 143 0.363 -5.296 -29.608 1.00 3.22 H new ATOM 2050 N VAL A 144 3.159 -0.621 -31.899 1.00 3.67 N ATOM 2051 CA VAL A 144 4.226 0.374 -31.951 1.00 3.89 C ATOM 2052 C VAL A 144 4.009 1.462 -30.905 1.00 3.73 C ATOM 2053 O VAL A 144 2.884 1.918 -30.696 1.00 3.75 O ATOM 2054 CB VAL A 144 4.330 1.031 -33.340 1.00 4.46 C ATOM 2055 CG1 VAL A 144 5.574 1.905 -33.423 1.00 4.72 C ATOM 2056 CG2 VAL A 144 4.339 -0.027 -34.432 1.00 4.65 C ATOM 0 H VAL A 144 2.247 -0.281 -32.205 1.00 3.67 H new ATOM 0 HA VAL A 144 5.156 -0.155 -31.743 1.00 3.89 H new ATOM 0 HB VAL A 144 3.456 1.665 -33.489 1.00 4.46 H new ATOM 0 HG11 VAL A 144 5.632 2.362 -34.411 1.00 4.72 H new ATOM 0 HG12 VAL A 144 5.521 2.686 -32.665 1.00 4.72 H new ATOM 0 HG13 VAL A 144 6.460 1.294 -33.253 1.00 4.72 H new ATOM 0 HG21 VAL A 144 4.413 0.456 -35.406 1.00 4.65 H new ATOM 0 HG22 VAL A 144 5.193 -0.689 -34.290 1.00 4.65 H new ATOM 0 HG23 VAL A 144 3.418 -0.607 -34.384 1.00 4.65 H new ATOM 2066 N ILE A 145 5.086 1.861 -30.239 1.00 3.65 N ATOM 2067 CA ILE A 145 5.025 2.865 -29.214 1.00 3.51 C ATOM 2068 C ILE A 145 5.602 4.192 -29.706 1.00 3.94 C ATOM 2069 O ILE A 145 6.739 4.254 -30.171 1.00 4.16 O ATOM 2070 CB ILE A 145 5.813 2.374 -27.991 1.00 3.10 C ATOM 2071 CG1 ILE A 145 5.039 1.252 -27.290 1.00 2.57 C ATOM 2072 CG2 ILE A 145 6.103 3.518 -27.051 1.00 3.09 C ATOM 2073 CD1 ILE A 145 5.528 0.940 -25.891 1.00 2.34 C ATOM 0 H ILE A 145 6.022 1.490 -30.404 1.00 3.65 H new ATOM 0 HA ILE A 145 3.982 3.033 -28.947 1.00 3.51 H new ATOM 0 HB ILE A 145 6.771 1.973 -28.320 1.00 3.10 H new ATOM 0 HG12 ILE A 145 3.986 1.528 -27.241 1.00 2.57 H new ATOM 0 HG13 ILE A 145 5.104 0.348 -27.895 1.00 2.57 H new ATOM 0 HG21 ILE A 145 6.662 3.149 -26.191 1.00 3.09 H new ATOM 0 HG22 ILE A 145 6.692 4.275 -27.569 1.00 3.09 H new ATOM 0 HG23 ILE A 145 5.165 3.958 -26.713 1.00 3.09 H new ATOM 0 HD11 ILE A 145 4.927 0.136 -25.467 1.00 2.34 H new ATOM 0 HD12 ILE A 145 6.572 0.631 -25.931 1.00 2.34 H new ATOM 0 HD13 ILE A 145 5.437 1.829 -25.267 1.00 2.34 H new ATOM 2085 N PHE A 146 4.807 5.250 -29.591 1.00 4.11 N ATOM 2086 CA PHE A 146 5.226 6.581 -30.011 1.00 4.53 C ATOM 2087 C PHE A 146 5.462 7.475 -28.798 1.00 4.37 C ATOM 2088 O PHE A 146 4.522 7.834 -28.090 1.00 4.27 O ATOM 2089 CB PHE A 146 4.166 7.204 -30.924 1.00 4.97 C ATOM 2090 CG PHE A 146 4.707 7.652 -32.250 1.00 5.46 C ATOM 2091 CD1 PHE A 146 5.394 8.849 -32.363 1.00 5.94 C ATOM 2092 CD2 PHE A 146 4.526 6.877 -33.384 1.00 5.72 C ATOM 2093 CE1 PHE A 146 5.894 9.265 -33.582 1.00 6.42 C ATOM 2094 CE2 PHE A 146 5.022 7.287 -34.606 1.00 6.19 C ATOM 2095 CZ PHE A 146 5.707 8.483 -34.705 1.00 6.45 C ATOM 0 H PHE A 146 3.863 5.210 -29.208 1.00 4.11 H new ATOM 0 HA PHE A 146 6.161 6.491 -30.563 1.00 4.53 H new ATOM 0 HB2 PHE A 146 3.370 6.478 -31.092 1.00 4.97 H new ATOM 0 HB3 PHE A 146 3.717 8.058 -30.416 1.00 4.97 H new ATOM 0 HD1 PHE A 146 5.541 9.465 -31.488 1.00 5.94 H new ATOM 0 HD2 PHE A 146 3.991 5.942 -33.312 1.00 5.72 H new ATOM 0 HE1 PHE A 146 6.430 10.200 -33.657 1.00 6.42 H new ATOM 0 HE2 PHE A 146 4.875 6.674 -35.483 1.00 6.19 H new ATOM 0 HZ PHE A 146 6.096 8.806 -35.659 1.00 6.45 H new ATOM 2105 N ILE A 147 6.721 7.825 -28.561 1.00 4.42 N ATOM 2106 CA ILE A 147 7.074 8.669 -27.428 1.00 4.30 C ATOM 2107 C ILE A 147 6.922 10.148 -27.757 1.00 4.75 C ATOM 2108 O ILE A 147 7.353 10.609 -28.814 1.00 5.16 O ATOM 2109 CB ILE A 147 8.499 8.403 -26.954 1.00 4.19 C ATOM 2110 CG1 ILE A 147 8.744 6.900 -26.809 1.00 3.87 C ATOM 2111 CG2 ILE A 147 8.770 9.124 -25.642 1.00 4.01 C ATOM 2112 CD1 ILE A 147 10.056 6.444 -27.400 1.00 4.20 C ATOM 0 H ILE A 147 7.512 7.538 -29.137 1.00 4.42 H new ATOM 0 HA ILE A 147 6.380 8.414 -26.627 1.00 4.30 H new ATOM 0 HB ILE A 147 9.190 8.790 -27.703 1.00 4.19 H new ATOM 0 HG12 ILE A 147 8.720 6.636 -25.752 1.00 3.87 H new ATOM 0 HG13 ILE A 147 7.930 6.359 -27.291 1.00 3.87 H new ATOM 0 HG21 ILE A 147 9.792 8.922 -25.320 1.00 4.01 H new ATOM 0 HG22 ILE A 147 8.639 10.197 -25.783 1.00 4.01 H new ATOM 0 HG23 ILE A 147 8.073 8.770 -24.882 1.00 4.01 H new ATOM 0 HD11 ILE A 147 10.163 5.368 -27.261 1.00 4.20 H new ATOM 0 HD12 ILE A 147 10.076 6.676 -28.465 1.00 4.20 H new ATOM 0 HD13 ILE A 147 10.878 6.958 -26.901 1.00 4.20 H new ATOM 2124 N ASN A 148 6.304 10.886 -26.842 1.00 4.69 N ATOM 2125 CA ASN A 148 6.088 12.315 -27.025 1.00 5.12 C ATOM 2126 C ASN A 148 7.379 13.096 -26.797 1.00 5.18 C ATOM 2127 O ASN A 148 7.920 13.110 -25.692 1.00 4.87 O ATOM 2128 CB ASN A 148 5.002 12.809 -26.068 1.00 5.12 C ATOM 2129 CG ASN A 148 3.864 13.501 -26.792 1.00 5.72 C ATOM 2130 OD1 ASN A 148 3.135 12.878 -27.562 1.00 6.13 O ATOM 2131 ND2 ASN A 148 3.710 14.796 -26.547 1.00 5.99 N ATOM 0 H ASN A 148 5.943 10.516 -25.963 1.00 4.69 H new ATOM 0 HA ASN A 148 5.764 12.482 -28.052 1.00 5.12 H new ATOM 0 HB2 ASN A 148 4.609 11.964 -25.502 1.00 5.12 H new ATOM 0 HB3 ASN A 148 5.443 13.498 -25.347 1.00 5.12 H new ATOM 0 HD21 ASN A 148 2.962 15.316 -27.006 1.00 5.99 H new ATOM 0 HD22 ASN A 148 4.339 15.271 -25.900 1.00 5.99 H new ATOM 2138 N ASP A 149 7.865 13.748 -27.849 1.00 5.59 N ATOM 2139 CA ASP A 149 9.088 14.534 -27.760 1.00 5.72 C ATOM 2140 C ASP A 149 8.933 15.662 -26.747 1.00 5.73 C ATOM 2141 O ASP A 149 9.868 15.989 -26.017 1.00 5.63 O ATOM 2142 CB ASP A 149 9.453 15.105 -29.133 1.00 6.24 C ATOM 2143 CG ASP A 149 10.873 14.764 -29.543 1.00 6.12 C ATOM 2144 OD1 ASP A 149 11.795 15.527 -29.184 1.00 6.36 O ATOM 2145 OD2 ASP A 149 11.063 13.733 -30.223 1.00 6.10 O ATOM 0 H ASP A 149 7.430 13.747 -28.772 1.00 5.59 H new ATOM 0 HA ASP A 149 9.892 13.878 -27.425 1.00 5.72 H new ATOM 0 HB2 ASP A 149 8.760 14.719 -29.880 1.00 6.24 H new ATOM 0 HB3 ASP A 149 9.333 16.188 -29.116 1.00 6.24 H new ATOM 2150 N LYS A 150 7.741 16.252 -26.706 1.00 5.90 N ATOM 2151 CA LYS A 150 7.459 17.338 -25.783 1.00 5.99 C ATOM 2152 C LYS A 150 7.665 16.884 -24.344 1.00 5.55 C ATOM 2153 O LYS A 150 8.279 17.586 -23.539 1.00 5.54 O ATOM 2154 CB LYS A 150 6.025 17.840 -25.975 1.00 6.27 C ATOM 2155 CG LYS A 150 5.914 19.354 -26.045 1.00 6.70 C ATOM 2156 CD LYS A 150 4.717 19.786 -26.876 1.00 6.90 C ATOM 2157 CE LYS A 150 4.876 21.210 -27.385 1.00 7.37 C ATOM 2158 NZ LYS A 150 3.561 21.846 -27.674 1.00 7.77 N ATOM 0 H LYS A 150 6.956 15.993 -27.304 1.00 5.90 H new ATOM 0 HA LYS A 150 8.150 18.155 -25.993 1.00 5.99 H new ATOM 0 HB2 LYS A 150 5.619 17.412 -26.891 1.00 6.27 H new ATOM 0 HB3 LYS A 150 5.409 17.477 -25.153 1.00 6.27 H new ATOM 0 HG2 LYS A 150 5.825 19.760 -25.038 1.00 6.70 H new ATOM 0 HG3 LYS A 150 6.826 19.767 -26.476 1.00 6.70 H new ATOM 0 HD2 LYS A 150 4.596 19.108 -27.721 1.00 6.90 H new ATOM 0 HD3 LYS A 150 3.810 19.712 -26.275 1.00 6.90 H new ATOM 0 HE2 LYS A 150 5.411 21.803 -26.643 1.00 7.37 H new ATOM 0 HE3 LYS A 150 5.484 21.207 -28.289 1.00 7.37 H new ATOM 0 HZ1 LYS A 150 3.713 22.815 -28.019 1.00 7.77 H new ATOM 0 HZ2 LYS A 150 3.061 21.295 -28.400 1.00 7.77 H new ATOM 0 HZ3 LYS A 150 2.990 21.873 -26.805 1.00 7.77 H new ATOM 2172 N PHE A 151 7.152 15.699 -24.031 1.00 5.21 N ATOM 2173 CA PHE A 151 7.276 15.136 -22.698 1.00 4.81 C ATOM 2174 C PHE A 151 8.742 15.014 -22.295 1.00 4.63 C ATOM 2175 O PHE A 151 9.120 15.349 -21.174 1.00 4.50 O ATOM 2176 CB PHE A 151 6.603 13.765 -22.640 1.00 4.50 C ATOM 2177 CG PHE A 151 6.372 13.265 -21.243 1.00 4.18 C ATOM 2178 CD1 PHE A 151 5.198 13.564 -20.571 1.00 4.47 C ATOM 2179 CD2 PHE A 151 7.329 12.494 -20.602 1.00 3.96 C ATOM 2180 CE1 PHE A 151 4.982 13.104 -19.286 1.00 4.27 C ATOM 2181 CE2 PHE A 151 7.120 12.032 -19.317 1.00 3.77 C ATOM 2182 CZ PHE A 151 5.944 12.337 -18.658 1.00 3.76 C ATOM 0 H PHE A 151 6.644 15.109 -24.690 1.00 5.21 H new ATOM 0 HA PHE A 151 6.780 15.807 -21.997 1.00 4.81 H new ATOM 0 HB2 PHE A 151 5.647 13.817 -23.161 1.00 4.50 H new ATOM 0 HB3 PHE A 151 7.220 13.044 -23.177 1.00 4.50 H new ATOM 0 HD1 PHE A 151 4.443 14.164 -21.057 1.00 4.47 H new ATOM 0 HD2 PHE A 151 8.249 12.252 -21.113 1.00 3.96 H new ATOM 0 HE1 PHE A 151 4.062 13.344 -18.773 1.00 4.27 H new ATOM 0 HE2 PHE A 151 7.874 11.433 -18.828 1.00 3.77 H new ATOM 0 HZ PHE A 151 5.777 11.976 -17.654 1.00 3.76 H new ATOM 2192 N LYS A 152 9.561 14.532 -23.224 1.00 4.67 N ATOM 2193 CA LYS A 152 10.987 14.364 -22.976 1.00 4.59 C ATOM 2194 C LYS A 152 11.647 15.705 -22.673 1.00 4.83 C ATOM 2195 O LYS A 152 12.544 15.792 -21.835 1.00 4.70 O ATOM 2196 CB LYS A 152 11.661 13.711 -24.184 1.00 4.75 C ATOM 2197 CG LYS A 152 11.562 12.194 -24.189 1.00 4.51 C ATOM 2198 CD LYS A 152 12.294 11.590 -25.377 1.00 4.68 C ATOM 2199 CE LYS A 152 13.665 11.066 -24.981 1.00 4.78 C ATOM 2200 NZ LYS A 152 13.568 9.860 -24.113 1.00 5.19 N ATOM 0 H LYS A 152 9.260 14.251 -24.157 1.00 4.67 H new ATOM 0 HA LYS A 152 11.107 13.716 -22.108 1.00 4.59 H new ATOM 0 HB2 LYS A 152 11.208 14.099 -25.096 1.00 4.75 H new ATOM 0 HB3 LYS A 152 12.712 13.998 -24.203 1.00 4.75 H new ATOM 0 HG2 LYS A 152 11.980 11.798 -23.263 1.00 4.51 H new ATOM 0 HG3 LYS A 152 10.514 11.897 -24.217 1.00 4.51 H new ATOM 0 HD2 LYS A 152 11.700 10.778 -25.796 1.00 4.68 H new ATOM 0 HD3 LYS A 152 12.403 12.342 -26.159 1.00 4.68 H new ATOM 0 HE2 LYS A 152 14.234 10.823 -25.878 1.00 4.78 H new ATOM 0 HE3 LYS A 152 14.215 11.848 -24.457 1.00 4.78 H new ATOM 0 HZ1 LYS A 152 14.462 9.331 -24.153 1.00 5.19 H new ATOM 0 HZ2 LYS A 152 13.382 10.152 -23.132 1.00 5.19 H new ATOM 0 HZ3 LYS A 152 12.792 9.254 -24.447 1.00 5.19 H new ATOM 2214 N GLN A 153 11.197 16.750 -23.362 1.00 5.21 N ATOM 2215 CA GLN A 153 11.742 18.087 -23.165 1.00 5.48 C ATOM 2216 C GLN A 153 11.411 18.606 -21.769 1.00 5.31 C ATOM 2217 O GLN A 153 12.280 19.119 -21.064 1.00 5.31 O ATOM 2218 CB GLN A 153 11.198 19.045 -24.227 1.00 5.94 C ATOM 2219 CG GLN A 153 12.246 19.502 -25.228 1.00 6.26 C ATOM 2220 CD GLN A 153 12.225 21.001 -25.453 1.00 6.64 C ATOM 2221 OE1 GLN A 153 13.187 21.702 -25.139 1.00 6.99 O ATOM 2222 NE2 GLN A 153 11.122 21.501 -25.999 1.00 6.87 N ATOM 0 H GLN A 153 10.456 16.695 -24.061 1.00 5.21 H new ATOM 0 HA GLN A 153 12.826 18.031 -23.263 1.00 5.48 H new ATOM 0 HB2 GLN A 153 10.385 18.556 -24.763 1.00 5.94 H new ATOM 0 HB3 GLN A 153 10.774 19.919 -23.733 1.00 5.94 H new ATOM 0 HG2 GLN A 153 13.234 19.205 -24.875 1.00 6.26 H new ATOM 0 HG3 GLN A 153 12.081 18.994 -26.178 1.00 6.26 H new ATOM 0 HE21 GLN A 153 10.349 20.883 -26.244 1.00 6.87 H new ATOM 0 HE22 GLN A 153 11.049 22.503 -26.174 1.00 6.87 H new ATOM 2231 N CYS A 154 10.150 18.464 -21.375 1.00 5.21 N ATOM 2232 CA CYS A 154 9.707 18.915 -20.062 1.00 5.12 C ATOM 2233 C CYS A 154 10.406 18.126 -18.961 1.00 4.74 C ATOM 2234 O CYS A 154 10.856 18.693 -17.966 1.00 4.73 O ATOM 2235 CB CYS A 154 8.191 18.763 -19.932 1.00 5.16 C ATOM 2236 SG CYS A 154 7.473 19.698 -18.561 1.00 5.32 S ATOM 0 H CYS A 154 9.418 18.041 -21.946 1.00 5.21 H new ATOM 0 HA CYS A 154 9.967 19.968 -19.956 1.00 5.12 H new ATOM 0 HB2 CYS A 154 7.723 19.085 -20.862 1.00 5.16 H new ATOM 0 HB3 CYS A 154 7.952 17.707 -19.803 1.00 5.16 H new ATOM 0 HG CYS A 154 7.650 19.045 -17.451 1.00 5.32 H new ATOM 2242 N LEU A 155 10.498 16.813 -19.152 1.00 4.46 N ATOM 2243 CA LEU A 155 11.148 15.946 -18.178 1.00 4.15 C ATOM 2244 C LEU A 155 12.608 16.349 -17.991 1.00 4.23 C ATOM 2245 O LEU A 155 13.144 16.280 -16.885 1.00 4.14 O ATOM 2246 CB LEU A 155 11.058 14.483 -18.623 1.00 3.89 C ATOM 2247 CG LEU A 155 10.272 13.570 -17.680 1.00 3.84 C ATOM 2248 CD1 LEU A 155 10.821 13.663 -16.266 1.00 4.02 C ATOM 2249 CD2 LEU A 155 8.793 13.924 -17.705 1.00 4.09 C ATOM 0 H LEU A 155 10.131 16.328 -19.971 1.00 4.46 H new ATOM 0 HA LEU A 155 10.633 16.055 -17.224 1.00 4.15 H new ATOM 0 HB2 LEU A 155 10.596 14.446 -19.610 1.00 3.89 H new ATOM 0 HB3 LEU A 155 12.068 14.088 -18.729 1.00 3.89 H new ATOM 0 HG LEU A 155 10.384 12.542 -18.024 1.00 3.84 H new ATOM 0 HD11 LEU A 155 10.249 13.007 -15.610 1.00 4.02 H new ATOM 0 HD12 LEU A 155 11.868 13.359 -16.261 1.00 4.02 H new ATOM 0 HD13 LEU A 155 10.740 14.691 -15.911 1.00 4.02 H new ATOM 0 HD21 LEU A 155 8.250 13.264 -17.028 1.00 4.09 H new ATOM 0 HD22 LEU A 155 8.661 14.958 -17.387 1.00 4.09 H new ATOM 0 HD23 LEU A 155 8.407 13.803 -18.717 1.00 4.09 H new ATOM 2261 N GLU A 156 13.241 16.778 -19.079 1.00 4.48 N ATOM 2262 CA GLU A 156 14.636 17.201 -19.034 1.00 4.66 C ATOM 2263 C GLU A 156 14.818 18.335 -18.032 1.00 4.78 C ATOM 2264 O GLU A 156 15.760 18.335 -17.238 1.00 4.77 O ATOM 2265 CB GLU A 156 15.102 17.647 -20.422 1.00 5.01 C ATOM 2266 CG GLU A 156 16.475 17.118 -20.802 1.00 5.23 C ATOM 2267 CD GLU A 156 16.818 17.382 -22.255 1.00 5.36 C ATOM 2268 OE1 GLU A 156 15.980 17.076 -23.128 1.00 5.48 O ATOM 2269 OE2 GLU A 156 17.928 17.893 -22.519 1.00 5.72 O ATOM 0 H GLU A 156 12.810 16.842 -20.001 1.00 4.48 H new ATOM 0 HA GLU A 156 15.242 16.353 -18.715 1.00 4.66 H new ATOM 0 HB2 GLU A 156 14.376 17.315 -21.164 1.00 5.01 H new ATOM 0 HB3 GLU A 156 15.119 18.736 -20.458 1.00 5.01 H new ATOM 0 HG2 GLU A 156 17.228 17.581 -20.164 1.00 5.23 H new ATOM 0 HG3 GLU A 156 16.513 16.045 -20.612 1.00 5.23 H new ATOM 2276 N GLN A 157 13.901 19.297 -18.068 1.00 4.94 N ATOM 2277 CA GLN A 157 13.949 20.436 -17.159 1.00 5.11 C ATOM 2278 C GLN A 157 13.259 20.101 -15.838 1.00 4.89 C ATOM 2279 O GLN A 157 13.557 20.700 -14.805 1.00 4.95 O ATOM 2280 CB GLN A 157 13.284 21.655 -17.800 1.00 5.48 C ATOM 2281 CG GLN A 157 14.206 22.435 -18.724 1.00 5.85 C ATOM 2282 CD GLN A 157 13.480 23.527 -19.484 1.00 6.29 C ATOM 2283 OE1 GLN A 157 12.258 23.495 -19.625 1.00 6.40 O ATOM 2284 NE2 GLN A 157 14.232 24.503 -19.981 1.00 6.84 N ATOM 0 H GLN A 157 13.115 19.310 -18.718 1.00 4.94 H new ATOM 0 HA GLN A 157 14.995 20.667 -16.957 1.00 5.11 H new ATOM 0 HB2 GLN A 157 12.410 21.328 -18.364 1.00 5.48 H new ATOM 0 HB3 GLN A 157 12.925 22.319 -17.013 1.00 5.48 H new ATOM 0 HG2 GLN A 157 15.011 22.879 -18.138 1.00 5.85 H new ATOM 0 HG3 GLN A 157 14.669 21.749 -19.434 1.00 5.85 H new ATOM 0 HE21 GLN A 157 15.242 24.490 -19.841 1.00 6.84 H new ATOM 0 HE22 GLN A 157 13.799 25.265 -20.503 1.00 6.84 H new ATOM 2293 N ASN A 158 12.338 19.137 -15.883 1.00 4.71 N ATOM 2294 CA ASN A 158 11.593 18.705 -14.698 1.00 4.60 C ATOM 2295 C ASN A 158 11.122 19.898 -13.860 1.00 4.82 C ATOM 2296 O ASN A 158 10.037 20.432 -14.091 1.00 5.26 O ATOM 2297 CB ASN A 158 12.429 17.740 -13.842 1.00 4.42 C ATOM 2298 CG ASN A 158 13.922 18.008 -13.923 1.00 4.67 C ATOM 2299 OD1 ASN A 158 14.524 18.520 -12.979 1.00 4.86 O ATOM 2300 ND2 ASN A 158 14.524 17.664 -15.055 1.00 4.80 N ATOM 0 H ASN A 158 12.088 18.636 -16.736 1.00 4.71 H new ATOM 0 HA ASN A 158 10.707 18.175 -15.049 1.00 4.60 H new ATOM 0 HB2 ASN A 158 12.109 17.816 -12.803 1.00 4.42 H new ATOM 0 HB3 ASN A 158 12.232 16.717 -14.162 1.00 4.42 H new ATOM 0 HD21 ASN A 158 15.525 17.821 -15.168 1.00 4.80 H new ATOM 0 HD22 ASN A 158 13.985 17.242 -15.811 1.00 4.80 H new ATOM 2307 N LYS A 159 11.935 20.310 -12.890 1.00 4.81 N ATOM 2308 CA LYS A 159 11.584 21.434 -12.030 1.00 5.18 C ATOM 2309 C LYS A 159 12.301 22.704 -12.474 1.00 5.20 C ATOM 2310 O LYS A 159 13.526 22.799 -12.393 1.00 5.14 O ATOM 2311 CB LYS A 159 11.934 21.119 -10.575 1.00 5.63 C ATOM 2312 CG LYS A 159 11.501 22.200 -9.599 1.00 6.17 C ATOM 2313 CD LYS A 159 11.514 21.692 -8.166 1.00 6.76 C ATOM 2314 CE LYS A 159 10.342 22.242 -7.369 1.00 7.61 C ATOM 2315 NZ LYS A 159 10.374 23.728 -7.288 1.00 8.06 N ATOM 0 H LYS A 159 12.838 19.883 -12.681 1.00 4.81 H new ATOM 0 HA LYS A 159 10.509 21.598 -12.110 1.00 5.18 H new ATOM 0 HB2 LYS A 159 11.465 20.177 -10.293 1.00 5.63 H new ATOM 0 HB3 LYS A 159 13.011 20.976 -10.492 1.00 5.63 H new ATOM 0 HG2 LYS A 159 12.165 23.060 -9.688 1.00 6.17 H new ATOM 0 HG3 LYS A 159 10.499 22.544 -9.856 1.00 6.17 H new ATOM 0 HD2 LYS A 159 11.477 20.603 -8.165 1.00 6.76 H new ATOM 0 HD3 LYS A 159 12.449 21.980 -7.685 1.00 6.76 H new ATOM 0 HE2 LYS A 159 9.408 21.924 -7.831 1.00 7.61 H new ATOM 0 HE3 LYS A 159 10.359 21.823 -6.363 1.00 7.61 H new ATOM 0 HZ1 LYS A 159 9.629 24.056 -6.640 1.00 8.06 H new ATOM 0 HZ2 LYS A 159 11.302 24.036 -6.934 1.00 8.06 H new ATOM 0 HZ3 LYS A 159 10.213 24.131 -8.233 1.00 8.06 H new ATOM 2329 N VAL A 160 11.531 23.679 -12.944 1.00 5.67 N ATOM 2330 CA VAL A 160 12.092 24.945 -13.398 1.00 6.09 C ATOM 2331 C VAL A 160 12.696 25.724 -12.236 1.00 6.33 C ATOM 2332 O VAL A 160 12.091 25.837 -11.170 1.00 6.48 O ATOM 2333 CB VAL A 160 11.027 25.818 -14.089 1.00 6.78 C ATOM 2334 CG1 VAL A 160 10.706 25.275 -15.473 1.00 7.04 C ATOM 2335 CG2 VAL A 160 9.771 25.902 -13.235 1.00 7.19 C ATOM 0 H VAL A 160 10.516 23.616 -13.020 1.00 5.67 H new ATOM 0 HA VAL A 160 12.874 24.704 -14.118 1.00 6.09 H new ATOM 0 HB VAL A 160 11.428 26.825 -14.205 1.00 6.78 H new ATOM 0 HG11 VAL A 160 9.952 25.905 -15.945 1.00 7.04 H new ATOM 0 HG12 VAL A 160 11.610 25.273 -16.082 1.00 7.04 H new ATOM 0 HG13 VAL A 160 10.326 24.257 -15.385 1.00 7.04 H new ATOM 0 HG21 VAL A 160 9.030 26.522 -13.738 1.00 7.19 H new ATOM 0 HG22 VAL A 160 9.365 24.901 -13.085 1.00 7.19 H new ATOM 0 HG23 VAL A 160 10.017 26.342 -12.269 1.00 7.19 H new ATOM 2345 N ASP A 161 13.895 26.258 -12.447 1.00 6.64 N ATOM 2346 CA ASP A 161 14.582 27.025 -11.415 1.00 7.11 C ATOM 2347 C ASP A 161 13.729 28.200 -10.947 1.00 7.63 C ATOM 2348 O ASP A 161 13.686 28.514 -9.758 1.00 8.06 O ATOM 2349 CB ASP A 161 15.927 27.534 -11.939 1.00 7.35 C ATOM 2350 CG ASP A 161 17.054 26.551 -11.691 1.00 7.50 C ATOM 2351 OD1 ASP A 161 16.899 25.680 -10.809 1.00 7.58 O ATOM 2352 OD2 ASP A 161 18.092 26.651 -12.379 1.00 7.84 O ATOM 0 H ASP A 161 14.410 26.173 -13.323 1.00 6.64 H new ATOM 0 HA ASP A 161 14.755 26.365 -10.565 1.00 7.11 H new ATOM 0 HB2 ASP A 161 15.847 27.728 -13.009 1.00 7.35 H new ATOM 0 HB3 ASP A 161 16.165 28.484 -11.459 1.00 7.35 H new ATOM 2357 N ARG A 162 13.051 28.845 -11.891 1.00 7.84 N ATOM 2358 CA ARG A 162 12.197 29.986 -11.576 1.00 8.48 C ATOM 2359 C ARG A 162 12.990 31.077 -10.862 1.00 8.96 C ATOM 2360 O ARG A 162 13.238 30.991 -9.659 1.00 9.35 O ATOM 2361 CB ARG A 162 11.018 29.543 -10.708 1.00 8.74 C ATOM 2362 CG ARG A 162 9.760 29.231 -11.503 1.00 8.83 C ATOM 2363 CD ARG A 162 8.565 30.022 -10.995 1.00 9.34 C ATOM 2364 NE ARG A 162 8.602 31.414 -11.437 1.00 9.75 N ATOM 2365 CZ ARG A 162 7.638 32.298 -11.186 1.00 10.28 C ATOM 2366 NH1 ARG A 162 6.561 31.938 -10.499 1.00 10.45 N ATOM 2367 NH2 ARG A 162 7.751 33.544 -11.625 1.00 10.85 N ATOM 0 H ARG A 162 13.076 28.598 -12.880 1.00 7.84 H new ATOM 0 HA ARG A 162 11.815 30.393 -12.512 1.00 8.48 H new ATOM 0 HB2 ARG A 162 11.308 28.659 -10.140 1.00 8.74 H new ATOM 0 HB3 ARG A 162 10.795 30.327 -9.985 1.00 8.74 H new ATOM 0 HG2 ARG A 162 9.928 29.460 -12.555 1.00 8.83 H new ATOM 0 HG3 ARG A 162 9.544 28.164 -11.440 1.00 8.83 H new ATOM 0 HD2 ARG A 162 7.645 29.555 -11.346 1.00 9.34 H new ATOM 0 HD3 ARG A 162 8.544 29.988 -9.906 1.00 9.34 H new ATOM 0 HE ARG A 162 9.414 31.727 -11.969 1.00 9.75 H new ATOM 0 HH11 ARG A 162 6.469 30.980 -10.160 1.00 10.45 H new ATOM 0 HH12 ARG A 162 5.826 32.619 -10.310 1.00 10.45 H new ATOM 0 HH21 ARG A 162 8.576 33.825 -12.155 1.00 10.85 H new ATOM 0 HH22 ARG A 162 7.013 34.221 -11.433 1.00 10.85 H new ATOM 2381 N ILE A 163 13.386 32.101 -11.612 1.00 9.16 N ATOM 2382 CA ILE A 163 14.152 33.206 -11.049 1.00 9.85 C ATOM 2383 C ILE A 163 13.253 34.149 -10.257 1.00 10.22 C ATOM 2384 O ILE A 163 12.433 34.867 -10.829 1.00 10.21 O ATOM 2385 CB ILE A 163 14.875 34.007 -12.148 1.00 10.26 C ATOM 2386 CG1 ILE A 163 15.580 33.061 -13.123 1.00 10.14 C ATOM 2387 CG2 ILE A 163 15.871 34.976 -11.529 1.00 10.77 C ATOM 2388 CD1 ILE A 163 16.565 32.127 -12.453 1.00 10.25 C ATOM 0 H ILE A 163 13.189 32.188 -12.609 1.00 9.16 H new ATOM 0 HA ILE A 163 14.895 32.768 -10.382 1.00 9.85 H new ATOM 0 HB ILE A 163 14.134 34.582 -12.703 1.00 10.26 H new ATOM 0 HG12 ILE A 163 14.831 32.469 -13.649 1.00 10.14 H new ATOM 0 HG13 ILE A 163 16.105 33.651 -13.874 1.00 10.14 H new ATOM 0 HG21 ILE A 163 16.374 35.535 -12.318 1.00 10.77 H new ATOM 0 HG22 ILE A 163 15.345 35.669 -10.873 1.00 10.77 H new ATOM 0 HG23 ILE A 163 16.609 34.420 -10.952 1.00 10.77 H new ATOM 0 HD11 ILE A 163 17.027 31.486 -13.204 1.00 10.25 H new ATOM 0 HD12 ILE A 163 17.336 32.711 -11.951 1.00 10.25 H new ATOM 0 HD13 ILE A 163 16.042 31.511 -11.722 1.00 10.25 H new ATOM 2400 N ARG A 164 13.413 34.142 -8.938 1.00 10.77 N ATOM 2401 CA ARG A 164 12.614 35.000 -8.067 1.00 11.36 C ATOM 2402 C ARG A 164 12.838 36.471 -8.399 1.00 12.02 C ATOM 2403 O ARG A 164 13.670 36.758 -9.285 1.00 12.31 O ATOM 2404 CB ARG A 164 12.948 34.742 -6.592 1.00 11.65 C ATOM 2405 CG ARG A 164 14.424 34.482 -6.319 1.00 11.97 C ATOM 2406 CD ARG A 164 15.314 35.527 -6.974 1.00 12.51 C ATOM 2407 NE ARG A 164 15.100 36.859 -6.414 1.00 13.02 N ATOM 2408 CZ ARG A 164 15.582 37.255 -5.239 1.00 13.57 C ATOM 2409 NH1 ARG A 164 16.305 36.425 -4.497 1.00 13.69 N ATOM 2410 NH2 ARG A 164 15.341 38.484 -4.803 1.00 14.17 N ATOM 2411 OXT ARG A 164 12.175 37.325 -7.773 1.00 12.40 O ATOM 0 H ARG A 164 14.087 33.553 -8.448 1.00 10.77 H new ATOM 0 HA ARG A 164 11.565 34.759 -8.237 1.00 11.36 H new ATOM 0 HB2 ARG A 164 12.628 35.602 -6.003 1.00 11.65 H new ATOM 0 HB3 ARG A 164 12.370 33.885 -6.245 1.00 11.65 H new ATOM 0 HG2 ARG A 164 14.599 34.479 -5.243 1.00 11.97 H new ATOM 0 HG3 ARG A 164 14.693 33.493 -6.689 1.00 11.97 H new ATOM 0 HD2 ARG A 164 16.359 35.244 -6.847 1.00 12.51 H new ATOM 0 HD3 ARG A 164 15.118 35.549 -8.046 1.00 12.51 H new ATOM 0 HE ARG A 164 14.549 37.525 -6.956 1.00 13.02 H new ATOM 0 HH11 ARG A 164 16.493 35.478 -4.827 1.00 13.69 H new ATOM 0 HH12 ARG A 164 16.672 36.734 -3.597 1.00 13.69 H new ATOM 0 HH21 ARG A 164 14.786 39.126 -5.369 1.00 14.17 H new ATOM 0 HH22 ARG A 164 15.711 38.787 -3.902 1.00 14.17 H new TER 2425 ARG A 164 ATOM 2426 N SER B 165 -15.780 -24.112 -17.497 1.00 10.80 N ATOM 2427 CA SER B 165 -15.838 -22.957 -18.431 1.00 10.56 C ATOM 2428 C SER B 165 -14.551 -22.142 -18.382 1.00 9.75 C ATOM 2429 O SER B 165 -13.742 -22.190 -19.308 1.00 9.69 O ATOM 2430 CB SER B 165 -17.032 -22.081 -18.050 1.00 10.96 C ATOM 2431 OG SER B 165 -18.200 -22.473 -18.752 1.00 11.45 O ATOM 0 HA SER B 165 -15.953 -23.327 -19.450 1.00 10.56 H new ATOM 0 HB2 SER B 165 -17.209 -22.150 -16.977 1.00 10.96 H new ATOM 0 HB3 SER B 165 -16.806 -21.038 -18.269 1.00 10.96 H new ATOM 0 HG SER B 165 -18.949 -21.898 -18.488 1.00 11.45 H new ATOM 2439 N LEU B 166 -14.369 -21.397 -17.292 1.00 9.32 N ATOM 2440 CA LEU B 166 -13.182 -20.561 -17.102 1.00 8.66 C ATOM 2441 C LEU B 166 -12.829 -19.784 -18.371 1.00 8.02 C ATOM 2442 O LEU B 166 -13.576 -19.800 -19.351 1.00 8.16 O ATOM 2443 CB LEU B 166 -11.983 -21.407 -16.639 1.00 8.69 C ATOM 2444 CG LEU B 166 -11.718 -22.693 -17.431 1.00 8.92 C ATOM 2445 CD1 LEU B 166 -11.060 -22.382 -18.768 1.00 9.62 C ATOM 2446 CD2 LEU B 166 -10.845 -23.638 -16.617 1.00 8.63 C ATOM 0 H LEU B 166 -15.035 -21.355 -16.520 1.00 9.32 H new ATOM 0 HA LEU B 166 -13.418 -19.836 -16.323 1.00 8.66 H new ATOM 0 HB2 LEU B 166 -11.088 -20.786 -16.683 1.00 8.69 H new ATOM 0 HB3 LEU B 166 -12.135 -21.674 -15.593 1.00 8.69 H new ATOM 0 HG LEU B 166 -12.674 -23.178 -17.629 1.00 8.92 H new ATOM 0 HD11 LEU B 166 -10.882 -23.310 -19.311 1.00 9.62 H new ATOM 0 HD12 LEU B 166 -11.715 -21.738 -19.355 1.00 9.62 H new ATOM 0 HD13 LEU B 166 -10.111 -21.874 -18.597 1.00 9.62 H new ATOM 0 HD21 LEU B 166 -10.663 -24.548 -17.188 1.00 8.63 H new ATOM 0 HD22 LEU B 166 -9.895 -23.154 -16.393 1.00 8.63 H new ATOM 0 HD23 LEU B 166 -11.352 -23.890 -15.685 1.00 8.63 H new ATOM 2458 N GLU B 167 -11.694 -19.094 -18.344 1.00 7.59 N ATOM 2459 CA GLU B 167 -11.249 -18.307 -19.489 1.00 7.22 C ATOM 2460 C GLU B 167 -9.733 -18.145 -19.481 1.00 6.41 C ATOM 2461 O GLU B 167 -9.211 -17.076 -19.798 1.00 6.27 O ATOM 2462 CB GLU B 167 -11.922 -16.934 -19.483 1.00 7.60 C ATOM 2463 CG GLU B 167 -11.914 -16.246 -20.839 1.00 8.33 C ATOM 2464 CD GLU B 167 -12.947 -16.819 -21.789 1.00 8.77 C ATOM 2465 OE1 GLU B 167 -14.145 -16.503 -21.625 1.00 9.22 O ATOM 2466 OE2 GLU B 167 -12.559 -17.583 -22.697 1.00 8.92 O ATOM 0 H GLU B 167 -11.065 -19.064 -17.542 1.00 7.59 H new ATOM 0 HA GLU B 167 -11.534 -18.838 -20.397 1.00 7.22 H new ATOM 0 HB2 GLU B 167 -12.953 -17.046 -19.148 1.00 7.60 H new ATOM 0 HB3 GLU B 167 -11.418 -16.295 -18.758 1.00 7.60 H new ATOM 0 HG2 GLU B 167 -12.102 -15.181 -20.703 1.00 8.33 H new ATOM 0 HG3 GLU B 167 -10.924 -16.341 -21.285 1.00 8.33 H new ATOM 2473 N VAL B 168 -9.030 -19.213 -19.118 1.00 6.16 N ATOM 2474 CA VAL B 168 -7.573 -19.190 -19.069 1.00 5.66 C ATOM 2475 C VAL B 168 -6.984 -18.812 -20.424 1.00 5.09 C ATOM 2476 O VAL B 168 -7.327 -19.400 -21.448 1.00 5.18 O ATOM 2477 CB VAL B 168 -7.003 -20.554 -18.639 1.00 6.03 C ATOM 2478 CG1 VAL B 168 -5.503 -20.455 -18.403 1.00 5.94 C ATOM 2479 CG2 VAL B 168 -7.714 -21.060 -17.393 1.00 6.56 C ATOM 0 H VAL B 168 -9.446 -20.106 -18.853 1.00 6.16 H new ATOM 0 HA VAL B 168 -7.294 -18.439 -18.330 1.00 5.66 H new ATOM 0 HB VAL B 168 -7.174 -21.270 -19.443 1.00 6.03 H new ATOM 0 HG11 VAL B 168 -5.117 -21.428 -18.100 1.00 5.94 H new ATOM 0 HG12 VAL B 168 -5.010 -20.140 -19.323 1.00 5.94 H new ATOM 0 HG13 VAL B 168 -5.306 -19.726 -17.617 1.00 5.94 H new ATOM 0 HG21 VAL B 168 -7.298 -22.025 -17.103 1.00 6.56 H new ATOM 0 HG22 VAL B 168 -7.576 -20.347 -16.580 1.00 6.56 H new ATOM 0 HG23 VAL B 168 -8.778 -21.171 -17.601 1.00 6.56 H new HETATM 2489 N TPO B 169 -6.093 -17.826 -20.419 1.00 4.74 N HETATM 2490 CA TPO B 169 -5.454 -17.369 -21.647 1.00 4.22 C HETATM 2491 CB TPO B 169 -4.492 -16.189 -21.381 1.00 3.99 C HETATM 2492 CG2 TPO B 169 -3.812 -15.741 -22.668 1.00 3.52 C HETATM 2493 OG1 TPO B 169 -5.196 -15.107 -20.825 1.00 4.04 O HETATM 2494 P TPO B 169 -5.308 -14.987 -19.267 1.00 4.32 P HETATM 2495 O1P TPO B 169 -6.763 -15.419 -18.946 1.00 4.54 O HETATM 2496 O2P TPO B 169 -4.330 -16.049 -18.699 1.00 4.60 O HETATM 2497 O3P TPO B 169 -4.998 -13.607 -18.771 1.00 4.88 O HETATM 2498 C TPO B 169 -4.682 -18.507 -22.310 1.00 4.23 C HETATM 2499 O TPO B 169 -3.788 -19.098 -21.705 1.00 4.61 O HETATM 0 HG23 TPO B 169 -3.241 -16.570 -23.086 1.00 3.52 H new HETATM 0 HG22 TPO B 169 -4.567 -15.422 -23.386 1.00 3.52 H new HETATM 0 HG21 TPO B 169 -3.140 -14.910 -22.454 1.00 3.52 H new HETATM 0 HB TPO B 169 -3.729 -16.528 -20.680 1.00 3.99 H new HETATM 0 HA TPO B 169 -6.247 -17.030 -22.314 1.00 4.22 H new HETATM 0 H TPO B 169 -5.878 -17.370 -19.532 1.00 4.74 H new ATOM 2506 N GLU B 170 -5.038 -18.810 -23.554 1.00 3.90 N ATOM 2507 CA GLU B 170 -4.382 -19.880 -24.300 1.00 4.00 C ATOM 2508 C GLU B 170 -2.873 -19.665 -24.355 1.00 4.03 C ATOM 2509 O GLU B 170 -2.383 -18.827 -25.112 1.00 3.93 O ATOM 2510 CB GLU B 170 -4.950 -19.962 -25.718 1.00 3.78 C ATOM 2511 CG GLU B 170 -5.070 -21.383 -26.244 1.00 4.30 C ATOM 2512 CD GLU B 170 -5.652 -21.439 -27.643 1.00 4.16 C ATOM 2513 OE1 GLU B 170 -6.297 -20.452 -28.058 1.00 4.33 O ATOM 2514 OE2 GLU B 170 -5.464 -22.468 -28.325 1.00 4.33 O ATOM 0 H GLU B 170 -5.777 -18.330 -24.068 1.00 3.90 H new ATOM 0 HA GLU B 170 -4.575 -20.819 -23.782 1.00 4.00 H new ATOM 0 HB2 GLU B 170 -5.934 -19.493 -25.734 1.00 3.78 H new ATOM 0 HB3 GLU B 170 -4.312 -19.387 -26.390 1.00 3.78 H new ATOM 0 HG2 GLU B 170 -4.085 -21.851 -26.245 1.00 4.30 H new ATOM 0 HG3 GLU B 170 -5.698 -21.964 -25.569 1.00 4.30 H new ATOM 2521 N ALA B 171 -2.140 -20.426 -23.548 1.00 4.33 N ATOM 2522 CA ALA B 171 -0.687 -20.319 -23.504 1.00 4.48 C ATOM 2523 C ALA B 171 -0.027 -21.627 -23.928 1.00 4.81 C ATOM 2524 O ALA B 171 -0.423 -22.706 -23.486 1.00 5.27 O ATOM 2525 CB ALA B 171 -0.229 -19.923 -22.108 1.00 4.74 C ATOM 0 H ALA B 171 -2.530 -21.124 -22.915 1.00 4.33 H new ATOM 0 HA ALA B 171 -0.383 -19.544 -24.208 1.00 4.48 H new ATOM 0 HB1 ALA B 171 0.858 -19.847 -22.090 1.00 4.74 H new ATOM 0 HB2 ALA B 171 -0.665 -18.960 -21.842 1.00 4.74 H new ATOM 0 HB3 ALA B 171 -0.552 -20.678 -21.391 1.00 4.74 H new ATOM 2531 N ASP B 172 0.981 -21.524 -24.789 1.00 4.81 N ATOM 2532 CA ASP B 172 1.696 -22.699 -25.272 1.00 5.16 C ATOM 2533 C ASP B 172 2.357 -23.447 -24.119 1.00 5.51 C ATOM 2534 O ASP B 172 2.505 -22.909 -23.021 1.00 5.51 O ATOM 2535 CB ASP B 172 2.752 -22.291 -26.301 1.00 5.12 C ATOM 2536 CG ASP B 172 2.138 -21.737 -27.571 1.00 4.67 C ATOM 2537 OD1 ASP B 172 0.943 -22.004 -27.819 1.00 4.47 O ATOM 2538 OD2 ASP B 172 2.852 -21.037 -28.320 1.00 4.87 O ATOM 0 H ASP B 172 1.320 -20.639 -25.166 1.00 4.81 H new ATOM 0 HA ASP B 172 0.973 -23.364 -25.745 1.00 5.16 H new ATOM 0 HB2 ASP B 172 3.412 -21.542 -25.863 1.00 5.12 H new ATOM 0 HB3 ASP B 172 3.369 -23.155 -26.546 1.00 5.12 H new ATOM 2543 N ALA B 173 2.750 -24.690 -24.374 1.00 5.88 N ATOM 2544 CA ALA B 173 3.395 -25.512 -23.357 1.00 6.30 C ATOM 2545 C ALA B 173 4.693 -26.118 -23.881 1.00 6.81 C ATOM 2546 O ALA B 173 4.937 -27.315 -23.735 1.00 7.08 O ATOM 2547 CB ALA B 173 2.450 -26.607 -22.887 1.00 6.49 C ATOM 0 H ALA B 173 2.633 -25.151 -25.277 1.00 5.88 H new ATOM 0 HA ALA B 173 3.641 -24.872 -22.510 1.00 6.30 H new ATOM 0 HB1 ALA B 173 2.944 -27.213 -22.128 1.00 6.49 H new ATOM 0 HB2 ALA B 173 1.553 -26.156 -22.464 1.00 6.49 H new ATOM 0 HB3 ALA B 173 2.175 -27.238 -23.732 1.00 6.49 H new ATOM 2553 N THR B 174 5.524 -25.279 -24.494 1.00 7.20 N ATOM 2554 CA THR B 174 6.799 -25.730 -25.041 1.00 7.90 C ATOM 2555 C THR B 174 7.958 -25.289 -24.152 1.00 8.46 C ATOM 2556 O THR B 174 8.955 -24.751 -24.635 1.00 8.87 O ATOM 2557 CB THR B 174 6.989 -25.188 -26.459 1.00 8.24 C ATOM 2558 OG1 THR B 174 7.164 -23.783 -26.438 1.00 8.55 O ATOM 2559 CG2 THR B 174 5.827 -25.493 -27.377 1.00 7.98 C ATOM 0 H THR B 174 5.337 -24.285 -24.624 1.00 7.20 H new ATOM 0 HA THR B 174 6.788 -26.819 -25.076 1.00 7.90 H new ATOM 0 HB THR B 174 7.876 -25.691 -26.845 1.00 8.24 H new ATOM 0 HG1 THR B 174 7.819 -23.545 -25.749 1.00 8.55 H new ATOM 0 HG21 THR B 174 6.027 -25.081 -28.366 1.00 7.98 H new ATOM 0 HG22 THR B 174 5.697 -26.573 -27.453 1.00 7.98 H new ATOM 0 HG23 THR B 174 4.918 -25.046 -26.974 1.00 7.98 H new ATOM 2567 N PHE B 175 7.821 -25.530 -22.848 1.00 8.71 N ATOM 2568 CA PHE B 175 8.845 -25.172 -21.877 1.00 9.41 C ATOM 2569 C PHE B 175 9.449 -23.798 -22.169 1.00 10.02 C ATOM 2570 O PHE B 175 10.664 -23.613 -22.103 1.00 10.37 O ATOM 2571 CB PHE B 175 9.928 -26.251 -21.848 1.00 9.53 C ATOM 2572 CG PHE B 175 10.969 -26.137 -22.982 1.00 10.03 C ATOM 2573 CD1 PHE B 175 12.356 -25.819 -22.988 1.00 10.51 C ATOM 2574 CD2 PHE B 175 11.725 -27.211 -23.402 1.00 10.25 C ATOM 2575 CE1 PHE B 175 11.821 -27.095 -22.869 1.00 11.17 C ATOM 2576 CE2 PHE B 175 12.282 -26.086 -24.008 1.00 10.95 C ATOM 2577 CZ PHE B 175 10.953 -26.335 -23.622 1.00 11.38 C ATOM 0 H PHE B 175 7.000 -25.977 -22.440 1.00 8.71 H new ATOM 0 HA PHE B 175 8.377 -25.110 -20.895 1.00 9.41 H new ATOM 0 HB2 PHE B 175 10.445 -26.204 -20.890 1.00 9.53 H new ATOM 0 HB3 PHE B 175 9.451 -27.229 -21.905 1.00 9.53 H new ATOM 0 HD1 PHE B 175 13.182 -25.125 -23.043 1.00 10.51 H new ATOM 0 HD2 PHE B 175 11.825 -28.283 -23.314 1.00 10.25 H new ATOM 0 HE1 PHE B 175 11.984 -28.076 -22.447 1.00 11.17 H new ATOM 0 HE2 PHE B 175 13.084 -25.499 -24.431 1.00 10.95 H new ATOM 0 HZ PHE B 175 9.917 -26.089 -23.801 1.00 11.38 H new ATOM 2587 N VAL B 176 8.583 -22.839 -22.487 1.00 10.36 N ATOM 2588 CA VAL B 176 9.005 -21.471 -22.789 1.00 11.15 C ATOM 2589 C VAL B 176 10.273 -21.443 -23.641 1.00 11.66 C ATOM 2590 O VAL B 176 11.365 -21.177 -23.139 1.00 11.78 O ATOM 2591 CB VAL B 176 9.243 -20.651 -21.503 1.00 11.50 C ATOM 2592 CG1 VAL B 176 7.918 -20.269 -20.862 1.00 11.95 C ATOM 2593 CG2 VAL B 176 10.113 -21.423 -20.522 1.00 11.46 C ATOM 0 H VAL B 176 7.575 -22.985 -22.543 1.00 10.36 H new ATOM 0 HA VAL B 176 8.190 -21.019 -23.354 1.00 11.15 H new ATOM 0 HB VAL B 176 9.770 -19.736 -21.774 1.00 11.50 H new ATOM 0 HG11 VAL B 176 8.105 -19.691 -19.957 1.00 11.95 H new ATOM 0 HG12 VAL B 176 7.335 -19.669 -21.561 1.00 11.95 H new ATOM 0 HG13 VAL B 176 7.363 -21.172 -20.608 1.00 11.95 H new ATOM 0 HG21 VAL B 176 10.267 -20.825 -19.624 1.00 11.46 H new ATOM 0 HG22 VAL B 176 9.620 -22.358 -20.256 1.00 11.46 H new ATOM 0 HG23 VAL B 176 11.077 -21.640 -20.983 1.00 11.46 H new ATOM 2603 N GLN B 177 10.118 -21.721 -24.931 1.00 12.15 N ATOM 2604 CA GLN B 177 11.249 -21.728 -25.853 1.00 12.86 C ATOM 2605 C GLN B 177 11.627 -20.308 -26.260 1.00 13.54 C ATOM 2606 O GLN B 177 10.725 -19.554 -26.681 1.00 13.74 O ATOM 2607 CB GLN B 177 10.916 -22.557 -27.095 1.00 13.18 C ATOM 2608 CG GLN B 177 11.125 -24.050 -26.903 1.00 13.25 C ATOM 2609 CD GLN B 177 10.434 -24.877 -27.970 1.00 13.63 C ATOM 2610 OE1 GLN B 177 9.979 -24.347 -28.984 1.00 13.83 O ATOM 2611 NE2 GLN B 177 10.350 -26.182 -27.745 1.00 13.89 N ATOM 2612 OXT GLN B 177 12.822 -19.962 -26.155 1.00 14.01 O ATOM 0 H GLN B 177 9.221 -21.944 -25.362 1.00 12.15 H new ATOM 0 HA GLN B 177 12.100 -22.178 -25.342 1.00 12.86 H new ATOM 0 HB2 GLN B 177 9.878 -22.377 -27.374 1.00 13.18 H new ATOM 0 HB3 GLN B 177 11.534 -22.216 -27.926 1.00 13.18 H new ATOM 0 HG2 GLN B 177 12.193 -24.268 -26.914 1.00 13.25 H new ATOM 0 HG3 GLN B 177 10.750 -24.343 -25.922 1.00 13.25 H new ATOM 0 HE21 GLN B 177 10.741 -26.578 -26.891 1.00 13.89 H new ATOM 0 HE22 GLN B 177 9.894 -26.789 -28.427 1.00 13.89 H new TER 2621 GLN B 177 CONECT 2475 2489 CONECT 2489 2475 2490 2500 CONECT 2490 2489 2491 2498 2501 CONECT 2491 2490 2492 2493 2502 CONECT 2492 2491 2503 2504 2505 CONECT 2493 2491 2494 CONECT 2494 2493 2495 2496 2497 CONECT 2495 2494 CONECT 2496 2494 CONECT 2497 2494 CONECT 2498 2490 2499 2506 CONECT 2499 2498 CONECT 2500 2489 CONECT 2501 2490 CONECT 2502 2491 CONECT 2503 2492 CONECT 2504 2492 CONECT 2505 2492 CONECT 2506 2498 END