USER MOD reduce.3.24.130724 H: found=0, std=0, add=1291, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1290 hydrogens (24 hets) HEADER OXIDO-REDUCTASE 01-AUG-95 1DIS TITLE DIHYDROFOLATE REDUCTASE (E.C.1.5.1.3) COMPLEX WITH TITLE 2 BRODIMOPRIM-4,6-DICARBOXYLATE COMPND MOL_ID: 1; COMPND 2 MOLECULE: DIHYDROFOLATE REDUCTASE; COMPND 3 CHAIN: A; COMPND 4 EC: 1.5.1.3; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS CASEI; SOURCE 3 ORGANISM_TAXID: 1582; SOURCE 4 STRAIN: METHOTREXATE-RESISTANT; SOURCE 5 GENE: POTENTIAL; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS INHIBITOR/ENZYME COMPLEX, OXIDO-REDUCTASE EXPDTA SOLUTION NMR AUTHOR W.D.MORGAN,B.BIRDSALL,V.I.POLSHAKOV,D.SALI,I.KOMPIS,J.FEENEY REVDAT 2 24-FEB-09 1DIS 1 VERSN REVDAT 1 14-NOV-95 1DIS 0 JRNL AUTH W.D.MORGAN,B.BIRDSALL,V.I.POLSHAKOV,D.SALI, JRNL AUTH 2 I.KOMPIS,J.FEENEY JRNL TITL SOLUTION STRUCTURE OF A BRODIMOPRIM ANALOGUE IN JRNL TITL 2 ITS COMPLEX WITH LACTOBACILLUS CASEI DIHYDROFOLATE JRNL TITL 3 REDUCTASE. JRNL REF BIOCHEMISTRY V. 34 11690 1995 JRNL REFN ISSN 0006-2960 JRNL PMID 7547901 JRNL DOI 10.1021/BI00037A006 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH G.MARTORELL,M.J.GRADWELL,B.BIRDSALL,C.J.BAUER, REMARK 1 AUTH 2 T.A.FRENKIEL,H.T.A.CHEUNG,V.I.POLSHAKOV,L.KUYPER, REMARK 1 AUTH 3 J.FEENEY REMARK 1 TITL SOLUTION STRUCTURE OF BOUND TRIMETHOPRIM IN ITS REMARK 1 TITL 2 COMPLEX WITH LACTOBACILLUS CASEI DIHYDROFOLATE REMARK 1 TITL 3 REDUCTASE REMARK 1 REF BIOCHEMISTRY V. 33 12416 1994 REMARK 1 REFN ISSN 0006-2960 REMARK 1 REFERENCE 2 REMARK 1 AUTH B.BIRDSALL,J.FEENEY,C.PASCUAL,G.C.K.ROBERTS, REMARK 1 AUTH 2 I.KOMPIS,R.L.THEN,K.MUELLER,A.KROEHN REMARK 1 TITL A 1H NMR STUDY OF THE INTERACTIONS AND REMARK 1 TITL 2 CONFORMATIONS OF RATIONALLY DESIGNED BRODIMOPRIM REMARK 1 TITL 3 ANALOGUES IN COMPLEXES WITH LACTOBACILLUS CASEI REMARK 1 TITL 4 DIHYDROFOLATE REDUCTASE REMARK 1 REF J.MED.CHEM. V. 27 1672 1984 REMARK 1 REFN ISSN 0022-2623 REMARK 1 REFERENCE 3 REMARK 1 AUTH J.T.BOLIN,D.J.FILMAN,D.A.MATTHEWS,R.C.HAMLIN, REMARK 1 AUTH 2 J.KRAUT REMARK 1 TITL CRYSTAL STRUCTURES OF ESCHERICHIA COLI AND REMARK 1 TITL 2 LACTOBACILLUS CASEI DIHYDROFOLATE REDUCTASE REMARK 1 TITL 3 REFINED AT 1.7 ANGSTROMS RESOLUTION. I. GENERAL REMARK 1 TITL 4 FEATURES AND BINDING OF METHOTREXATE REMARK 1 REF J.BIOL.CHEM. V. 257 13650 1982 REMARK 1 REFN ISSN 0021-9258 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : DISCOVER REMARK 3 AUTHORS : MOLECULAR SIMULATIONS INC. REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1DIS COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : NULL REMARK 210 PH : NULL REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : NULL REMARK 210 SPECTROMETER FIELD STRENGTH : NULL REMARK 210 SPECTROMETER MODEL : NULL REMARK 210 SPECTROMETER MANUFACTURER : NULL REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : NULL REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS 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,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) 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 RES CSSEQI ATM2 DEVIATION REMARK 500 HIS A 18 CG HIS A 18 CD2 0.056 REMARK 500 HIS A 22 CG HIS A 22 CD2 0.055 REMARK 500 HIS A 28 CG HIS A 28 CD2 0.056 REMARK 500 HIS A 64 CG HIS A 64 CD2 0.055 REMARK 500 HIS A 77 CG HIS A 77 CD2 0.056 REMARK 500 HIS A 89 CG HIS A 89 CD2 0.055 REMARK 500 REMARK 500 REMARK: NULL 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 ARG A 9 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES REMARK 500 HIS A 18 ND1 - CE1 - NE2 ANGL. DEV. = 7.9 DEGREES REMARK 500 HIS A 22 ND1 - CE1 - NE2 ANGL. DEV. = 8.0 DEGREES REMARK 500 HIS A 28 ND1 - CE1 - NE2 ANGL. DEV. = 8.0 DEGREES REMARK 500 ARG A 31 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES REMARK 500 ARG A 43 NE - CZ - NH1 ANGL. DEV. = 3.8 DEGREES REMARK 500 ARG A 44 NE - CZ - NH1 ANGL. DEV. = 3.9 DEGREES REMARK 500 ARG A 52 NE - CZ - NH1 ANGL. DEV. = 4.0 DEGREES REMARK 500 ARG A 57 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES REMARK 500 HIS A 64 ND1 - CE1 - NE2 ANGL. DEV. = 8.0 DEGREES REMARK 500 HIS A 77 ND1 - CE1 - NE2 ANGL. DEV. = 8.1 DEGREES REMARK 500 HIS A 89 ND1 - CE1 - NE2 ANGL. DEV. = 8.0 DEGREES REMARK 500 ARG A 117 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES REMARK 500 ARG A 142 NE - CZ - NH1 ANGL. DEV. = 3.8 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 GLU A 56 -0.71 73.75 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE BDM A 163 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1DIU RELATED DB: PDB DBREF 1DIS A 1 162 UNP P00381 DYR_LACCA 1 162 SEQRES 1 A 162 THR ALA PHE LEU TRP ALA GLN ASP ARG ASP GLY LEU ILE SEQRES 2 A 162 GLY LYS ASP GLY HIS LEU PRO TRP HIS LEU PRO ASP ASP SEQRES 3 A 162 LEU HIS TYR PHE ARG ALA GLN THR VAL GLY LYS ILE MET SEQRES 4 A 162 VAL VAL GLY ARG ARG THR TYR GLU SER PHE PRO LYS ARG SEQRES 5 A 162 PRO LEU PRO GLU ARG THR ASN VAL VAL LEU THR HIS GLN SEQRES 6 A 162 GLU ASP TYR GLN ALA GLN GLY ALA VAL VAL VAL HIS ASP SEQRES 7 A 162 VAL ALA ALA VAL PHE ALA TYR ALA LYS GLN HIS PRO ASP SEQRES 8 A 162 GLN GLU LEU VAL ILE ALA GLY GLY ALA GLN ILE PHE THR SEQRES 9 A 162 ALA PHE LYS ASP ASP VAL ASP THR LEU LEU VAL THR ARG SEQRES 10 A 162 LEU ALA GLY SER PHE GLU GLY ASP THR LYS MET ILE PRO SEQRES 11 A 162 LEU ASN TRP ASP ASP PHE THR LYS VAL SER SER ARG THR SEQRES 12 A 162 VAL GLU ASP THR ASN PRO ALA LEU THR HIS THR TYR GLU SEQRES 13 A 162 VAL TRP GLN LYS LYS ALA HET BDM A 163 55 HETNAM BDM BRODIMOPRIM-4,6-DICARBOXYLATE FORMUL 2 BDM C20 H24 BR N4 O6 1- HELIX 1 HB PRO A 24 GLN A 33 1 10 HELIX 2 HC ARG A 43 SER A 48 1 6 HELIX 3 HE VAL A 79 GLN A 88 1 10 HELIX 4 HF GLY A 99 PHE A 106 1 8 SHEET 1 S1 8 VAL A 74 VAL A 76 0 SHEET 2 S1 8 THR A 58 LEU A 62 1 N VAL A 61 O VAL A 74 SHEET 3 S1 8 ILE A 38 GLY A 42 1 N MET A 39 O THR A 58 SHEET 4 S1 8 LEU A 94 ILE A 96 1 N VAL A 95 O ILE A 38 SHEET 5 S1 8 THR A 1 GLN A 7 1 N ALA A 2 O LEU A 94 SHEET 6 S1 8 THR A 112 LEU A 118 1 N THR A 112 O THR A 1 SHEET 7 S1 8 HIS A 153 LYS A 160 -1 N TRP A 158 O LEU A 113 SHEET 8 S1 8 PHE A 136 VAL A 144 -1 N PHE A 136 O GLN A 159 CISPEP 1 ARG A 52 PRO A 53 0 -16.45 CISPEP 2 GLY A 98 GLY A 99 0 7.98 SITE *** AC1 14 LEU A 4 TRP A 5 ALA A 6 LEU A 19 SITE *** AC1 14 ASP A 26 LEU A 27 HIS A 28 PHE A 30 SITE *** AC1 14 ARG A 31 SER A 48 PHE A 49 PRO A 50 SITE *** AC1 14 ARG A 57 ALA A 97 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 153 HIS : +bothHN:sc= 0.432 K(o=1.2,f=-2) USER MOD Set 1.2: A 155 TYR OH : rot 165:sc= 0.743 USER MOD Set 2.1: A 143 THR OG1 : rot -72:sc= 0.255 USER MOD Set 2.2: A 154 THR OG1 : rot 180:sc= 0.24 USER MOD Set 3.1: A 58 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 92 GLN : amide:sc= 0.0873 X(o=0.087,f=-0.045) USER MOD Set 4.1: A 85 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 88 GLN : amide:sc= 0 X(o=0,f=0.046) USER MOD Set 4.3: A 89 HIS : no HD1:sc= 0 X(o=0,f=0.046) USER MOD Set 5.1: A 39 MET CE :methyl 167:sc= -0.0122 (180deg=-0.365) USER MOD Set 5.2: A 59 ASN : amide:sc= 0 K(o=-0.012,f=-2) USER MOD Single : A 1 THR N :NH3+ 179:sc= 0.0142 (180deg=0.0128) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 GLN : amide:sc= 0.221 K(o=0.22,f=-1.7!) USER MOD Single : A 15 LYS NZ :NH3+ 142:sc= 0.00506 (180deg=0) USER MOD Single : A 18 HIS : no HE2:sc= -0.0834 K(o=-0.083,f=-1.7) USER MOD Single : A 22 HIS : no HD1:sc=-8.3e-05 X(o=-8.3e-05,f=-0.0068) USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 34 THR OG1 : rot -48:sc= 0.926 USER MOD Single : A 37 LYS NZ :NH3+ 174:sc= 0.00527 (180deg=0.0028) USER MOD Single : A 45 THR OG1 : rot -150:sc= 0 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot -20:sc= 0.135 USER MOD Single : A 51 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.239) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 TYR OH : rot 150:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0.028 X(o=0.028,f=-0.0057) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HE2:sc= 0.19 K(o=0.19,f=-1.2) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 104 THR OG1 : rot 70:sc= 0.597 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 74:sc= 0.256 USER MOD Single : A 116 THR OG1 : rot 168:sc= 0.815 USER MOD Single : A 121 SER OG : rot 104:sc= 0.28 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 132 ASN : amide:sc= -0.0311 K(o=-0.031,f=-3!) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ -131:sc= 0.0108 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= -0.0558 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 ASN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0.143 USER MOD Single : A 159 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 161:sc= 0.0159 (180deg=0.000965) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -0.301 18.716 33.581 1.00 0.00 N ATOM 2 CA THR A 1 0.258 19.617 32.553 1.00 0.00 C ATOM 3 C THR A 1 -0.758 19.612 31.372 1.00 0.00 C ATOM 4 O THR A 1 -1.162 18.542 30.897 1.00 0.00 O ATOM 5 CB THR A 1 1.717 19.186 32.201 1.00 0.00 C ATOM 6 OG1 THR A 1 2.529 19.203 33.372 1.00 0.00 O ATOM 7 CG2 THR A 1 2.422 20.070 31.157 1.00 0.00 C ATOM 0 H1 THR A 1 0.349 18.668 34.391 1.00 0.00 H new ATOM 0 H2 THR A 1 -1.222 19.080 33.898 1.00 0.00 H new ATOM 0 H3 THR A 1 -0.424 17.765 33.179 1.00 0.00 H new ATOM 0 HA THR A 1 0.370 20.649 32.886 1.00 0.00 H new ATOM 0 HB THR A 1 1.609 18.189 31.775 1.00 0.00 H new ATOM 0 HG1 THR A 1 3.441 18.930 33.141 1.00 0.00 H new ATOM 0 HG21 THR A 1 3.428 19.691 30.979 1.00 0.00 H new ATOM 0 HG22 THR A 1 1.858 20.052 30.225 1.00 0.00 H new ATOM 0 HG23 THR A 1 2.480 21.094 31.527 1.00 0.00 H new ATOM 16 N ALA A 2 -1.071 20.830 30.879 1.00 0.00 N ATOM 17 CA ALA A 2 -1.888 21.020 29.650 1.00 0.00 C ATOM 18 C ALA A 2 -1.063 21.606 28.483 1.00 0.00 C ATOM 19 O ALA A 2 -0.180 22.428 28.738 1.00 0.00 O ATOM 20 CB ALA A 2 -3.046 21.960 29.993 1.00 0.00 C ATOM 0 H ALA A 2 -0.771 21.703 31.312 1.00 0.00 H new ATOM 0 HA ALA A 2 -2.254 20.048 29.319 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -3.662 22.117 29.108 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -3.652 21.517 30.783 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -2.650 22.917 30.333 1.00 0.00 H new ATOM 26 N PHE A 3 -1.383 21.235 27.215 1.00 0.00 N ATOM 27 CA PHE A 3 -0.948 22.001 26.018 1.00 0.00 C ATOM 28 C PHE A 3 -2.080 22.966 25.652 1.00 0.00 C ATOM 29 O PHE A 3 -3.202 22.544 25.365 1.00 0.00 O ATOM 30 CB PHE A 3 -0.625 21.052 24.818 1.00 0.00 C ATOM 31 CG PHE A 3 0.700 20.277 24.752 1.00 0.00 C ATOM 32 CD1 PHE A 3 1.661 20.283 25.770 1.00 0.00 C ATOM 33 CD2 PHE A 3 0.944 19.535 23.590 1.00 0.00 C ATOM 34 CE1 PHE A 3 2.856 19.593 25.614 1.00 0.00 C ATOM 35 CE2 PHE A 3 2.135 18.834 23.442 1.00 0.00 C ATOM 36 CZ PHE A 3 3.088 18.866 24.454 1.00 0.00 C ATOM 0 H PHE A 3 -1.941 20.410 26.996 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.032 22.548 26.241 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -1.427 20.316 24.769 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -0.688 21.653 23.911 1.00 0.00 H new ATOM 0 HD1 PHE A 3 1.472 20.828 26.683 1.00 0.00 H new ATOM 0 HD2 PHE A 3 0.203 19.507 22.805 1.00 0.00 H new ATOM 0 HE1 PHE A 3 3.603 19.622 26.393 1.00 0.00 H new ATOM 0 HE2 PHE A 3 2.320 18.265 22.543 1.00 0.00 H new ATOM 0 HZ PHE A 3 4.014 18.322 24.337 1.00 0.00 H new ATOM 46 N LEU A 4 -1.723 24.252 25.644 1.00 0.00 N ATOM 47 CA LEU A 4 -2.552 25.331 25.112 1.00 0.00 C ATOM 48 C LEU A 4 -2.140 25.626 23.661 1.00 0.00 C ATOM 49 O LEU A 4 -0.990 26.018 23.439 1.00 0.00 O ATOM 50 CB LEU A 4 -2.596 26.557 26.085 1.00 0.00 C ATOM 51 CG LEU A 4 -3.561 27.725 25.718 1.00 0.00 C ATOM 52 CD1 LEU A 4 -5.031 27.302 25.492 1.00 0.00 C ATOM 53 CD2 LEU A 4 -3.522 28.802 26.817 1.00 0.00 C ATOM 0 H LEU A 4 -0.830 24.577 26.015 1.00 0.00 H new ATOM 0 HA LEU A 4 -3.597 25.025 25.058 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -2.869 26.192 27.075 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -1.588 26.964 26.162 1.00 0.00 H new ATOM 0 HG LEU A 4 -3.197 28.108 24.765 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -5.628 28.179 25.242 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.081 26.583 24.674 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.422 26.845 26.401 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -4.199 29.615 26.554 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -3.832 28.365 27.766 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -2.508 29.190 26.910 1.00 0.00 H new ATOM 65 N TRP A 5 -3.085 25.454 22.686 1.00 0.00 N ATOM 66 CA TRP A 5 -2.853 25.821 21.252 1.00 0.00 C ATOM 67 C TRP A 5 -4.149 26.180 20.456 1.00 0.00 C ATOM 68 O TRP A 5 -5.266 25.883 20.897 1.00 0.00 O ATOM 69 CB TRP A 5 -1.877 24.822 20.550 1.00 0.00 C ATOM 70 CG TRP A 5 -2.460 23.589 19.868 1.00 0.00 C ATOM 71 CD1 TRP A 5 -2.664 23.450 18.483 1.00 0.00 C ATOM 72 CD2 TRP A 5 -2.775 22.371 20.420 1.00 0.00 C ATOM 73 NE1 TRP A 5 -3.092 22.158 18.151 1.00 0.00 N ATOM 74 CE2 TRP A 5 -3.135 21.498 19.365 1.00 0.00 C ATOM 75 CE3 TRP A 5 -2.734 21.907 21.757 1.00 0.00 C ATOM 76 CZ2 TRP A 5 -3.428 20.143 19.636 1.00 0.00 C ATOM 77 CZ3 TRP A 5 -3.046 20.572 22.002 1.00 0.00 C ATOM 78 CH2 TRP A 5 -3.379 19.699 20.957 1.00 0.00 C ATOM 0 H TRP A 5 -4.011 25.065 22.866 1.00 0.00 H new ATOM 0 HA TRP A 5 -2.328 26.776 21.254 1.00 0.00 H new ATOM 0 HB2 TRP A 5 -1.315 25.380 19.801 1.00 0.00 H new ATOM 0 HB3 TRP A 5 -1.160 24.480 21.297 1.00 0.00 H new ATOM 0 HD1 TRP A 5 -2.510 24.241 17.765 1.00 0.00 H new ATOM 0 HE1 TRP A 5 -3.319 21.790 17.227 1.00 0.00 H new ATOM 0 HE3 TRP A 5 -2.468 22.571 22.566 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 -3.685 19.464 18.836 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 -3.031 20.202 23.017 1.00 0.00 H new ATOM 0 HH2 TRP A 5 -3.601 18.666 21.179 1.00 0.00 H new ATOM 89 N ALA A 6 -3.941 26.773 19.248 1.00 0.00 N ATOM 90 CA ALA A 6 -4.967 26.899 18.193 1.00 0.00 C ATOM 91 C ALA A 6 -4.349 26.531 16.830 1.00 0.00 C ATOM 92 O ALA A 6 -3.252 26.996 16.491 1.00 0.00 O ATOM 93 CB ALA A 6 -5.423 28.352 18.171 1.00 0.00 C ATOM 0 H ALA A 6 -3.043 27.179 18.984 1.00 0.00 H new ATOM 0 HA ALA A 6 -5.808 26.234 18.388 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -6.183 28.483 17.401 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -5.841 28.617 19.142 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -4.572 28.997 17.954 1.00 0.00 H new ATOM 99 N GLN A 7 -5.080 25.698 16.068 1.00 0.00 N ATOM 100 CA GLN A 7 -4.642 25.165 14.743 1.00 0.00 C ATOM 101 C GLN A 7 -5.743 25.549 13.712 1.00 0.00 C ATOM 102 O GLN A 7 -6.907 25.748 14.073 1.00 0.00 O ATOM 103 CB GLN A 7 -4.279 23.635 14.841 1.00 0.00 C ATOM 104 CG GLN A 7 -5.402 22.653 15.280 1.00 0.00 C ATOM 105 CD GLN A 7 -5.002 21.164 15.302 1.00 0.00 C ATOM 106 OE1 GLN A 7 -3.836 20.787 15.427 1.00 0.00 O ATOM 107 NE2 GLN A 7 -5.976 20.273 15.201 1.00 0.00 N ATOM 0 H GLN A 7 -6.003 25.366 16.348 1.00 0.00 H new ATOM 0 HA GLN A 7 -3.710 25.610 14.396 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -3.915 23.313 13.865 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -3.450 23.531 15.541 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -5.741 22.936 16.277 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -6.252 22.774 14.608 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -6.942 20.583 15.097 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -5.760 19.276 15.227 1.00 0.00 H new ATOM 116 N ASP A 8 -5.376 25.551 12.418 1.00 0.00 N ATOM 117 CA ASP A 8 -6.328 25.339 11.301 1.00 0.00 C ATOM 118 C ASP A 8 -6.677 23.837 11.140 1.00 0.00 C ATOM 119 O ASP A 8 -6.103 22.966 11.812 1.00 0.00 O ATOM 120 CB ASP A 8 -5.795 26.099 10.054 1.00 0.00 C ATOM 121 CG ASP A 8 -4.749 25.466 9.120 1.00 0.00 C ATOM 122 OD1 ASP A 8 -4.478 24.249 9.186 1.00 0.00 O ATOM 123 OD2 ASP A 8 -4.175 26.212 8.303 1.00 0.00 O ATOM 0 H ASP A 8 -4.414 25.699 12.112 1.00 0.00 H new ATOM 0 HA ASP A 8 -7.308 25.774 11.498 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -6.660 26.348 9.440 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -5.375 27.040 10.410 1.00 0.00 H new ATOM 128 N ARG A 9 -7.620 23.562 10.224 1.00 0.00 N ATOM 129 CA ARG A 9 -7.992 22.180 9.823 1.00 0.00 C ATOM 130 C ARG A 9 -6.871 21.114 9.624 1.00 0.00 C ATOM 131 O ARG A 9 -7.013 19.983 10.099 1.00 0.00 O ATOM 132 CB ARG A 9 -9.052 22.229 8.710 1.00 0.00 C ATOM 133 CG ARG A 9 -8.550 22.369 7.261 1.00 0.00 C ATOM 134 CD ARG A 9 -9.719 22.435 6.255 1.00 0.00 C ATOM 135 NE ARG A 9 -9.246 22.406 4.849 1.00 0.00 N ATOM 136 CZ ARG A 9 -10.023 22.654 3.776 1.00 0.00 C ATOM 137 NH1 ARG A 9 -11.322 22.937 3.846 1.00 0.00 N ATOM 138 NH2 ARG A 9 -9.460 22.613 2.582 1.00 0.00 N ATOM 0 H ARG A 9 -8.150 24.285 9.737 1.00 0.00 H new ATOM 0 HA ARG A 9 -8.426 21.748 10.725 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -9.650 21.320 8.773 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -9.720 23.065 8.917 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -7.942 23.269 7.172 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -7.906 21.524 7.016 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -10.393 21.596 6.428 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -10.293 23.346 6.426 1.00 0.00 H new ATOM 0 HE ARG A 9 -8.265 22.183 4.683 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -11.787 22.976 4.753 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -11.852 23.115 2.993 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -8.467 22.399 2.494 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -10.019 22.796 1.748 1.00 0.00 H new ATOM 152 N ASP A 10 -5.809 21.538 8.900 1.00 0.00 N ATOM 153 CA ASP A 10 -4.653 20.668 8.581 1.00 0.00 C ATOM 154 C ASP A 10 -3.640 20.534 9.739 1.00 0.00 C ATOM 155 O ASP A 10 -2.644 19.817 9.562 1.00 0.00 O ATOM 156 CB ASP A 10 -3.992 21.167 7.272 1.00 0.00 C ATOM 157 CG ASP A 10 -4.870 21.074 6.011 1.00 0.00 C ATOM 158 OD1 ASP A 10 -4.995 19.967 5.442 1.00 0.00 O ATOM 159 OD2 ASP A 10 -5.441 22.105 5.593 1.00 0.00 O ATOM 0 H ASP A 10 -5.729 22.483 8.524 1.00 0.00 H new ATOM 0 HA ASP A 10 -5.026 19.654 8.433 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -3.692 22.206 7.410 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -3.081 20.592 7.103 1.00 0.00 H new ATOM 164 N GLY A 11 -3.896 21.172 10.912 1.00 0.00 N ATOM 165 CA GLY A 11 -2.864 21.289 11.949 1.00 0.00 C ATOM 166 C GLY A 11 -1.803 22.361 11.785 1.00 0.00 C ATOM 167 O GLY A 11 -0.753 22.188 12.408 1.00 0.00 O ATOM 0 H GLY A 11 -4.790 21.601 11.150 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -3.366 21.460 12.901 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -2.357 20.327 12.025 1.00 0.00 H new ATOM 171 N LEU A 12 -2.051 23.450 11.020 1.00 0.00 N ATOM 172 CA LEU A 12 -1.109 24.577 10.953 1.00 0.00 C ATOM 173 C LEU A 12 -1.270 25.478 12.197 1.00 0.00 C ATOM 174 O LEU A 12 -2.400 25.841 12.537 1.00 0.00 O ATOM 175 CB LEU A 12 -1.335 25.409 9.658 1.00 0.00 C ATOM 176 CG LEU A 12 -0.225 26.435 9.318 1.00 0.00 C ATOM 177 CD1 LEU A 12 0.947 25.773 8.573 1.00 0.00 C ATOM 178 CD2 LEU A 12 -0.818 27.622 8.547 1.00 0.00 C ATOM 0 H LEU A 12 -2.888 23.566 10.449 1.00 0.00 H new ATOM 0 HA LEU A 12 -0.095 24.177 10.932 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -1.438 24.721 8.819 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -2.281 25.942 9.751 1.00 0.00 H new ATOM 0 HG LEU A 12 0.189 26.822 10.249 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.707 26.522 8.351 1.00 0.00 H new ATOM 0 HD12 LEU A 12 1.380 24.991 9.197 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.586 25.335 7.642 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.028 28.336 8.314 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.269 27.265 7.621 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -1.578 28.109 9.157 1.00 0.00 H new ATOM 190 N ILE A 13 -0.124 25.898 12.743 1.00 0.00 N ATOM 191 CA ILE A 13 -0.090 26.782 13.950 1.00 0.00 C ATOM 192 C ILE A 13 0.581 28.147 13.700 1.00 0.00 C ATOM 193 O ILE A 13 0.234 29.064 14.453 1.00 0.00 O ATOM 194 CB ILE A 13 0.415 26.082 15.265 1.00 0.00 C ATOM 195 CG1 ILE A 13 1.925 25.703 15.270 1.00 0.00 C ATOM 196 CG2 ILE A 13 -0.496 24.889 15.652 1.00 0.00 C ATOM 197 CD1 ILE A 13 2.497 25.229 16.616 1.00 0.00 C ATOM 0 H ILE A 13 0.797 25.650 12.382 1.00 0.00 H new ATOM 0 HA ILE A 13 -1.141 26.997 14.140 1.00 0.00 H new ATOM 0 HB ILE A 13 0.333 26.840 16.044 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.084 24.916 14.533 1.00 0.00 H new ATOM 0 HG13 ILE A 13 2.498 26.570 14.939 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -0.121 24.426 16.565 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -1.512 25.246 15.817 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -0.496 24.155 14.846 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.555 24.993 16.499 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.381 26.018 17.359 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.961 24.339 16.946 1.00 0.00 H new ATOM 209 N GLY A 14 1.569 28.240 12.776 1.00 0.00 N ATOM 210 CA GLY A 14 2.370 29.470 12.650 1.00 0.00 C ATOM 211 C GLY A 14 2.895 29.708 11.242 1.00 0.00 C ATOM 212 O GLY A 14 3.022 28.798 10.414 1.00 0.00 O ATOM 0 H GLY A 14 1.822 27.496 12.126 1.00 0.00 H new ATOM 0 HA2 GLY A 14 1.762 30.323 12.952 1.00 0.00 H new ATOM 0 HA3 GLY A 14 3.212 29.418 13.340 1.00 0.00 H new ATOM 216 N LYS A 15 3.193 30.998 11.030 1.00 0.00 N ATOM 217 CA LYS A 15 3.681 31.540 9.759 1.00 0.00 C ATOM 218 C LYS A 15 4.701 32.620 10.190 1.00 0.00 C ATOM 219 O LYS A 15 4.347 33.584 10.873 1.00 0.00 O ATOM 220 CB LYS A 15 2.490 32.165 8.975 1.00 0.00 C ATOM 221 CG LYS A 15 2.943 32.793 7.644 1.00 0.00 C ATOM 222 CD LYS A 15 1.806 33.475 6.847 1.00 0.00 C ATOM 223 CE LYS A 15 2.141 33.840 5.383 1.00 0.00 C ATOM 224 NZ LYS A 15 2.300 32.662 4.510 1.00 0.00 N ATOM 0 H LYS A 15 3.098 31.708 11.756 1.00 0.00 H new ATOM 0 HA LYS A 15 4.129 30.794 9.103 1.00 0.00 H new ATOM 0 HB2 LYS A 15 1.743 31.397 8.778 1.00 0.00 H new ATOM 0 HB3 LYS A 15 2.010 32.926 9.590 1.00 0.00 H new ATOM 0 HG2 LYS A 15 3.721 33.529 7.848 1.00 0.00 H new ATOM 0 HG3 LYS A 15 3.393 32.018 7.023 1.00 0.00 H new ATOM 0 HD2 LYS A 15 0.939 32.814 6.848 1.00 0.00 H new ATOM 0 HD3 LYS A 15 1.514 34.385 7.372 1.00 0.00 H new ATOM 0 HE2 LYS A 15 1.350 34.475 4.984 1.00 0.00 H new ATOM 0 HE3 LYS A 15 3.060 34.425 5.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 1.895 32.866 3.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 3.311 32.439 4.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 1.807 31.849 4.931 1.00 0.00 H new ATOM 238 N ASP A 16 5.902 32.549 9.583 1.00 0.00 N ATOM 239 CA ASP A 16 6.963 33.619 9.616 1.00 0.00 C ATOM 240 C ASP A 16 7.347 34.162 11.039 1.00 0.00 C ATOM 241 O ASP A 16 7.697 35.343 11.195 1.00 0.00 O ATOM 242 CB ASP A 16 6.683 34.731 8.547 1.00 0.00 C ATOM 243 CG ASP A 16 6.677 34.271 7.077 1.00 0.00 C ATOM 244 OD1 ASP A 16 7.691 33.700 6.616 1.00 0.00 O ATOM 245 OD2 ASP A 16 5.665 34.491 6.377 1.00 0.00 O ATOM 0 H ASP A 16 6.185 31.734 9.039 1.00 0.00 H new ATOM 0 HA ASP A 16 7.887 33.120 9.323 1.00 0.00 H new ATOM 0 HB2 ASP A 16 5.717 35.185 8.769 1.00 0.00 H new ATOM 0 HB3 ASP A 16 7.435 35.512 8.659 1.00 0.00 H new ATOM 250 N GLY A 17 7.278 33.278 12.066 1.00 0.00 N ATOM 251 CA GLY A 17 7.273 33.733 13.478 1.00 0.00 C ATOM 252 C GLY A 17 6.057 34.424 14.103 1.00 0.00 C ATOM 253 O GLY A 17 6.201 34.931 15.220 1.00 0.00 O ATOM 0 H GLY A 17 7.226 32.266 11.947 1.00 0.00 H new ATOM 0 HA2 GLY A 17 7.487 32.858 14.091 1.00 0.00 H new ATOM 0 HA3 GLY A 17 8.115 34.415 13.592 1.00 0.00 H new ATOM 257 N HIS A 18 4.903 34.437 13.420 1.00 0.00 N ATOM 258 CA HIS A 18 3.634 35.015 13.925 1.00 0.00 C ATOM 259 C HIS A 18 2.529 33.963 13.683 1.00 0.00 C ATOM 260 O HIS A 18 2.740 32.899 13.087 1.00 0.00 O ATOM 261 CB HIS A 18 3.390 36.435 13.318 1.00 0.00 C ATOM 262 CG HIS A 18 3.362 36.575 11.786 1.00 0.00 C ATOM 263 ND1 HIS A 18 2.248 36.365 10.989 1.00 0.00 N ATOM 264 CD2 HIS A 18 4.464 36.937 10.984 1.00 0.00 C ATOM 265 CE1 HIS A 18 2.786 36.602 9.752 1.00 0.00 C ATOM 266 NE2 HIS A 18 4.106 36.953 9.648 1.00 0.00 N ATOM 0 H HIS A 18 4.816 34.041 12.484 1.00 0.00 H new ATOM 0 HA HIS A 18 3.653 35.212 14.997 1.00 0.00 H new ATOM 0 HB2 HIS A 18 2.439 36.803 13.704 1.00 0.00 H new ATOM 0 HB3 HIS A 18 4.167 37.098 13.699 1.00 0.00 H new ATOM 0 HD1 HIS A 18 1.296 36.107 11.250 1.00 0.00 H new ATOM 0 HD2 HIS A 18 5.449 37.169 11.360 1.00 0.00 H new ATOM 0 HE1 HIS A 18 2.175 36.513 8.866 1.00 0.00 H new ATOM 275 N LEU A 19 1.322 34.284 14.168 1.00 0.00 N ATOM 276 CA LEU A 19 0.089 33.562 13.889 1.00 0.00 C ATOM 277 C LEU A 19 -0.330 33.593 12.399 1.00 0.00 C ATOM 278 O LEU A 19 -0.233 34.695 11.839 1.00 0.00 O ATOM 279 CB LEU A 19 -1.112 34.084 14.724 1.00 0.00 C ATOM 280 CG LEU A 19 -1.139 33.726 16.233 1.00 0.00 C ATOM 281 CD1 LEU A 19 -2.238 34.544 16.937 1.00 0.00 C ATOM 282 CD2 LEU A 19 -1.369 32.220 16.487 1.00 0.00 C ATOM 0 H LEU A 19 1.180 35.083 14.786 1.00 0.00 H new ATOM 0 HA LEU A 19 0.326 32.536 14.170 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.138 35.170 14.635 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.028 33.705 14.271 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.159 33.973 16.641 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.256 34.292 17.997 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.031 35.608 16.820 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.206 34.312 16.492 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -1.378 32.029 17.560 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.325 31.920 16.057 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -0.567 31.646 16.023 1.00 0.00 H new ATOM 294 N PRO A 20 -0.823 32.495 11.745 1.00 0.00 N ATOM 295 CA PRO A 20 -1.340 32.621 10.351 1.00 0.00 C ATOM 296 C PRO A 20 -2.680 33.420 10.115 1.00 0.00 C ATOM 297 O PRO A 20 -3.037 33.684 8.964 1.00 0.00 O ATOM 298 CB PRO A 20 -1.481 31.154 9.946 1.00 0.00 C ATOM 299 CG PRO A 20 -0.882 30.290 11.057 1.00 0.00 C ATOM 300 CD PRO A 20 -0.984 31.127 12.332 1.00 0.00 C ATOM 0 HA PRO A 20 -0.661 33.234 9.758 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -2.530 30.902 9.792 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -0.967 30.969 9.003 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -1.427 29.352 11.160 1.00 0.00 H new ATOM 0 HG3 PRO A 20 0.155 30.034 10.838 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -1.939 31.000 12.841 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -0.204 30.887 13.054 1.00 0.00 H new ATOM 308 N TRP A 21 -3.395 33.729 11.211 1.00 0.00 N ATOM 309 CA TRP A 21 -4.756 34.316 11.272 1.00 0.00 C ATOM 310 C TRP A 21 -4.709 35.405 12.392 1.00 0.00 C ATOM 311 O TRP A 21 -3.775 35.467 13.207 1.00 0.00 O ATOM 312 CB TRP A 21 -5.821 33.189 11.543 1.00 0.00 C ATOM 313 CG TRP A 21 -5.628 32.334 12.813 1.00 0.00 C ATOM 314 CD1 TRP A 21 -5.812 32.762 14.146 1.00 0.00 C ATOM 315 CD2 TRP A 21 -5.076 31.073 12.906 1.00 0.00 C ATOM 316 NE1 TRP A 21 -5.373 31.806 15.074 1.00 0.00 N ATOM 317 CE2 TRP A 21 -4.904 30.772 14.281 1.00 0.00 C ATOM 318 CE3 TRP A 21 -4.638 30.163 11.909 1.00 0.00 C ATOM 319 CZ2 TRP A 21 -4.250 29.582 14.665 1.00 0.00 C ATOM 320 CZ3 TRP A 21 -4.024 28.979 12.316 1.00 0.00 C ATOM 321 CH2 TRP A 21 -3.818 28.703 13.672 1.00 0.00 C ATOM 0 H TRP A 21 -3.016 33.566 12.144 1.00 0.00 H new ATOM 0 HA TRP A 21 -5.057 34.777 10.331 1.00 0.00 H new ATOM 0 HB2 TRP A 21 -6.804 33.657 11.596 1.00 0.00 H new ATOM 0 HB3 TRP A 21 -5.833 32.520 10.683 1.00 0.00 H new ATOM 0 HD1 TRP A 21 -6.241 33.715 14.419 1.00 0.00 H new ATOM 0 HE1 TRP A 21 -5.394 31.860 16.092 1.00 0.00 H new ATOM 0 HE3 TRP A 21 -4.777 30.382 10.861 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 -4.087 29.356 15.708 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 -3.703 28.264 11.573 1.00 0.00 H new ATOM 0 HH2 TRP A 21 -3.314 27.791 13.956 1.00 0.00 H new ATOM 332 N HIS A 22 -5.771 36.225 12.452 1.00 0.00 N ATOM 333 CA HIS A 22 -6.078 37.044 13.634 1.00 0.00 C ATOM 334 C HIS A 22 -7.508 36.653 14.007 1.00 0.00 C ATOM 335 O HIS A 22 -8.476 36.892 13.274 1.00 0.00 O ATOM 336 CB HIS A 22 -5.903 38.518 13.261 1.00 0.00 C ATOM 337 CG HIS A 22 -6.113 39.524 14.399 1.00 0.00 C ATOM 338 ND1 HIS A 22 -5.281 39.655 15.503 1.00 0.00 N ATOM 339 CD2 HIS A 22 -7.126 40.502 14.443 1.00 0.00 C ATOM 340 CE1 HIS A 22 -5.877 40.717 16.130 1.00 0.00 C ATOM 341 NE2 HIS A 22 -6.986 41.294 15.570 1.00 0.00 N ATOM 0 H HIS A 22 -6.436 36.338 11.687 1.00 0.00 H new ATOM 0 HA HIS A 22 -5.425 36.884 14.492 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -4.898 38.655 12.861 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -6.601 38.755 12.458 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -7.903 40.618 13.702 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -5.476 41.096 17.058 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -7.548 42.082 15.891 1.00 0.00 H new ATOM 350 N LEU A 23 -7.546 36.032 15.186 1.00 0.00 N ATOM 351 CA LEU A 23 -8.749 35.531 15.824 1.00 0.00 C ATOM 352 C LEU A 23 -8.782 36.142 17.256 1.00 0.00 C ATOM 353 O LEU A 23 -8.280 35.492 18.183 1.00 0.00 O ATOM 354 CB LEU A 23 -8.824 34.000 15.718 1.00 0.00 C ATOM 355 CG LEU A 23 -10.113 33.289 16.214 1.00 0.00 C ATOM 356 CD1 LEU A 23 -11.394 33.782 15.510 1.00 0.00 C ATOM 357 CD2 LEU A 23 -9.962 31.766 16.043 1.00 0.00 C ATOM 0 H LEU A 23 -6.705 35.861 15.738 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.667 35.844 15.327 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -8.678 33.732 14.672 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.982 33.587 16.273 1.00 0.00 H new ATOM 0 HG LEU A 23 -10.229 33.541 17.268 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -12.256 33.244 15.904 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -11.520 34.850 15.689 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -11.313 33.601 14.438 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -10.867 31.269 16.392 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.802 31.532 14.990 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -9.109 31.417 16.626 1.00 0.00 H new ATOM 369 N PRO A 24 -9.425 37.323 17.487 1.00 0.00 N ATOM 370 CA PRO A 24 -9.659 37.866 18.846 1.00 0.00 C ATOM 371 C PRO A 24 -10.401 37.033 19.920 1.00 0.00 C ATOM 372 O PRO A 24 -9.976 37.126 21.076 1.00 0.00 O ATOM 373 CB PRO A 24 -10.388 39.173 18.576 1.00 0.00 C ATOM 374 CG PRO A 24 -9.955 39.597 17.177 1.00 0.00 C ATOM 375 CD PRO A 24 -9.812 38.276 16.426 1.00 0.00 C ATOM 0 HA PRO A 24 -8.686 37.921 19.333 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -11.468 39.038 18.629 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -10.125 39.930 19.315 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.695 40.246 16.708 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -9.015 40.149 17.199 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -10.745 37.984 15.944 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -9.055 38.337 15.644 1.00 0.00 H new ATOM 383 N ASP A 25 -11.457 36.243 19.569 1.00 0.00 N ATOM 384 CA ASP A 25 -12.157 35.357 20.551 1.00 0.00 C ATOM 385 C ASP A 25 -11.252 34.280 21.252 1.00 0.00 C ATOM 386 O ASP A 25 -11.353 34.084 22.467 1.00 0.00 O ATOM 387 CB ASP A 25 -13.390 34.739 19.857 1.00 0.00 C ATOM 388 CG ASP A 25 -14.405 34.100 20.818 1.00 0.00 C ATOM 389 OD1 ASP A 25 -15.127 34.844 21.517 1.00 0.00 O ATOM 390 OD2 ASP A 25 -14.486 32.854 20.874 1.00 0.00 O ATOM 0 H ASP A 25 -11.840 36.200 18.624 1.00 0.00 H new ATOM 0 HA ASP A 25 -12.468 35.983 21.388 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -13.893 35.514 19.279 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -13.052 33.982 19.149 1.00 0.00 H new ATOM 395 N ASP A 26 -10.392 33.646 20.441 1.00 0.00 N ATOM 396 CA ASP A 26 -9.328 32.715 20.860 1.00 0.00 C ATOM 397 C ASP A 26 -8.174 33.311 21.722 1.00 0.00 C ATOM 398 O ASP A 26 -7.673 32.579 22.577 1.00 0.00 O ATOM 399 CB ASP A 26 -8.863 32.126 19.506 1.00 0.00 C ATOM 400 CG ASP A 26 -7.811 31.025 19.537 1.00 0.00 C ATOM 401 OD1 ASP A 26 -8.003 30.037 20.272 1.00 0.00 O ATOM 402 OD2 ASP A 26 -6.792 31.142 18.821 1.00 0.00 O ATOM 0 H ASP A 26 -10.419 33.772 19.429 1.00 0.00 H new ATOM 0 HA ASP A 26 -9.701 31.975 21.568 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -9.741 31.737 18.990 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -8.474 32.944 18.900 1.00 0.00 H new ATOM 407 N LEU A 27 -7.762 34.567 21.464 1.00 0.00 N ATOM 408 CA LEU A 27 -6.745 35.304 22.268 1.00 0.00 C ATOM 409 C LEU A 27 -7.307 35.924 23.568 1.00 0.00 C ATOM 410 O LEU A 27 -6.529 36.049 24.521 1.00 0.00 O ATOM 411 CB LEU A 27 -6.008 36.342 21.354 1.00 0.00 C ATOM 412 CG LEU A 27 -4.846 35.808 20.461 1.00 0.00 C ATOM 413 CD1 LEU A 27 -5.298 34.912 19.289 1.00 0.00 C ATOM 414 CD2 LEU A 27 -4.007 36.976 19.904 1.00 0.00 C ATOM 0 H LEU A 27 -8.126 35.113 20.683 1.00 0.00 H new ATOM 0 HA LEU A 27 -6.013 34.580 22.626 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -6.749 36.804 20.702 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -5.609 37.130 21.992 1.00 0.00 H new ATOM 0 HG LEU A 27 -4.249 35.181 21.123 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.426 34.587 18.722 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -5.823 34.040 19.679 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -5.965 35.475 18.636 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -3.202 36.582 19.284 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -4.643 37.627 19.303 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -3.583 37.546 20.731 1.00 0.00 H new ATOM 426 N HIS A 28 -8.623 36.240 23.624 1.00 0.00 N ATOM 427 CA HIS A 28 -9.354 36.408 24.920 1.00 0.00 C ATOM 428 C HIS A 28 -9.446 35.131 25.822 1.00 0.00 C ATOM 429 O HIS A 28 -9.300 35.259 27.042 1.00 0.00 O ATOM 430 CB HIS A 28 -10.776 36.987 24.672 1.00 0.00 C ATOM 431 CG HIS A 28 -10.918 38.338 23.952 1.00 0.00 C ATOM 432 ND1 HIS A 28 -10.082 39.436 24.115 1.00 0.00 N ATOM 433 CD2 HIS A 28 -11.963 38.664 23.064 1.00 0.00 C ATOM 434 CE1 HIS A 28 -10.692 40.332 23.278 1.00 0.00 C ATOM 435 NE2 HIS A 28 -11.823 39.961 22.603 1.00 0.00 N ATOM 0 H HIS A 28 -9.204 36.384 22.798 1.00 0.00 H new ATOM 0 HA HIS A 28 -8.742 37.109 25.487 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -11.336 36.248 24.098 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -11.267 37.078 25.641 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -12.762 37.994 22.783 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -10.284 41.324 23.152 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -12.398 40.490 21.947 1.00 0.00 H new ATOM 444 N TYR A 29 -9.647 33.943 25.207 1.00 0.00 N ATOM 445 CA TYR A 29 -9.494 32.615 25.859 1.00 0.00 C ATOM 446 C TYR A 29 -8.025 32.171 26.138 1.00 0.00 C ATOM 447 O TYR A 29 -7.848 31.457 27.131 1.00 0.00 O ATOM 448 CB TYR A 29 -10.261 31.646 24.934 1.00 0.00 C ATOM 449 CG TYR A 29 -10.427 30.172 25.356 1.00 0.00 C ATOM 450 CD1 TYR A 29 -11.556 29.763 26.074 1.00 0.00 C ATOM 451 CD2 TYR A 29 -9.521 29.208 24.897 1.00 0.00 C ATOM 452 CE1 TYR A 29 -11.781 28.410 26.320 1.00 0.00 C ATOM 453 CE2 TYR A 29 -9.751 27.855 25.139 1.00 0.00 C ATOM 454 CZ TYR A 29 -10.881 27.457 25.849 1.00 0.00 C ATOM 455 OH TYR A 29 -11.106 26.125 26.083 1.00 0.00 O ATOM 0 H TYR A 29 -9.925 33.875 24.228 1.00 0.00 H new ATOM 0 HA TYR A 29 -9.897 32.638 26.871 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -11.259 32.058 24.783 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -9.763 31.655 23.965 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -12.256 30.499 26.439 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -8.640 29.514 24.353 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -12.653 28.100 26.876 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -9.053 27.115 24.776 1.00 0.00 H new ATOM 0 HH TYR A 29 -10.383 25.596 25.686 1.00 0.00 H new ATOM 465 N PHE A 30 -7.005 32.597 25.342 1.00 0.00 N ATOM 466 CA PHE A 30 -5.566 32.502 25.734 1.00 0.00 C ATOM 467 C PHE A 30 -5.191 33.256 27.040 1.00 0.00 C ATOM 468 O PHE A 30 -4.545 32.648 27.900 1.00 0.00 O ATOM 469 CB PHE A 30 -4.668 32.981 24.560 1.00 0.00 C ATOM 470 CG PHE A 30 -3.179 32.639 24.670 1.00 0.00 C ATOM 471 CD1 PHE A 30 -2.760 31.320 24.481 1.00 0.00 C ATOM 472 CD2 PHE A 30 -2.227 33.635 24.909 1.00 0.00 C ATOM 473 CE1 PHE A 30 -1.409 31.000 24.516 1.00 0.00 C ATOM 474 CE2 PHE A 30 -0.873 33.313 24.939 1.00 0.00 C ATOM 475 CZ PHE A 30 -0.465 31.998 24.730 1.00 0.00 C ATOM 0 H PHE A 30 -7.152 33.011 24.422 1.00 0.00 H new ATOM 0 HA PHE A 30 -5.390 31.449 25.952 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -5.052 32.550 23.636 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -4.766 34.063 24.472 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -3.491 30.544 24.307 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -2.543 34.655 25.070 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -1.092 29.977 24.377 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -0.139 34.083 25.124 1.00 0.00 H new ATOM 0 HZ PHE A 30 0.587 31.753 24.734 1.00 0.00 H new ATOM 485 N ARG A 31 -5.643 34.527 27.186 1.00 0.00 N ATOM 486 CA ARG A 31 -5.604 35.280 28.453 1.00 0.00 C ATOM 487 C ARG A 31 -6.065 34.467 29.710 1.00 0.00 C ATOM 488 O ARG A 31 -5.284 34.410 30.659 1.00 0.00 O ATOM 489 CB ARG A 31 -6.392 36.600 28.267 1.00 0.00 C ATOM 490 CG ARG A 31 -6.096 37.586 29.411 1.00 0.00 C ATOM 491 CD ARG A 31 -6.618 39.014 29.160 1.00 0.00 C ATOM 492 NE ARG A 31 -6.029 39.982 30.120 1.00 0.00 N ATOM 493 CZ ARG A 31 -6.048 41.321 29.966 1.00 0.00 C ATOM 494 NH1 ARG A 31 -6.622 41.944 28.938 1.00 0.00 N ATOM 495 NH2 ARG A 31 -5.462 42.060 30.889 1.00 0.00 N ATOM 0 H ARG A 31 -6.048 35.058 26.415 1.00 0.00 H new ATOM 0 HA ARG A 31 -4.561 35.503 28.676 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -6.126 37.055 27.313 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -7.461 36.388 28.233 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -6.541 37.204 30.330 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -5.019 37.627 29.571 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -6.377 39.317 28.141 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -7.704 39.027 29.248 1.00 0.00 H new ATOM 0 HE ARG A 31 -5.578 39.607 30.955 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -7.083 41.403 28.207 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.600 42.962 28.882 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -5.012 41.615 31.689 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.459 43.076 30.802 1.00 0.00 H new ATOM 509 N ALA A 32 -7.321 33.978 29.692 1.00 0.00 N ATOM 510 CA ALA A 32 -8.026 33.510 30.898 1.00 0.00 C ATOM 511 C ALA A 32 -8.054 31.988 31.128 1.00 0.00 C ATOM 512 O ALA A 32 -8.236 31.595 32.286 1.00 0.00 O ATOM 513 CB ALA A 32 -9.440 34.058 30.831 1.00 0.00 C ATOM 0 H ALA A 32 -7.874 33.897 28.839 1.00 0.00 H new ATOM 0 HA ALA A 32 -7.461 33.882 31.753 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -9.998 33.733 31.709 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -9.407 35.147 30.804 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -9.932 33.688 29.931 1.00 0.00 H new ATOM 519 N GLN A 33 -7.797 31.150 30.092 1.00 0.00 N ATOM 520 CA GLN A 33 -7.179 29.797 30.292 1.00 0.00 C ATOM 521 C GLN A 33 -5.766 29.778 30.939 1.00 0.00 C ATOM 522 O GLN A 33 -5.437 28.769 31.572 1.00 0.00 O ATOM 523 CB GLN A 33 -7.159 28.935 28.991 1.00 0.00 C ATOM 524 CG GLN A 33 -8.526 28.501 28.424 1.00 0.00 C ATOM 525 CD GLN A 33 -9.327 27.514 29.293 1.00 0.00 C ATOM 526 OE1 GLN A 33 -9.009 26.328 29.374 1.00 0.00 O ATOM 527 NE2 GLN A 33 -10.385 27.974 29.943 1.00 0.00 N ATOM 0 H GLN A 33 -8.002 31.375 29.119 1.00 0.00 H new ATOM 0 HA GLN A 33 -7.855 29.351 31.021 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -6.634 29.497 28.219 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -6.572 28.038 29.187 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -9.133 29.393 28.266 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -8.365 28.048 27.446 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -10.640 28.959 29.869 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -10.945 27.344 30.517 1.00 0.00 H new ATOM 536 N THR A 34 -4.989 30.875 30.809 1.00 0.00 N ATOM 537 CA THR A 34 -3.738 31.090 31.588 1.00 0.00 C ATOM 538 C THR A 34 -3.754 32.323 32.536 1.00 0.00 C ATOM 539 O THR A 34 -2.660 32.658 33.008 1.00 0.00 O ATOM 540 CB THR A 34 -2.467 31.053 30.680 1.00 0.00 C ATOM 541 OG1 THR A 34 -2.559 31.965 29.594 1.00 0.00 O ATOM 542 CG2 THR A 34 -2.140 29.660 30.139 1.00 0.00 C ATOM 0 H THR A 34 -5.205 31.637 30.166 1.00 0.00 H new ATOM 0 HA THR A 34 -3.688 30.236 32.264 1.00 0.00 H new ATOM 0 HB THR A 34 -1.652 31.354 31.338 1.00 0.00 H new ATOM 0 HG1 THR A 34 -3.429 31.864 29.155 1.00 0.00 H new ATOM 0 HG21 THR A 34 -1.246 29.712 29.518 1.00 0.00 H new ATOM 0 HG22 THR A 34 -1.964 28.978 30.971 1.00 0.00 H new ATOM 0 HG23 THR A 34 -2.976 29.296 29.542 1.00 0.00 H new ATOM 550 N VAL A 35 -4.895 32.945 32.996 1.00 0.00 N ATOM 551 CA VAL A 35 -4.804 33.992 34.082 1.00 0.00 C ATOM 552 C VAL A 35 -4.472 33.235 35.401 1.00 0.00 C ATOM 553 O VAL A 35 -5.331 32.441 35.814 1.00 0.00 O ATOM 554 CB VAL A 35 -5.976 35.014 34.314 1.00 0.00 C ATOM 555 CG1 VAL A 35 -6.076 36.152 33.275 1.00 0.00 C ATOM 556 CG2 VAL A 35 -7.368 34.419 34.631 1.00 0.00 C ATOM 0 H VAL A 35 -5.838 32.755 32.656 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.036 34.678 33.724 1.00 0.00 H new ATOM 0 HB VAL A 35 -5.643 35.466 35.248 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.916 36.801 33.525 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.154 36.733 33.282 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -6.229 35.727 32.283 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -8.086 35.227 34.769 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -7.689 33.785 33.805 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.311 33.825 35.543 1.00 0.00 H new ATOM 566 N GLY A 36 -3.297 33.459 36.015 1.00 0.00 N ATOM 567 CA GLY A 36 -2.962 32.692 37.236 1.00 0.00 C ATOM 568 C GLY A 36 -2.049 31.476 37.183 1.00 0.00 C ATOM 569 O GLY A 36 -1.702 31.010 38.275 1.00 0.00 O ATOM 0 H GLY A 36 -2.592 34.129 35.709 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -2.514 33.394 37.939 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.905 32.362 37.672 1.00 0.00 H new ATOM 573 N LYS A 37 -1.688 30.955 35.999 1.00 0.00 N ATOM 574 CA LYS A 37 -1.008 29.632 35.906 1.00 0.00 C ATOM 575 C LYS A 37 0.462 29.915 35.576 1.00 0.00 C ATOM 576 O LYS A 37 0.898 31.067 35.415 1.00 0.00 O ATOM 577 CB LYS A 37 -1.735 28.729 34.869 1.00 0.00 C ATOM 578 CG LYS A 37 -3.162 28.363 35.331 1.00 0.00 C ATOM 579 CD LYS A 37 -3.919 27.442 34.350 1.00 0.00 C ATOM 580 CE LYS A 37 -5.351 27.038 34.761 1.00 0.00 C ATOM 581 NZ LYS A 37 -6.311 28.157 34.713 1.00 0.00 N ATOM 0 H LYS A 37 -1.848 31.412 35.101 1.00 0.00 H new ATOM 0 HA LYS A 37 -1.048 29.072 36.840 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -1.784 29.244 33.909 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -1.158 27.817 34.713 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -3.104 27.873 36.303 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -3.735 29.280 35.469 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.968 27.940 33.382 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.333 26.533 34.212 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -5.699 26.242 34.103 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -5.330 26.630 35.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -7.270 27.800 34.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -6.057 28.863 35.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -6.284 28.598 33.771 1.00 0.00 H new ATOM 595 N ILE A 38 1.232 28.820 35.451 1.00 0.00 N ATOM 596 CA ILE A 38 2.625 28.876 34.971 1.00 0.00 C ATOM 597 C ILE A 38 2.465 28.539 33.473 1.00 0.00 C ATOM 598 O ILE A 38 2.163 27.402 33.096 1.00 0.00 O ATOM 599 CB ILE A 38 3.556 27.931 35.785 1.00 0.00 C ATOM 600 CG1 ILE A 38 3.632 28.283 37.302 1.00 0.00 C ATOM 601 CG2 ILE A 38 4.998 27.940 35.222 1.00 0.00 C ATOM 602 CD1 ILE A 38 4.201 27.182 38.209 1.00 0.00 C ATOM 0 H ILE A 38 0.911 27.879 35.677 1.00 0.00 H new ATOM 0 HA ILE A 38 3.125 29.835 35.106 1.00 0.00 H new ATOM 0 HB ILE A 38 3.106 26.943 35.683 1.00 0.00 H new ATOM 0 HG12 ILE A 38 4.243 29.178 37.419 1.00 0.00 H new ATOM 0 HG13 ILE A 38 2.630 28.534 37.650 1.00 0.00 H new ATOM 0 HG21 ILE A 38 5.623 27.270 35.812 1.00 0.00 H new ATOM 0 HG22 ILE A 38 4.986 27.605 34.185 1.00 0.00 H new ATOM 0 HG23 ILE A 38 5.402 28.951 35.272 1.00 0.00 H new ATOM 0 HD11 ILE A 38 4.210 27.530 39.242 1.00 0.00 H new ATOM 0 HD12 ILE A 38 3.580 26.290 38.132 1.00 0.00 H new ATOM 0 HD13 ILE A 38 5.218 26.944 37.898 1.00 0.00 H new ATOM 614 N MET A 39 2.704 29.595 32.697 1.00 0.00 N ATOM 615 CA MET A 39 2.645 29.565 31.240 1.00 0.00 C ATOM 616 C MET A 39 4.091 29.385 30.728 1.00 0.00 C ATOM 617 O MET A 39 4.946 30.214 31.040 1.00 0.00 O ATOM 618 CB MET A 39 1.942 30.855 30.754 1.00 0.00 C ATOM 619 CG MET A 39 1.612 30.780 29.256 1.00 0.00 C ATOM 620 SD MET A 39 0.798 32.297 28.718 1.00 0.00 S ATOM 621 CE MET A 39 1.865 32.760 27.347 1.00 0.00 C ATOM 0 H MET A 39 2.948 30.511 33.072 1.00 0.00 H new ATOM 0 HA MET A 39 2.058 28.737 30.843 1.00 0.00 H new ATOM 0 HB2 MET A 39 1.025 31.009 31.323 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.584 31.715 30.945 1.00 0.00 H new ATOM 0 HG2 MET A 39 2.526 30.627 28.682 1.00 0.00 H new ATOM 0 HG3 MET A 39 0.966 29.924 29.061 1.00 0.00 H new ATOM 0 HE1 MET A 39 1.383 33.541 26.758 1.00 0.00 H new ATOM 0 HE2 MET A 39 2.814 33.131 27.734 1.00 0.00 H new ATOM 0 HE3 MET A 39 2.046 31.889 26.716 1.00 0.00 H new ATOM 631 N VAL A 40 4.303 28.347 29.905 1.00 0.00 N ATOM 632 CA VAL A 40 5.644 28.000 29.362 1.00 0.00 C ATOM 633 C VAL A 40 5.495 28.299 27.860 1.00 0.00 C ATOM 634 O VAL A 40 4.536 27.899 27.193 1.00 0.00 O ATOM 635 CB VAL A 40 6.107 26.529 29.631 1.00 0.00 C ATOM 636 CG1 VAL A 40 7.567 26.262 29.194 1.00 0.00 C ATOM 637 CG2 VAL A 40 5.966 26.106 31.111 1.00 0.00 C ATOM 0 H VAL A 40 3.560 27.722 29.593 1.00 0.00 H new ATOM 0 HA VAL A 40 6.430 28.573 29.854 1.00 0.00 H new ATOM 0 HB VAL A 40 5.431 25.930 29.020 1.00 0.00 H new ATOM 0 HG11 VAL A 40 7.827 25.225 29.407 1.00 0.00 H new ATOM 0 HG12 VAL A 40 7.667 26.449 28.125 1.00 0.00 H new ATOM 0 HG13 VAL A 40 8.238 26.924 29.742 1.00 0.00 H new ATOM 0 HG21 VAL A 40 6.304 25.076 31.229 1.00 0.00 H new ATOM 0 HG22 VAL A 40 6.573 26.761 31.736 1.00 0.00 H new ATOM 0 HG23 VAL A 40 4.921 26.182 31.413 1.00 0.00 H new ATOM 647 N VAL A 41 6.549 28.932 27.355 1.00 0.00 N ATOM 648 CA VAL A 41 6.632 29.361 25.936 1.00 0.00 C ATOM 649 C VAL A 41 8.126 29.162 25.592 1.00 0.00 C ATOM 650 O VAL A 41 9.028 29.467 26.388 1.00 0.00 O ATOM 651 CB VAL A 41 6.064 30.810 25.630 1.00 0.00 C ATOM 652 CG1 VAL A 41 4.529 30.805 25.650 1.00 0.00 C ATOM 653 CG2 VAL A 41 6.611 31.942 26.537 1.00 0.00 C ATOM 0 H VAL A 41 7.375 29.168 27.905 1.00 0.00 H new ATOM 0 HA VAL A 41 5.976 28.772 25.295 1.00 0.00 H new ATOM 0 HB VAL A 41 6.429 31.046 24.630 1.00 0.00 H new ATOM 0 HG11 VAL A 41 4.159 31.808 25.438 1.00 0.00 H new ATOM 0 HG12 VAL A 41 4.158 30.114 24.894 1.00 0.00 H new ATOM 0 HG13 VAL A 41 4.179 30.490 26.633 1.00 0.00 H new ATOM 0 HG21 VAL A 41 6.161 32.891 26.246 1.00 0.00 H new ATOM 0 HG22 VAL A 41 6.364 31.727 27.577 1.00 0.00 H new ATOM 0 HG23 VAL A 41 7.694 32.005 26.427 1.00 0.00 H new ATOM 663 N GLY A 42 8.357 28.770 24.333 1.00 0.00 N ATOM 664 CA GLY A 42 9.647 28.969 23.672 1.00 0.00 C ATOM 665 C GLY A 42 9.959 30.436 23.406 1.00 0.00 C ATOM 666 O GLY A 42 9.061 31.228 23.093 1.00 0.00 O ATOM 0 H GLY A 42 7.659 28.309 23.750 1.00 0.00 H new ATOM 0 HA2 GLY A 42 10.436 28.542 24.291 1.00 0.00 H new ATOM 0 HA3 GLY A 42 9.653 28.425 22.728 1.00 0.00 H new ATOM 670 N ARG A 43 11.254 30.748 23.521 1.00 0.00 N ATOM 671 CA ARG A 43 11.814 32.091 23.262 1.00 0.00 C ATOM 672 C ARG A 43 11.297 32.830 22.009 1.00 0.00 C ATOM 673 O ARG A 43 11.071 34.040 22.140 1.00 0.00 O ATOM 674 CB ARG A 43 13.356 31.963 23.267 1.00 0.00 C ATOM 675 CG ARG A 43 14.152 33.292 23.281 1.00 0.00 C ATOM 676 CD ARG A 43 14.598 33.829 21.906 1.00 0.00 C ATOM 677 NE ARG A 43 15.703 33.039 21.307 1.00 0.00 N ATOM 678 CZ ARG A 43 16.196 33.234 20.069 1.00 0.00 C ATOM 679 NH1 ARG A 43 15.777 34.190 19.241 1.00 0.00 N ATOM 680 NH2 ARG A 43 17.155 32.429 19.650 1.00 0.00 N ATOM 0 H ARG A 43 11.960 30.067 23.801 1.00 0.00 H new ATOM 0 HA ARG A 43 11.457 32.739 24.062 1.00 0.00 H new ATOM 0 HB2 ARG A 43 13.649 31.379 24.140 1.00 0.00 H new ATOM 0 HB3 ARG A 43 13.655 31.393 22.387 1.00 0.00 H new ATOM 0 HG2 ARG A 43 13.540 34.053 23.765 1.00 0.00 H new ATOM 0 HG3 ARG A 43 15.039 33.155 23.900 1.00 0.00 H new ATOM 0 HD2 ARG A 43 13.746 33.825 21.226 1.00 0.00 H new ATOM 0 HD3 ARG A 43 14.916 34.866 22.013 1.00 0.00 H new ATOM 0 HE ARG A 43 16.117 32.298 21.872 1.00 0.00 H new ATOM 0 HH11 ARG A 43 15.038 34.830 19.533 1.00 0.00 H new ATOM 0 HH12 ARG A 43 16.195 34.282 18.315 1.00 0.00 H new ATOM 0 HH21 ARG A 43 17.500 31.687 20.259 1.00 0.00 H new ATOM 0 HH22 ARG A 43 17.551 32.549 18.718 1.00 0.00 H new ATOM 694 N ARG A 44 11.113 32.136 20.857 1.00 0.00 N ATOM 695 CA ARG A 44 10.515 32.813 19.685 1.00 0.00 C ATOM 696 C ARG A 44 9.025 33.240 19.898 1.00 0.00 C ATOM 697 O ARG A 44 8.740 34.425 19.694 1.00 0.00 O ATOM 698 CB ARG A 44 10.702 31.914 18.465 1.00 0.00 C ATOM 699 CG ARG A 44 10.386 32.633 17.138 1.00 0.00 C ATOM 700 CD ARG A 44 10.490 31.760 15.866 1.00 0.00 C ATOM 701 NE ARG A 44 11.885 31.471 15.426 1.00 0.00 N ATOM 702 CZ ARG A 44 12.530 30.301 15.607 1.00 0.00 C ATOM 703 NH1 ARG A 44 12.001 29.241 16.216 1.00 0.00 N ATOM 704 NH2 ARG A 44 13.765 30.199 15.154 1.00 0.00 N ATOM 0 H ARG A 44 11.357 31.155 20.719 1.00 0.00 H new ATOM 0 HA ARG A 44 11.035 33.758 19.527 1.00 0.00 H new ATOM 0 HB2 ARG A 44 11.730 31.552 18.441 1.00 0.00 H new ATOM 0 HB3 ARG A 44 10.058 31.040 18.562 1.00 0.00 H new ATOM 0 HG2 ARG A 44 9.376 33.040 17.197 1.00 0.00 H new ATOM 0 HG3 ARG A 44 11.065 33.479 17.033 1.00 0.00 H new ATOM 0 HD2 ARG A 44 9.976 30.816 16.046 1.00 0.00 H new ATOM 0 HD3 ARG A 44 9.963 32.260 15.054 1.00 0.00 H new ATOM 0 HE ARG A 44 12.392 32.218 14.950 1.00 0.00 H new ATOM 0 HH11 ARG A 44 11.049 29.284 16.580 1.00 0.00 H new ATOM 0 HH12 ARG A 44 12.548 28.386 16.318 1.00 0.00 H new ATOM 0 HH21 ARG A 44 14.203 30.991 14.684 1.00 0.00 H new ATOM 0 HH22 ARG A 44 14.282 29.328 15.274 1.00 0.00 H new ATOM 718 N THR A 45 8.135 32.298 20.302 1.00 0.00 N ATOM 719 CA THR A 45 6.755 32.639 20.708 1.00 0.00 C ATOM 720 C THR A 45 6.700 33.732 21.818 1.00 0.00 C ATOM 721 O THR A 45 5.793 34.563 21.691 1.00 0.00 O ATOM 722 CB THR A 45 6.026 31.347 21.111 1.00 0.00 C ATOM 723 OG1 THR A 45 6.023 30.421 20.028 1.00 0.00 O ATOM 724 CG2 THR A 45 4.557 31.535 21.530 1.00 0.00 C ATOM 0 H THR A 45 8.351 31.302 20.354 1.00 0.00 H new ATOM 0 HA THR A 45 6.240 33.088 19.859 1.00 0.00 H new ATOM 0 HB THR A 45 6.582 30.986 21.976 1.00 0.00 H new ATOM 0 HG1 THR A 45 5.220 29.861 20.079 1.00 0.00 H new ATOM 0 HG21 THR A 45 4.128 30.569 21.796 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.506 32.204 22.389 1.00 0.00 H new ATOM 0 HG23 THR A 45 3.995 31.966 20.702 1.00 0.00 H new ATOM 732 N TYR A 46 7.618 33.759 22.831 1.00 0.00 N ATOM 733 CA TYR A 46 7.665 34.934 23.739 1.00 0.00 C ATOM 734 C TYR A 46 7.914 36.320 23.048 1.00 0.00 C ATOM 735 O TYR A 46 7.155 37.255 23.325 1.00 0.00 O ATOM 736 CB TYR A 46 8.654 34.686 24.893 1.00 0.00 C ATOM 737 CG TYR A 46 8.657 35.770 25.993 1.00 0.00 C ATOM 738 CD1 TYR A 46 7.606 35.867 26.914 1.00 0.00 C ATOM 739 CD2 TYR A 46 9.715 36.684 26.061 1.00 0.00 C ATOM 740 CE1 TYR A 46 7.629 36.846 27.904 1.00 0.00 C ATOM 741 CE2 TYR A 46 9.728 37.671 27.041 1.00 0.00 C ATOM 742 CZ TYR A 46 8.692 37.746 27.969 1.00 0.00 C ATOM 743 OH TYR A 46 8.734 38.696 28.955 1.00 0.00 O ATOM 0 H TYR A 46 8.296 33.023 23.029 1.00 0.00 H new ATOM 0 HA TYR A 46 6.654 35.024 24.136 1.00 0.00 H new ATOM 0 HB2 TYR A 46 8.421 33.725 25.351 1.00 0.00 H new ATOM 0 HB3 TYR A 46 9.659 34.606 24.479 1.00 0.00 H new ATOM 0 HD1 TYR A 46 6.775 35.180 26.856 1.00 0.00 H new ATOM 0 HD2 TYR A 46 10.525 36.623 25.349 1.00 0.00 H new ATOM 0 HE1 TYR A 46 6.824 36.908 28.621 1.00 0.00 H new ATOM 0 HE2 TYR A 46 10.542 38.380 27.082 1.00 0.00 H new ATOM 0 HH TYR A 46 9.544 39.238 28.852 1.00 0.00 H new ATOM 753 N GLU A 47 8.950 36.415 22.185 1.00 0.00 N ATOM 754 CA GLU A 47 9.297 37.652 21.427 1.00 0.00 C ATOM 755 C GLU A 47 8.162 38.156 20.481 1.00 0.00 C ATOM 756 O GLU A 47 8.016 39.377 20.358 1.00 0.00 O ATOM 757 CB GLU A 47 10.587 37.423 20.601 1.00 0.00 C ATOM 758 CG GLU A 47 11.889 37.225 21.414 1.00 0.00 C ATOM 759 CD GLU A 47 13.106 36.841 20.565 1.00 0.00 C ATOM 760 OE1 GLU A 47 13.004 35.918 19.725 1.00 0.00 O ATOM 761 OE2 GLU A 47 14.182 37.452 20.748 1.00 0.00 O ATOM 0 H GLU A 47 9.577 35.634 21.989 1.00 0.00 H new ATOM 0 HA GLU A 47 9.448 38.429 22.176 1.00 0.00 H new ATOM 0 HB2 GLU A 47 10.440 36.546 19.970 1.00 0.00 H new ATOM 0 HB3 GLU A 47 10.724 38.275 19.935 1.00 0.00 H new ATOM 0 HG2 GLU A 47 12.112 38.146 21.953 1.00 0.00 H new ATOM 0 HG3 GLU A 47 11.723 36.450 22.162 1.00 0.00 H new ATOM 768 N SER A 48 7.394 37.225 19.857 1.00 0.00 N ATOM 769 CA SER A 48 6.207 37.578 19.050 1.00 0.00 C ATOM 770 C SER A 48 4.898 37.962 19.796 1.00 0.00 C ATOM 771 O SER A 48 3.952 38.373 19.110 1.00 0.00 O ATOM 772 CB SER A 48 5.984 36.452 18.041 1.00 0.00 C ATOM 773 OG SER A 48 5.528 35.248 18.650 1.00 0.00 O ATOM 0 H SER A 48 7.580 36.223 19.901 1.00 0.00 H new ATOM 0 HA SER A 48 6.448 38.528 18.573 1.00 0.00 H new ATOM 0 HB2 SER A 48 5.256 36.776 17.297 1.00 0.00 H new ATOM 0 HB3 SER A 48 6.916 36.255 17.511 1.00 0.00 H new ATOM 0 HG SER A 48 5.742 35.264 19.606 1.00 0.00 H new ATOM 779 N PHE A 49 4.845 37.935 21.158 1.00 0.00 N ATOM 780 CA PHE A 49 3.730 38.514 21.944 1.00 0.00 C ATOM 781 C PHE A 49 3.809 40.077 21.935 1.00 0.00 C ATOM 782 O PHE A 49 4.875 40.568 22.334 1.00 0.00 O ATOM 783 CB PHE A 49 3.666 38.011 23.415 1.00 0.00 C ATOM 784 CG PHE A 49 3.406 36.510 23.634 1.00 0.00 C ATOM 785 CD1 PHE A 49 2.423 35.825 22.908 1.00 0.00 C ATOM 786 CD2 PHE A 49 4.125 35.825 24.617 1.00 0.00 C ATOM 787 CE1 PHE A 49 2.178 34.481 23.148 1.00 0.00 C ATOM 788 CE2 PHE A 49 3.849 34.489 24.883 1.00 0.00 C ATOM 789 CZ PHE A 49 2.875 33.820 24.145 1.00 0.00 C ATOM 0 H PHE A 49 5.573 37.512 21.734 1.00 0.00 H new ATOM 0 HA PHE A 49 2.818 38.173 21.454 1.00 0.00 H new ATOM 0 HB2 PHE A 49 4.608 38.265 23.900 1.00 0.00 H new ATOM 0 HB3 PHE A 49 2.883 38.568 23.929 1.00 0.00 H new ATOM 0 HD1 PHE A 49 1.851 36.348 22.155 1.00 0.00 H new ATOM 0 HD2 PHE A 49 4.898 36.336 25.172 1.00 0.00 H new ATOM 0 HE1 PHE A 49 1.445 33.951 22.558 1.00 0.00 H new ATOM 0 HE2 PHE A 49 4.389 33.970 25.661 1.00 0.00 H new ATOM 0 HZ PHE A 49 2.663 32.781 24.351 1.00 0.00 H new ATOM 799 N PRO A 50 2.775 40.887 21.523 1.00 0.00 N ATOM 800 CA PRO A 50 2.829 42.384 21.550 1.00 0.00 C ATOM 801 C PRO A 50 3.319 43.084 22.853 1.00 0.00 C ATOM 802 O PRO A 50 4.218 43.928 22.767 1.00 0.00 O ATOM 803 CB PRO A 50 1.412 42.810 21.141 1.00 0.00 C ATOM 804 CG PRO A 50 0.877 41.638 20.320 1.00 0.00 C ATOM 805 CD PRO A 50 1.492 40.400 20.974 1.00 0.00 C ATOM 0 HA PRO A 50 3.617 42.717 20.875 1.00 0.00 H new ATOM 0 HB2 PRO A 50 0.788 42.999 22.014 1.00 0.00 H new ATOM 0 HB3 PRO A 50 1.428 43.729 20.555 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -0.212 41.600 20.345 1.00 0.00 H new ATOM 0 HG3 PRO A 50 1.169 41.720 19.273 1.00 0.00 H new ATOM 0 HD2 PRO A 50 0.848 40.001 21.758 1.00 0.00 H new ATOM 0 HD3 PRO A 50 1.646 39.600 20.249 1.00 0.00 H new ATOM 813 N LYS A 51 2.760 42.680 24.018 1.00 0.00 N ATOM 814 CA LYS A 51 3.281 43.016 25.347 1.00 0.00 C ATOM 815 C LYS A 51 4.197 41.837 25.782 1.00 0.00 C ATOM 816 O LYS A 51 3.870 40.656 25.597 1.00 0.00 O ATOM 817 CB LYS A 51 2.069 43.251 26.283 1.00 0.00 C ATOM 818 CG LYS A 51 2.502 43.888 27.609 1.00 0.00 C ATOM 819 CD LYS A 51 1.319 44.213 28.542 1.00 0.00 C ATOM 820 CE LYS A 51 1.767 44.578 29.969 1.00 0.00 C ATOM 821 NZ LYS A 51 0.622 44.948 30.819 1.00 0.00 N ATOM 0 H LYS A 51 1.920 42.102 24.052 1.00 0.00 H new ATOM 0 HA LYS A 51 3.879 43.927 25.371 1.00 0.00 H new ATOM 0 HB2 LYS A 51 1.344 43.896 25.787 1.00 0.00 H new ATOM 0 HB3 LYS A 51 1.569 42.302 26.479 1.00 0.00 H new ATOM 0 HG2 LYS A 51 3.186 43.213 28.123 1.00 0.00 H new ATOM 0 HG3 LYS A 51 3.055 44.804 27.401 1.00 0.00 H new ATOM 0 HD2 LYS A 51 0.748 45.041 28.122 1.00 0.00 H new ATOM 0 HD3 LYS A 51 0.649 43.354 28.585 1.00 0.00 H new ATOM 0 HE2 LYS A 51 2.293 43.733 30.413 1.00 0.00 H new ATOM 0 HE3 LYS A 51 2.474 45.407 29.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 0.873 44.810 31.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 0.378 45.946 30.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -0.195 44.350 30.581 1.00 0.00 H new ATOM 835 N ARG A 52 5.318 42.229 26.406 1.00 0.00 N ATOM 836 CA ARG A 52 6.392 41.297 26.806 1.00 0.00 C ATOM 837 C ARG A 52 6.776 41.716 28.264 1.00 0.00 C ATOM 838 O ARG A 52 7.372 42.798 28.394 1.00 0.00 O ATOM 839 CB ARG A 52 7.603 41.399 25.858 1.00 0.00 C ATOM 840 CG ARG A 52 7.504 40.514 24.594 1.00 0.00 C ATOM 841 CD ARG A 52 8.390 40.967 23.417 1.00 0.00 C ATOM 842 NE ARG A 52 7.731 41.997 22.569 1.00 0.00 N ATOM 843 CZ ARG A 52 8.059 43.304 22.535 1.00 0.00 C ATOM 844 NH1 ARG A 52 9.016 43.856 23.277 1.00 0.00 N ATOM 845 NH2 ARG A 52 7.386 44.088 21.712 1.00 0.00 N ATOM 0 H ARG A 52 5.509 43.201 26.649 1.00 0.00 H new ATOM 0 HA ARG A 52 6.065 40.258 26.757 1.00 0.00 H new ATOM 0 HB2 ARG A 52 7.721 42.438 25.550 1.00 0.00 H new ATOM 0 HB3 ARG A 52 8.503 41.125 26.408 1.00 0.00 H new ATOM 0 HG2 ARG A 52 7.773 39.492 24.861 1.00 0.00 H new ATOM 0 HG3 ARG A 52 6.466 40.494 24.262 1.00 0.00 H new ATOM 0 HD2 ARG A 52 9.327 41.366 23.805 1.00 0.00 H new ATOM 0 HD3 ARG A 52 8.642 40.103 22.803 1.00 0.00 H new ATOM 0 HE ARG A 52 6.969 41.689 21.964 1.00 0.00 H new ATOM 0 HH11 ARG A 52 9.555 43.281 23.924 1.00 0.00 H new ATOM 0 HH12 ARG A 52 9.210 44.854 23.199 1.00 0.00 H new ATOM 0 HH21 ARG A 52 6.645 43.699 21.129 1.00 0.00 H new ATOM 0 HH22 ARG A 52 7.607 45.082 21.660 1.00 0.00 H new ATOM 859 N PRO A 53 6.490 40.943 29.364 1.00 0.00 N ATOM 860 CA PRO A 53 5.511 39.811 29.427 1.00 0.00 C ATOM 861 C PRO A 53 4.051 40.320 29.282 1.00 0.00 C ATOM 862 O PRO A 53 3.721 41.434 29.711 1.00 0.00 O ATOM 863 CB PRO A 53 5.816 39.184 30.784 1.00 0.00 C ATOM 864 CG PRO A 53 6.346 40.324 31.656 1.00 0.00 C ATOM 865 CD PRO A 53 7.077 41.246 30.679 1.00 0.00 C ATOM 0 HA PRO A 53 5.604 39.088 28.617 1.00 0.00 H new ATOM 0 HB2 PRO A 53 4.921 38.740 31.221 1.00 0.00 H new ATOM 0 HB3 PRO A 53 6.554 38.387 30.690 1.00 0.00 H new ATOM 0 HG2 PRO A 53 5.534 40.846 32.163 1.00 0.00 H new ATOM 0 HG3 PRO A 53 7.018 39.952 32.430 1.00 0.00 H new ATOM 0 HD2 PRO A 53 6.935 42.294 30.943 1.00 0.00 H new ATOM 0 HD3 PRO A 53 8.151 41.058 30.686 1.00 0.00 H new ATOM 873 N LEU A 54 3.194 39.423 28.780 1.00 0.00 N ATOM 874 CA LEU A 54 1.732 39.476 29.007 1.00 0.00 C ATOM 875 C LEU A 54 1.362 39.193 30.527 1.00 0.00 C ATOM 876 O LEU A 54 1.940 38.243 31.071 1.00 0.00 O ATOM 877 CB LEU A 54 0.886 38.660 27.977 1.00 0.00 C ATOM 878 CG LEU A 54 1.005 37.112 27.933 1.00 0.00 C ATOM 879 CD1 LEU A 54 -0.101 36.522 27.041 1.00 0.00 C ATOM 880 CD2 LEU A 54 2.370 36.638 27.414 1.00 0.00 C ATOM 0 H LEU A 54 3.489 38.635 28.203 1.00 0.00 H new ATOM 0 HA LEU A 54 1.434 40.505 28.806 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.162 38.900 28.154 1.00 0.00 H new ATOM 0 HB3 LEU A 54 1.135 39.033 26.984 1.00 0.00 H new ATOM 0 HG LEU A 54 0.897 36.761 28.959 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.009 35.436 27.017 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.077 36.794 27.443 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.002 36.917 26.030 1.00 0.00 H new ATOM 0 HD21 LEU A 54 2.397 35.548 27.405 1.00 0.00 H new ATOM 0 HD22 LEU A 54 2.525 37.014 26.403 1.00 0.00 H new ATOM 0 HD23 LEU A 54 3.158 37.015 28.066 1.00 0.00 H new ATOM 892 N PRO A 55 0.494 39.986 31.219 1.00 0.00 N ATOM 893 CA PRO A 55 0.440 40.066 32.708 1.00 0.00 C ATOM 894 C PRO A 55 -0.326 38.914 33.402 1.00 0.00 C ATOM 895 O PRO A 55 -0.919 38.054 32.739 1.00 0.00 O ATOM 896 CB PRO A 55 -0.163 41.481 32.902 1.00 0.00 C ATOM 897 CG PRO A 55 -1.091 41.681 31.708 1.00 0.00 C ATOM 898 CD PRO A 55 -0.296 41.040 30.575 1.00 0.00 C ATOM 0 HA PRO A 55 1.408 39.935 33.192 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -0.709 41.552 33.843 1.00 0.00 H new ATOM 0 HB3 PRO A 55 0.617 42.242 32.928 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -2.055 41.195 31.855 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -1.291 42.736 31.520 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -0.957 40.628 29.812 1.00 0.00 H new ATOM 0 HD3 PRO A 55 0.346 41.769 30.081 1.00 0.00 H new ATOM 906 N GLU A 56 -0.361 38.959 34.765 1.00 0.00 N ATOM 907 CA GLU A 56 -1.320 38.180 35.630 1.00 0.00 C ATOM 908 C GLU A 56 -1.026 36.661 35.746 1.00 0.00 C ATOM 909 O GLU A 56 -1.732 35.945 36.472 1.00 0.00 O ATOM 910 CB GLU A 56 -2.837 38.437 35.339 1.00 0.00 C ATOM 911 CG GLU A 56 -3.328 39.904 35.390 1.00 0.00 C ATOM 912 CD GLU A 56 -4.777 40.066 34.910 1.00 0.00 C ATOM 913 OE1 GLU A 56 -5.001 40.161 33.683 1.00 0.00 O ATOM 914 OE2 GLU A 56 -5.697 40.094 35.758 1.00 0.00 O ATOM 0 H GLU A 56 0.278 39.540 35.307 1.00 0.00 H new ATOM 0 HA GLU A 56 -1.114 38.608 36.611 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -3.063 38.039 34.350 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -3.421 37.860 36.056 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -3.246 40.274 36.412 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -2.675 40.522 34.774 1.00 0.00 H new ATOM 921 N ARG A 57 0.031 36.191 35.062 1.00 0.00 N ATOM 922 CA ARG A 57 0.409 34.764 34.977 1.00 0.00 C ATOM 923 C ARG A 57 1.919 34.813 35.330 1.00 0.00 C ATOM 924 O ARG A 57 2.575 35.870 35.294 1.00 0.00 O ATOM 925 CB ARG A 57 -0.074 34.171 33.590 1.00 0.00 C ATOM 926 CG ARG A 57 0.611 34.701 32.307 1.00 0.00 C ATOM 927 CD ARG A 57 -0.270 34.616 31.042 1.00 0.00 C ATOM 928 NE ARG A 57 -1.324 35.664 31.046 1.00 0.00 N ATOM 929 CZ ARG A 57 -2.268 35.813 30.103 1.00 0.00 C ATOM 930 NH1 ARG A 57 -2.433 34.983 29.077 1.00 0.00 N ATOM 931 NH2 ARG A 57 -3.081 36.848 30.202 1.00 0.00 N ATOM 0 H ARG A 57 0.661 36.802 34.542 1.00 0.00 H new ATOM 0 HA ARG A 57 -0.063 34.052 35.653 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.062 33.090 33.621 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -1.145 34.356 33.500 1.00 0.00 H new ATOM 0 HG2 ARG A 57 0.902 35.740 32.465 1.00 0.00 H new ATOM 0 HG3 ARG A 57 1.528 34.136 32.137 1.00 0.00 H new ATOM 0 HD2 ARG A 57 0.353 34.727 30.154 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -0.734 33.631 30.985 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.331 36.321 31.826 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -1.821 34.174 28.972 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.172 35.155 28.395 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -2.980 37.503 30.977 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -3.810 36.993 29.503 1.00 0.00 H new ATOM 945 N THR A 58 2.499 33.628 35.565 1.00 0.00 N ATOM 946 CA THR A 58 3.955 33.438 35.412 1.00 0.00 C ATOM 947 C THR A 58 4.215 33.136 33.910 1.00 0.00 C ATOM 948 O THR A 58 3.662 32.164 33.390 1.00 0.00 O ATOM 949 CB THR A 58 4.469 32.376 36.411 1.00 0.00 C ATOM 950 OG1 THR A 58 4.050 32.696 37.735 1.00 0.00 O ATOM 951 CG2 THR A 58 6.006 32.291 36.433 1.00 0.00 C ATOM 0 H THR A 58 1.992 32.793 35.859 1.00 0.00 H new ATOM 0 HA THR A 58 4.530 34.328 35.668 1.00 0.00 H new ATOM 0 HB THR A 58 4.055 31.423 36.080 1.00 0.00 H new ATOM 0 HG1 THR A 58 4.381 32.014 38.357 1.00 0.00 H new ATOM 0 HG21 THR A 58 6.318 31.531 37.150 1.00 0.00 H new ATOM 0 HG22 THR A 58 6.370 32.025 35.441 1.00 0.00 H new ATOM 0 HG23 THR A 58 6.420 33.256 36.724 1.00 0.00 H new ATOM 959 N ASN A 59 5.083 33.950 33.272 1.00 0.00 N ATOM 960 CA ASN A 59 5.654 33.587 31.949 1.00 0.00 C ATOM 961 C ASN A 59 7.025 32.963 32.216 1.00 0.00 C ATOM 962 O ASN A 59 7.887 33.593 32.838 1.00 0.00 O ATOM 963 CB ASN A 59 5.790 34.821 31.022 1.00 0.00 C ATOM 964 CG ASN A 59 4.561 35.091 30.143 1.00 0.00 C ATOM 965 OD1 ASN A 59 4.527 34.727 28.968 1.00 0.00 O ATOM 966 ND2 ASN A 59 3.537 35.718 30.691 1.00 0.00 N ATOM 0 H ASN A 59 5.401 34.847 33.639 1.00 0.00 H new ATOM 0 HA ASN A 59 4.993 32.889 31.435 1.00 0.00 H new ATOM 0 HB2 ASN A 59 5.984 35.701 31.635 1.00 0.00 H new ATOM 0 HB3 ASN A 59 6.659 34.683 30.378 1.00 0.00 H new ATOM 0 HD21 ASN A 59 2.700 35.908 30.139 1.00 0.00 H new ATOM 0 HD22 ASN A 59 3.582 36.013 31.666 1.00 0.00 H new ATOM 973 N VAL A 60 7.186 31.738 31.709 1.00 0.00 N ATOM 974 CA VAL A 60 8.459 30.986 31.789 1.00 0.00 C ATOM 975 C VAL A 60 8.831 30.900 30.284 1.00 0.00 C ATOM 976 O VAL A 60 8.046 30.460 29.430 1.00 0.00 O ATOM 977 CB VAL A 60 8.323 29.578 32.457 1.00 0.00 C ATOM 978 CG1 VAL A 60 9.656 28.801 32.504 1.00 0.00 C ATOM 979 CG2 VAL A 60 7.742 29.586 33.888 1.00 0.00 C ATOM 0 H VAL A 60 6.442 31.232 31.229 1.00 0.00 H new ATOM 0 HA VAL A 60 9.209 31.461 32.422 1.00 0.00 H new ATOM 0 HB VAL A 60 7.611 29.080 31.800 1.00 0.00 H new ATOM 0 HG11 VAL A 60 9.496 27.833 32.979 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.026 28.651 31.490 1.00 0.00 H new ATOM 0 HG13 VAL A 60 10.388 29.369 33.077 1.00 0.00 H new ATOM 0 HG21 VAL A 60 7.687 28.564 34.264 1.00 0.00 H new ATOM 0 HG22 VAL A 60 8.385 30.178 34.539 1.00 0.00 H new ATOM 0 HG23 VAL A 60 6.743 30.021 33.873 1.00 0.00 H new ATOM 989 N VAL A 61 10.089 31.257 30.037 1.00 0.00 N ATOM 990 CA VAL A 61 10.638 31.419 28.673 1.00 0.00 C ATOM 991 C VAL A 61 11.791 30.386 28.709 1.00 0.00 C ATOM 992 O VAL A 61 12.749 30.521 29.485 1.00 0.00 O ATOM 993 CB VAL A 61 11.128 32.880 28.374 1.00 0.00 C ATOM 994 CG1 VAL A 61 11.623 33.025 26.921 1.00 0.00 C ATOM 995 CG2 VAL A 61 10.057 33.961 28.625 1.00 0.00 C ATOM 0 H VAL A 61 10.768 31.445 30.774 1.00 0.00 H new ATOM 0 HA VAL A 61 9.913 31.256 27.875 1.00 0.00 H new ATOM 0 HB VAL A 61 11.945 33.042 29.077 1.00 0.00 H new ATOM 0 HG11 VAL A 61 11.954 34.049 26.750 1.00 0.00 H new ATOM 0 HG12 VAL A 61 12.454 32.341 26.750 1.00 0.00 H new ATOM 0 HG13 VAL A 61 10.811 32.787 26.234 1.00 0.00 H new ATOM 0 HG21 VAL A 61 10.471 34.943 28.396 1.00 0.00 H new ATOM 0 HG22 VAL A 61 9.194 33.773 27.986 1.00 0.00 H new ATOM 0 HG23 VAL A 61 9.748 33.932 29.670 1.00 0.00 H new ATOM 1005 N LEU A 62 11.685 29.424 27.787 1.00 0.00 N ATOM 1006 CA LEU A 62 12.755 28.448 27.510 1.00 0.00 C ATOM 1007 C LEU A 62 13.642 28.978 26.362 1.00 0.00 C ATOM 1008 O LEU A 62 13.119 29.292 25.286 1.00 0.00 O ATOM 1009 CB LEU A 62 12.132 27.055 27.145 1.00 0.00 C ATOM 1010 CG LEU A 62 11.930 26.061 28.314 1.00 0.00 C ATOM 1011 CD1 LEU A 62 11.083 24.867 27.854 1.00 0.00 C ATOM 1012 CD2 LEU A 62 13.264 25.535 28.875 1.00 0.00 C ATOM 0 H LEU A 62 10.855 29.296 27.208 1.00 0.00 H new ATOM 0 HA LEU A 62 13.373 28.316 28.398 1.00 0.00 H new ATOM 0 HB2 LEU A 62 11.165 27.227 26.673 1.00 0.00 H new ATOM 0 HB3 LEU A 62 12.771 26.580 26.400 1.00 0.00 H new ATOM 0 HG LEU A 62 11.420 26.609 29.106 1.00 0.00 H new ATOM 0 HD11 LEU A 62 10.948 24.175 28.685 1.00 0.00 H new ATOM 0 HD12 LEU A 62 10.109 25.221 27.515 1.00 0.00 H new ATOM 0 HD13 LEU A 62 11.589 24.356 27.035 1.00 0.00 H new ATOM 0 HD21 LEU A 62 13.067 24.842 29.693 1.00 0.00 H new ATOM 0 HD22 LEU A 62 13.812 25.020 28.086 1.00 0.00 H new ATOM 0 HD23 LEU A 62 13.859 26.371 29.244 1.00 0.00 H new ATOM 1024 N THR A 63 14.968 29.058 26.610 1.00 0.00 N ATOM 1025 CA THR A 63 15.956 29.703 25.678 1.00 0.00 C ATOM 1026 C THR A 63 17.275 28.892 25.859 1.00 0.00 C ATOM 1027 O THR A 63 17.631 28.652 27.022 1.00 0.00 O ATOM 1028 CB THR A 63 16.123 31.246 25.977 1.00 0.00 C ATOM 1029 OG1 THR A 63 16.971 31.847 25.005 1.00 0.00 O ATOM 1030 CG2 THR A 63 16.658 31.606 27.377 1.00 0.00 C ATOM 0 H THR A 63 15.396 28.682 27.456 1.00 0.00 H new ATOM 0 HA THR A 63 15.625 29.673 24.640 1.00 0.00 H new ATOM 0 HB THR A 63 15.106 31.635 25.933 1.00 0.00 H new ATOM 0 HG1 THR A 63 17.066 32.803 25.200 1.00 0.00 H new ATOM 0 HG21 THR A 63 16.732 32.689 27.471 1.00 0.00 H new ATOM 0 HG22 THR A 63 15.977 31.222 28.137 1.00 0.00 H new ATOM 0 HG23 THR A 63 17.644 31.162 27.515 1.00 0.00 H new ATOM 1038 N HIS A 64 18.056 28.573 24.807 1.00 0.00 N ATOM 1039 CA HIS A 64 19.469 28.097 25.046 1.00 0.00 C ATOM 1040 C HIS A 64 20.509 29.238 25.265 1.00 0.00 C ATOM 1041 O HIS A 64 21.658 28.934 25.614 1.00 0.00 O ATOM 1042 CB HIS A 64 19.943 27.183 23.903 1.00 0.00 C ATOM 1043 CG HIS A 64 19.196 25.848 23.793 1.00 0.00 C ATOM 1044 ND1 HIS A 64 19.456 24.733 24.579 1.00 0.00 N ATOM 1045 CD2 HIS A 64 18.153 25.566 22.889 1.00 0.00 C ATOM 1046 CE1 HIS A 64 18.527 23.861 24.075 1.00 0.00 C ATOM 1047 NE2 HIS A 64 17.701 24.268 23.061 1.00 0.00 N ATOM 0 H HIS A 64 17.771 28.625 23.829 1.00 0.00 H new ATOM 0 HA HIS A 64 19.421 27.540 25.982 1.00 0.00 H new ATOM 0 HB2 HIS A 64 19.838 27.720 22.960 1.00 0.00 H new ATOM 0 HB3 HIS A 64 21.005 26.979 24.037 1.00 0.00 H new ATOM 0 HD2 HIS A 64 17.761 26.264 22.164 1.00 0.00 H new ATOM 0 HE1 HIS A 64 18.447 22.861 24.474 1.00 0.00 H new ATOM 0 HE2 HIS A 64 16.964 23.760 22.572 1.00 0.00 H new ATOM 1056 N GLN A 65 20.105 30.526 25.120 1.00 0.00 N ATOM 1057 CA GLN A 65 21.002 31.705 25.266 1.00 0.00 C ATOM 1058 C GLN A 65 21.180 31.940 26.796 1.00 0.00 C ATOM 1059 O GLN A 65 20.253 32.430 27.455 1.00 0.00 O ATOM 1060 CB GLN A 65 20.422 32.955 24.529 1.00 0.00 C ATOM 1061 CG GLN A 65 20.475 32.918 22.986 1.00 0.00 C ATOM 1062 CD GLN A 65 20.071 34.254 22.340 1.00 0.00 C ATOM 1063 OE1 GLN A 65 20.919 35.067 21.973 1.00 0.00 O ATOM 1064 NE2 GLN A 65 18.782 34.515 22.189 1.00 0.00 N ATOM 0 H GLN A 65 19.142 30.779 24.897 1.00 0.00 H new ATOM 0 HA GLN A 65 21.971 31.526 24.801 1.00 0.00 H new ATOM 0 HB2 GLN A 65 19.383 33.082 24.834 1.00 0.00 H new ATOM 0 HB3 GLN A 65 20.964 33.837 24.870 1.00 0.00 H new ATOM 0 HG2 GLN A 65 21.485 32.658 22.669 1.00 0.00 H new ATOM 0 HG3 GLN A 65 19.814 32.131 22.624 1.00 0.00 H new ATOM 0 HE21 GLN A 65 18.085 33.836 22.496 1.00 0.00 H new ATOM 0 HE22 GLN A 65 18.486 35.395 21.766 1.00 0.00 H new ATOM 1073 N GLU A 66 22.354 31.547 27.359 1.00 0.00 N ATOM 1074 CA GLU A 66 22.709 31.755 28.823 1.00 0.00 C ATOM 1075 C GLU A 66 22.415 33.192 29.400 1.00 0.00 C ATOM 1076 O GLU A 66 21.960 33.319 30.541 1.00 0.00 O ATOM 1077 CB GLU A 66 24.209 31.415 29.107 1.00 0.00 C ATOM 1078 CG GLU A 66 24.595 29.927 28.936 1.00 0.00 C ATOM 1079 CD GLU A 66 26.070 29.653 29.247 1.00 0.00 C ATOM 1080 OE1 GLU A 66 26.910 29.740 28.324 1.00 0.00 O ATOM 1081 OE2 GLU A 66 26.396 29.349 30.416 1.00 0.00 O ATOM 0 H GLU A 66 23.089 31.078 26.829 1.00 0.00 H new ATOM 0 HA GLU A 66 22.041 31.064 29.337 1.00 0.00 H new ATOM 0 HB2 GLU A 66 24.832 32.013 28.442 1.00 0.00 H new ATOM 0 HB3 GLU A 66 24.447 31.720 30.126 1.00 0.00 H new ATOM 0 HG2 GLU A 66 23.972 29.318 29.591 1.00 0.00 H new ATOM 0 HG3 GLU A 66 24.381 29.617 27.913 1.00 0.00 H new ATOM 1088 N ASP A 67 22.705 34.214 28.573 1.00 0.00 N ATOM 1089 CA ASP A 67 22.574 35.651 28.873 1.00 0.00 C ATOM 1090 C ASP A 67 21.194 36.280 28.614 1.00 0.00 C ATOM 1091 O ASP A 67 21.041 37.463 28.956 1.00 0.00 O ATOM 1092 CB ASP A 67 23.667 36.406 28.077 1.00 0.00 C ATOM 1093 CG ASP A 67 25.110 36.141 28.543 1.00 0.00 C ATOM 1094 OD1 ASP A 67 25.530 36.720 29.569 1.00 0.00 O ATOM 1095 OD2 ASP A 67 25.824 35.353 27.884 1.00 0.00 O ATOM 0 H ASP A 67 23.055 34.050 27.629 1.00 0.00 H new ATOM 0 HA ASP A 67 22.699 35.747 29.952 1.00 0.00 H new ATOM 0 HB2 ASP A 67 23.584 36.132 27.025 1.00 0.00 H new ATOM 0 HB3 ASP A 67 23.470 37.476 28.144 1.00 0.00 H new ATOM 1100 N TYR A 68 20.187 35.551 28.066 1.00 0.00 N ATOM 1101 CA TYR A 68 18.929 36.172 27.591 1.00 0.00 C ATOM 1102 C TYR A 68 18.148 36.863 28.733 1.00 0.00 C ATOM 1103 O TYR A 68 18.032 36.314 29.835 1.00 0.00 O ATOM 1104 CB TYR A 68 18.059 35.090 26.937 1.00 0.00 C ATOM 1105 CG TYR A 68 16.749 35.559 26.270 1.00 0.00 C ATOM 1106 CD1 TYR A 68 16.760 36.091 24.975 1.00 0.00 C ATOM 1107 CD2 TYR A 68 15.536 35.474 26.965 1.00 0.00 C ATOM 1108 CE1 TYR A 68 15.577 36.533 24.387 1.00 0.00 C ATOM 1109 CE2 TYR A 68 14.355 35.913 26.374 1.00 0.00 C ATOM 1110 CZ TYR A 68 14.374 36.440 25.085 1.00 0.00 C ATOM 1111 OH TYR A 68 13.207 36.859 24.503 1.00 0.00 O ATOM 0 H TYR A 68 20.224 34.539 27.944 1.00 0.00 H new ATOM 0 HA TYR A 68 19.183 36.946 26.867 1.00 0.00 H new ATOM 0 HB2 TYR A 68 18.660 34.580 26.184 1.00 0.00 H new ATOM 0 HB3 TYR A 68 17.807 34.351 27.698 1.00 0.00 H new ATOM 0 HD1 TYR A 68 17.690 36.159 24.430 1.00 0.00 H new ATOM 0 HD2 TYR A 68 15.517 35.066 27.965 1.00 0.00 H new ATOM 0 HE1 TYR A 68 15.592 36.948 23.390 1.00 0.00 H new ATOM 0 HE2 TYR A 68 13.423 35.845 26.915 1.00 0.00 H new ATOM 0 HH TYR A 68 12.459 36.331 24.852 1.00 0.00 H new ATOM 1121 N GLN A 69 17.653 38.059 28.394 1.00 0.00 N ATOM 1122 CA GLN A 69 17.061 38.969 29.380 1.00 0.00 C ATOM 1123 C GLN A 69 15.605 39.128 28.998 1.00 0.00 C ATOM 1124 O GLN A 69 15.265 39.579 27.894 1.00 0.00 O ATOM 1125 CB GLN A 69 17.760 40.346 29.416 1.00 0.00 C ATOM 1126 CG GLN A 69 19.217 40.395 29.938 1.00 0.00 C ATOM 1127 CD GLN A 69 19.388 40.017 31.421 1.00 0.00 C ATOM 1128 OE1 GLN A 69 19.045 40.786 32.319 1.00 0.00 O ATOM 1129 NE2 GLN A 69 19.920 38.839 31.711 1.00 0.00 N ATOM 0 H GLN A 69 17.651 38.420 27.440 1.00 0.00 H new ATOM 0 HA GLN A 69 17.178 38.552 30.380 1.00 0.00 H new ATOM 0 HB2 GLN A 69 17.751 40.754 28.405 1.00 0.00 H new ATOM 0 HB3 GLN A 69 17.159 41.012 30.034 1.00 0.00 H new ATOM 0 HG2 GLN A 69 19.827 39.723 29.334 1.00 0.00 H new ATOM 0 HG3 GLN A 69 19.608 41.401 29.787 1.00 0.00 H new ATOM 0 HE21 GLN A 69 20.201 38.208 30.961 1.00 0.00 H new ATOM 0 HE22 GLN A 69 20.048 38.563 32.685 1.00 0.00 H new ATOM 1138 N ALA A 70 14.768 38.754 29.976 1.00 0.00 N ATOM 1139 CA ALA A 70 13.330 39.049 29.943 1.00 0.00 C ATOM 1140 C ALA A 70 12.984 39.418 31.388 1.00 0.00 C ATOM 1141 O ALA A 70 12.969 38.558 32.278 1.00 0.00 O ATOM 1142 CB ALA A 70 12.538 37.858 29.395 1.00 0.00 C ATOM 0 H ALA A 70 15.067 38.242 30.806 1.00 0.00 H new ATOM 0 HA ALA A 70 13.069 39.865 29.270 1.00 0.00 H new ATOM 0 HB1 ALA A 70 11.476 38.103 29.381 1.00 0.00 H new ATOM 0 HB2 ALA A 70 12.872 37.634 28.382 1.00 0.00 H new ATOM 0 HB3 ALA A 70 12.702 36.988 30.031 1.00 0.00 H new ATOM 1148 N GLN A 71 12.748 40.730 31.593 1.00 0.00 N ATOM 1149 CA GLN A 71 12.483 41.329 32.933 1.00 0.00 C ATOM 1150 C GLN A 71 11.020 41.053 33.317 1.00 0.00 C ATOM 1151 O GLN A 71 10.114 41.328 32.515 1.00 0.00 O ATOM 1152 CB GLN A 71 12.697 42.859 32.936 1.00 0.00 C ATOM 1153 CG GLN A 71 14.171 43.316 32.831 1.00 0.00 C ATOM 1154 CD GLN A 71 14.331 44.845 32.850 1.00 0.00 C ATOM 1155 OE1 GLN A 71 14.189 45.514 31.826 1.00 0.00 O ATOM 1156 NE2 GLN A 71 14.629 45.429 34.001 1.00 0.00 N ATOM 0 H GLN A 71 12.734 41.413 30.836 1.00 0.00 H new ATOM 0 HA GLN A 71 13.179 40.881 33.642 1.00 0.00 H new ATOM 0 HB2 GLN A 71 12.139 43.290 32.104 1.00 0.00 H new ATOM 0 HB3 GLN A 71 12.270 43.268 33.852 1.00 0.00 H new ATOM 0 HG2 GLN A 71 14.738 42.887 33.657 1.00 0.00 H new ATOM 0 HG3 GLN A 71 14.602 42.923 31.910 1.00 0.00 H new ATOM 0 HE21 GLN A 71 14.745 44.866 34.844 1.00 0.00 H new ATOM 0 HE22 GLN A 71 14.743 46.442 34.045 1.00 0.00 H new ATOM 1165 N GLY A 72 10.827 40.498 34.525 1.00 0.00 N ATOM 1166 CA GLY A 72 9.493 39.976 34.890 1.00 0.00 C ATOM 1167 C GLY A 72 9.131 38.530 34.458 1.00 0.00 C ATOM 1168 O GLY A 72 8.187 38.005 35.059 1.00 0.00 O ATOM 0 H GLY A 72 11.545 40.399 35.243 1.00 0.00 H new ATOM 0 HA2 GLY A 72 9.397 40.034 35.974 1.00 0.00 H new ATOM 0 HA3 GLY A 72 8.745 40.647 34.468 1.00 0.00 H new ATOM 1172 N ALA A 73 9.824 37.897 33.473 1.00 0.00 N ATOM 1173 CA ALA A 73 9.620 36.465 33.122 1.00 0.00 C ATOM 1174 C ALA A 73 10.720 35.584 33.800 1.00 0.00 C ATOM 1175 O ALA A 73 11.786 36.074 34.197 1.00 0.00 O ATOM 1176 CB ALA A 73 9.652 36.345 31.587 1.00 0.00 C ATOM 0 H ALA A 73 10.533 38.360 32.905 1.00 0.00 H new ATOM 0 HA ALA A 73 8.658 36.107 33.488 1.00 0.00 H new ATOM 0 HB1 ALA A 73 9.505 35.304 31.300 1.00 0.00 H new ATOM 0 HB2 ALA A 73 8.858 36.955 31.158 1.00 0.00 H new ATOM 0 HB3 ALA A 73 10.616 36.691 31.215 1.00 0.00 H new ATOM 1182 N VAL A 74 10.439 34.265 33.905 1.00 0.00 N ATOM 1183 CA VAL A 74 11.302 33.235 34.539 1.00 0.00 C ATOM 1184 C VAL A 74 12.022 32.626 33.305 1.00 0.00 C ATOM 1185 O VAL A 74 11.420 31.922 32.495 1.00 0.00 O ATOM 1186 CB VAL A 74 10.448 32.222 35.387 1.00 0.00 C ATOM 1187 CG1 VAL A 74 11.245 30.993 35.879 1.00 0.00 C ATOM 1188 CG2 VAL A 74 9.774 32.882 36.613 1.00 0.00 C ATOM 0 H VAL A 74 9.573 33.871 33.537 1.00 0.00 H new ATOM 0 HA VAL A 74 12.015 33.605 35.276 1.00 0.00 H new ATOM 0 HB VAL A 74 9.684 31.885 34.686 1.00 0.00 H new ATOM 0 HG11 VAL A 74 10.589 30.341 36.456 1.00 0.00 H new ATOM 0 HG12 VAL A 74 11.637 30.446 35.021 1.00 0.00 H new ATOM 0 HG13 VAL A 74 12.072 31.323 36.507 1.00 0.00 H new ATOM 0 HG21 VAL A 74 9.199 32.134 37.159 1.00 0.00 H new ATOM 0 HG22 VAL A 74 10.539 33.300 37.267 1.00 0.00 H new ATOM 0 HG23 VAL A 74 9.109 33.678 36.278 1.00 0.00 H new ATOM 1198 N VAL A 75 13.321 32.896 33.228 1.00 0.00 N ATOM 1199 CA VAL A 75 14.163 32.569 32.049 1.00 0.00 C ATOM 1200 C VAL A 75 14.931 31.310 32.540 1.00 0.00 C ATOM 1201 O VAL A 75 15.709 31.384 33.501 1.00 0.00 O ATOM 1202 CB VAL A 75 15.083 33.767 31.630 1.00 0.00 C ATOM 1203 CG1 VAL A 75 16.015 33.390 30.457 1.00 0.00 C ATOM 1204 CG2 VAL A 75 14.305 35.039 31.221 1.00 0.00 C ATOM 0 H VAL A 75 13.837 33.352 33.981 1.00 0.00 H new ATOM 0 HA VAL A 75 13.604 32.379 31.133 1.00 0.00 H new ATOM 0 HB VAL A 75 15.661 33.987 32.528 1.00 0.00 H new ATOM 0 HG11 VAL A 75 16.636 34.247 30.196 1.00 0.00 H new ATOM 0 HG12 VAL A 75 16.652 32.556 30.752 1.00 0.00 H new ATOM 0 HG13 VAL A 75 15.415 33.101 29.594 1.00 0.00 H new ATOM 0 HG21 VAL A 75 15.010 35.823 30.945 1.00 0.00 H new ATOM 0 HG22 VAL A 75 13.661 34.814 30.371 1.00 0.00 H new ATOM 0 HG23 VAL A 75 13.695 35.378 32.059 1.00 0.00 H new ATOM 1214 N VAL A 76 14.727 30.209 31.808 1.00 0.00 N ATOM 1215 CA VAL A 76 15.329 28.885 32.139 1.00 0.00 C ATOM 1216 C VAL A 76 15.805 28.285 30.793 1.00 0.00 C ATOM 1217 O VAL A 76 15.405 28.704 29.695 1.00 0.00 O ATOM 1218 CB VAL A 76 14.433 27.933 33.027 1.00 0.00 C ATOM 1219 CG1 VAL A 76 14.252 28.455 34.470 1.00 0.00 C ATOM 1220 CG2 VAL A 76 13.066 27.565 32.417 1.00 0.00 C ATOM 0 H VAL A 76 14.145 30.196 30.971 1.00 0.00 H new ATOM 0 HA VAL A 76 16.175 29.015 32.814 1.00 0.00 H new ATOM 0 HB VAL A 76 15.009 27.008 33.058 1.00 0.00 H new ATOM 0 HG11 VAL A 76 13.628 27.761 35.033 1.00 0.00 H new ATOM 0 HG12 VAL A 76 15.226 28.539 34.951 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.774 29.434 34.445 1.00 0.00 H new ATOM 0 HG21 VAL A 76 12.527 26.910 33.101 1.00 0.00 H new ATOM 0 HG22 VAL A 76 12.486 28.473 32.251 1.00 0.00 H new ATOM 0 HG23 VAL A 76 13.218 27.052 31.467 1.00 0.00 H new ATOM 1230 N HIS A 77 16.677 27.285 30.935 1.00 0.00 N ATOM 1231 CA HIS A 77 17.455 26.745 29.806 1.00 0.00 C ATOM 1232 C HIS A 77 17.165 25.313 29.401 1.00 0.00 C ATOM 1233 O HIS A 77 17.652 24.907 28.337 1.00 0.00 O ATOM 1234 CB HIS A 77 18.945 27.037 30.050 1.00 0.00 C ATOM 1235 CG HIS A 77 19.323 28.519 30.262 1.00 0.00 C ATOM 1236 ND1 HIS A 77 19.227 29.522 29.310 1.00 0.00 N ATOM 1237 CD2 HIS A 77 19.628 29.081 31.519 1.00 0.00 C ATOM 1238 CE1 HIS A 77 19.439 30.622 30.098 1.00 0.00 C ATOM 1239 NE2 HIS A 77 19.718 30.458 31.427 1.00 0.00 N ATOM 0 H HIS A 77 16.867 26.826 31.826 1.00 0.00 H new ATOM 0 HA HIS A 77 17.116 27.272 28.914 1.00 0.00 H new ATOM 0 HB2 HIS A 77 19.266 26.473 30.926 1.00 0.00 H new ATOM 0 HB3 HIS A 77 19.512 26.657 29.200 1.00 0.00 H new ATOM 0 HD1 HIS A 77 19.049 29.459 28.308 1.00 0.00 H new ATOM 0 HD2 HIS A 77 19.771 28.515 32.427 1.00 0.00 H new ATOM 0 HE1 HIS A 77 19.386 31.613 29.672 1.00 0.00 H new ATOM 1248 N ASP A 78 16.388 24.551 30.203 1.00 0.00 N ATOM 1249 CA ASP A 78 16.140 23.111 29.932 1.00 0.00 C ATOM 1250 C ASP A 78 14.791 22.780 30.609 1.00 0.00 C ATOM 1251 O ASP A 78 14.327 23.474 31.528 1.00 0.00 O ATOM 1252 CB ASP A 78 17.331 22.196 30.383 1.00 0.00 C ATOM 1253 CG ASP A 78 17.776 22.312 31.851 1.00 0.00 C ATOM 1254 OD1 ASP A 78 17.153 21.674 32.723 1.00 0.00 O ATOM 1255 OD2 ASP A 78 18.746 23.050 32.134 1.00 0.00 O ATOM 0 H ASP A 78 15.923 24.904 31.039 1.00 0.00 H new ATOM 0 HA ASP A 78 16.077 22.909 28.863 1.00 0.00 H new ATOM 0 HB2 ASP A 78 17.054 21.159 30.193 1.00 0.00 H new ATOM 0 HB3 ASP A 78 18.189 22.418 29.749 1.00 0.00 H new ATOM 1260 N VAL A 79 14.190 21.660 30.178 1.00 0.00 N ATOM 1261 CA VAL A 79 12.908 21.140 30.757 1.00 0.00 C ATOM 1262 C VAL A 79 12.994 20.841 32.307 1.00 0.00 C ATOM 1263 O VAL A 79 12.073 21.260 33.015 1.00 0.00 O ATOM 1264 CB VAL A 79 12.426 19.944 29.871 1.00 0.00 C ATOM 1265 CG1 VAL A 79 11.273 19.100 30.463 1.00 0.00 C ATOM 1266 CG2 VAL A 79 11.995 20.379 28.450 1.00 0.00 C ATOM 0 H VAL A 79 14.563 21.082 29.425 1.00 0.00 H new ATOM 0 HA VAL A 79 12.141 21.914 30.721 1.00 0.00 H new ATOM 0 HB VAL A 79 13.319 19.320 29.833 1.00 0.00 H new ATOM 0 HG11 VAL A 79 11.016 18.299 29.770 1.00 0.00 H new ATOM 0 HG12 VAL A 79 11.588 18.671 31.414 1.00 0.00 H new ATOM 0 HG13 VAL A 79 10.402 19.735 30.622 1.00 0.00 H new ATOM 0 HG21 VAL A 79 11.671 19.505 27.884 1.00 0.00 H new ATOM 0 HG22 VAL A 79 11.172 21.090 28.521 1.00 0.00 H new ATOM 0 HG23 VAL A 79 12.837 20.848 27.942 1.00 0.00 H new ATOM 1276 N ALA A 80 14.044 20.126 32.789 1.00 0.00 N ATOM 1277 CA ALA A 80 14.315 19.927 34.238 1.00 0.00 C ATOM 1278 C ALA A 80 14.341 21.189 35.149 1.00 0.00 C ATOM 1279 O ALA A 80 13.968 21.049 36.319 1.00 0.00 O ATOM 1280 CB ALA A 80 15.618 19.147 34.425 1.00 0.00 C ATOM 0 H ALA A 80 14.727 19.671 32.184 1.00 0.00 H new ATOM 0 HA ALA A 80 13.440 19.373 34.578 1.00 0.00 H new ATOM 0 HB1 ALA A 80 15.808 19.006 35.489 1.00 0.00 H new ATOM 0 HB2 ALA A 80 15.533 18.175 33.940 1.00 0.00 H new ATOM 0 HB3 ALA A 80 16.442 19.704 33.980 1.00 0.00 H new ATOM 1286 N ALA A 81 14.716 22.380 34.610 1.00 0.00 N ATOM 1287 CA ALA A 81 14.418 23.675 35.264 1.00 0.00 C ATOM 1288 C ALA A 81 12.992 24.229 35.252 1.00 0.00 C ATOM 1289 O ALA A 81 12.651 24.956 36.192 1.00 0.00 O ATOM 1290 CB ALA A 81 15.340 24.715 34.686 1.00 0.00 C ATOM 0 H ALA A 81 15.222 22.466 33.729 1.00 0.00 H new ATOM 0 HA ALA A 81 14.568 23.449 36.320 1.00 0.00 H new ATOM 0 HB1 ALA A 81 15.139 25.679 35.153 1.00 0.00 H new ATOM 0 HB2 ALA A 81 16.375 24.429 34.875 1.00 0.00 H new ATOM 0 HB3 ALA A 81 15.175 24.791 33.611 1.00 0.00 H new ATOM 1296 N VAL A 82 12.169 23.879 34.244 1.00 0.00 N ATOM 1297 CA VAL A 82 10.706 24.153 34.223 1.00 0.00 C ATOM 1298 C VAL A 82 10.008 23.328 35.336 1.00 0.00 C ATOM 1299 O VAL A 82 9.318 23.949 36.150 1.00 0.00 O ATOM 1300 CB VAL A 82 10.060 24.013 32.805 1.00 0.00 C ATOM 1301 CG1 VAL A 82 8.542 24.304 32.816 1.00 0.00 C ATOM 1302 CG2 VAL A 82 10.714 24.955 31.767 1.00 0.00 C ATOM 0 H VAL A 82 12.498 23.393 33.410 1.00 0.00 H new ATOM 0 HA VAL A 82 10.549 25.207 34.452 1.00 0.00 H new ATOM 0 HB VAL A 82 10.231 22.975 32.521 1.00 0.00 H new ATOM 0 HG11 VAL A 82 8.143 24.193 31.808 1.00 0.00 H new ATOM 0 HG12 VAL A 82 8.042 23.602 33.484 1.00 0.00 H new ATOM 0 HG13 VAL A 82 8.369 25.322 33.165 1.00 0.00 H new ATOM 0 HG21 VAL A 82 10.231 24.821 30.799 1.00 0.00 H new ATOM 0 HG22 VAL A 82 10.598 25.989 32.090 1.00 0.00 H new ATOM 0 HG23 VAL A 82 11.775 24.719 31.679 1.00 0.00 H new ATOM 1312 N PHE A 83 10.195 21.985 35.350 1.00 0.00 N ATOM 1313 CA PHE A 83 9.632 21.144 36.424 1.00 0.00 C ATOM 1314 C PHE A 83 10.180 21.453 37.842 1.00 0.00 C ATOM 1315 O PHE A 83 9.335 21.620 38.718 1.00 0.00 O ATOM 1316 CB PHE A 83 9.717 19.646 36.065 1.00 0.00 C ATOM 1317 CG PHE A 83 8.757 19.175 34.953 1.00 0.00 C ATOM 1318 CD1 PHE A 83 7.374 19.158 35.181 1.00 0.00 C ATOM 1319 CD2 PHE A 83 9.250 18.780 33.705 1.00 0.00 C ATOM 1320 CE1 PHE A 83 6.499 18.780 34.167 1.00 0.00 C ATOM 1321 CE2 PHE A 83 8.372 18.386 32.698 1.00 0.00 C ATOM 1322 CZ PHE A 83 6.999 18.401 32.926 1.00 0.00 C ATOM 0 H PHE A 83 10.722 21.473 34.642 1.00 0.00 H new ATOM 0 HA PHE A 83 8.578 21.414 36.486 1.00 0.00 H new ATOM 0 HB2 PHE A 83 10.739 19.421 35.759 1.00 0.00 H new ATOM 0 HB3 PHE A 83 9.518 19.063 36.964 1.00 0.00 H new ATOM 0 HD1 PHE A 83 6.986 19.440 36.149 1.00 0.00 H new ATOM 0 HD2 PHE A 83 10.314 18.781 33.522 1.00 0.00 H new ATOM 0 HE1 PHE A 83 5.434 18.781 34.344 1.00 0.00 H new ATOM 0 HE2 PHE A 83 8.757 18.069 31.740 1.00 0.00 H new ATOM 0 HZ PHE A 83 6.319 18.117 32.136 1.00 0.00 H new ATOM 1332 N ALA A 84 11.509 21.654 38.042 1.00 0.00 N ATOM 1333 CA ALA A 84 12.035 22.262 39.298 1.00 0.00 C ATOM 1334 C ALA A 84 11.455 23.642 39.759 1.00 0.00 C ATOM 1335 O ALA A 84 11.369 23.841 40.976 1.00 0.00 O ATOM 1336 CB ALA A 84 13.549 22.376 39.206 1.00 0.00 C ATOM 0 H ALA A 84 12.228 21.409 37.362 1.00 0.00 H new ATOM 0 HA ALA A 84 11.691 21.570 40.066 1.00 0.00 H new ATOM 0 HB1 ALA A 84 13.937 22.820 40.123 1.00 0.00 H new ATOM 0 HB2 ALA A 84 13.981 21.384 39.072 1.00 0.00 H new ATOM 0 HB3 ALA A 84 13.816 23.005 38.357 1.00 0.00 H new ATOM 1342 N TYR A 85 11.016 24.534 38.824 1.00 0.00 N ATOM 1343 CA TYR A 85 10.119 25.682 39.131 1.00 0.00 C ATOM 1344 C TYR A 85 8.657 25.259 39.517 1.00 0.00 C ATOM 1345 O TYR A 85 8.210 25.657 40.598 1.00 0.00 O ATOM 1346 CB TYR A 85 10.202 26.770 38.008 1.00 0.00 C ATOM 1347 CG TYR A 85 9.524 28.101 38.391 1.00 0.00 C ATOM 1348 CD1 TYR A 85 10.196 29.041 39.182 1.00 0.00 C ATOM 1349 CD2 TYR A 85 8.186 28.327 38.047 1.00 0.00 C ATOM 1350 CE1 TYR A 85 9.536 30.185 39.627 1.00 0.00 C ATOM 1351 CE2 TYR A 85 7.525 29.460 38.508 1.00 0.00 C ATOM 1352 CZ TYR A 85 8.202 30.395 39.288 1.00 0.00 C ATOM 1353 OH TYR A 85 7.551 31.518 39.729 1.00 0.00 O ATOM 0 H TYR A 85 11.275 24.475 37.839 1.00 0.00 H new ATOM 0 HA TYR A 85 10.490 26.148 40.044 1.00 0.00 H new ATOM 0 HB2 TYR A 85 11.249 26.959 37.773 1.00 0.00 H new ATOM 0 HB3 TYR A 85 9.737 26.382 37.102 1.00 0.00 H new ATOM 0 HD1 TYR A 85 11.230 28.879 39.448 1.00 0.00 H new ATOM 0 HD2 TYR A 85 7.665 27.618 37.421 1.00 0.00 H new ATOM 0 HE1 TYR A 85 10.059 30.908 40.235 1.00 0.00 H new ATOM 0 HE2 TYR A 85 6.485 29.616 38.261 1.00 0.00 H new ATOM 0 HH TYR A 85 6.627 31.510 39.402 1.00 0.00 H new ATOM 1363 N ALA A 86 7.956 24.474 38.662 1.00 0.00 N ATOM 1364 CA ALA A 86 6.603 23.914 38.946 1.00 0.00 C ATOM 1365 C ALA A 86 6.397 23.100 40.263 1.00 0.00 C ATOM 1366 O ALA A 86 5.325 23.182 40.869 1.00 0.00 O ATOM 1367 CB ALA A 86 6.175 23.084 37.732 1.00 0.00 C ATOM 0 H ALA A 86 8.314 24.207 37.745 1.00 0.00 H new ATOM 0 HA ALA A 86 5.974 24.786 39.123 1.00 0.00 H new ATOM 0 HB1 ALA A 86 5.187 22.661 37.911 1.00 0.00 H new ATOM 0 HB2 ALA A 86 6.142 23.722 36.849 1.00 0.00 H new ATOM 0 HB3 ALA A 86 6.891 22.278 37.571 1.00 0.00 H new ATOM 1373 N LYS A 87 7.459 22.392 40.702 1.00 0.00 N ATOM 1374 CA LYS A 87 7.621 21.774 42.055 1.00 0.00 C ATOM 1375 C LYS A 87 7.625 22.797 43.231 1.00 0.00 C ATOM 1376 O LYS A 87 6.986 22.511 44.249 1.00 0.00 O ATOM 1377 CB LYS A 87 8.952 20.961 42.093 1.00 0.00 C ATOM 1378 CG LYS A 87 8.912 19.703 41.205 1.00 0.00 C ATOM 1379 CD LYS A 87 10.233 18.897 41.138 1.00 0.00 C ATOM 1380 CE LYS A 87 10.675 18.142 42.412 1.00 0.00 C ATOM 1381 NZ LYS A 87 9.779 17.026 42.769 1.00 0.00 N ATOM 0 H LYS A 87 8.268 22.222 40.104 1.00 0.00 H new ATOM 0 HA LYS A 87 6.750 21.135 42.201 1.00 0.00 H new ATOM 0 HB2 LYS A 87 9.772 21.602 41.770 1.00 0.00 H new ATOM 0 HB3 LYS A 87 9.163 20.667 43.121 1.00 0.00 H new ATOM 0 HG2 LYS A 87 8.123 19.046 41.570 1.00 0.00 H new ATOM 0 HG3 LYS A 87 8.636 20.001 40.194 1.00 0.00 H new ATOM 0 HD2 LYS A 87 10.143 18.170 40.331 1.00 0.00 H new ATOM 0 HD3 LYS A 87 11.032 19.584 40.860 1.00 0.00 H new ATOM 0 HE2 LYS A 87 11.684 17.756 42.266 1.00 0.00 H new ATOM 0 HE3 LYS A 87 10.720 18.844 43.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 10.130 16.561 43.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 8.820 17.391 42.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 9.755 16.338 41.990 1.00 0.00 H new ATOM 1395 N GLN A 88 8.320 23.958 43.069 1.00 0.00 N ATOM 1396 CA GLN A 88 8.305 25.075 44.053 1.00 0.00 C ATOM 1397 C GLN A 88 6.894 25.705 44.345 1.00 0.00 C ATOM 1398 O GLN A 88 6.659 26.145 45.476 1.00 0.00 O ATOM 1399 CB GLN A 88 9.383 26.090 43.583 1.00 0.00 C ATOM 1400 CG GLN A 88 9.799 27.154 44.625 1.00 0.00 C ATOM 1401 CD GLN A 88 10.800 28.175 44.059 1.00 0.00 C ATOM 1402 OE1 GLN A 88 10.426 29.116 43.360 1.00 0.00 O ATOM 1403 NE2 GLN A 88 12.084 28.016 44.346 1.00 0.00 N ATOM 0 H GLN A 88 8.905 24.144 42.254 1.00 0.00 H new ATOM 0 HA GLN A 88 8.551 24.689 45.042 1.00 0.00 H new ATOM 0 HB2 GLN A 88 10.272 25.535 43.282 1.00 0.00 H new ATOM 0 HB3 GLN A 88 9.011 26.602 42.696 1.00 0.00 H new ATOM 0 HG2 GLN A 88 8.911 27.678 44.978 1.00 0.00 H new ATOM 0 HG3 GLN A 88 10.241 26.658 45.489 1.00 0.00 H new ATOM 0 HE21 GLN A 88 12.384 27.233 44.926 1.00 0.00 H new ATOM 0 HE22 GLN A 88 12.773 28.677 43.987 1.00 0.00 H new ATOM 1412 N HIS A 89 6.032 25.744 43.317 1.00 0.00 N ATOM 1413 CA HIS A 89 4.692 26.354 43.356 1.00 0.00 C ATOM 1414 C HIS A 89 3.694 25.150 43.131 1.00 0.00 C ATOM 1415 O HIS A 89 3.318 24.918 41.971 1.00 0.00 O ATOM 1416 CB HIS A 89 4.583 27.473 42.320 1.00 0.00 C ATOM 1417 CG HIS A 89 5.405 28.734 42.608 1.00 0.00 C ATOM 1418 ND1 HIS A 89 6.723 28.926 42.217 1.00 0.00 N ATOM 1419 CD2 HIS A 89 4.956 29.848 43.345 1.00 0.00 C ATOM 1420 CE1 HIS A 89 6.962 30.155 42.771 1.00 0.00 C ATOM 1421 NE2 HIS A 89 5.963 30.791 43.458 1.00 0.00 N ATOM 0 H HIS A 89 6.254 25.340 42.407 1.00 0.00 H new ATOM 0 HA HIS A 89 4.461 26.849 44.299 1.00 0.00 H new ATOM 0 HB2 HIS A 89 4.889 27.077 41.352 1.00 0.00 H new ATOM 0 HB3 HIS A 89 3.535 27.758 42.231 1.00 0.00 H new ATOM 0 HD2 HIS A 89 3.966 29.951 43.763 1.00 0.00 H new ATOM 0 HE1 HIS A 89 7.931 30.619 42.667 1.00 0.00 H new ATOM 0 HE2 HIS A 89 5.961 31.700 43.921 1.00 0.00 H new ATOM 1430 N PRO A 90 3.267 24.339 44.157 1.00 0.00 N ATOM 1431 CA PRO A 90 2.273 23.227 43.965 1.00 0.00 C ATOM 1432 C PRO A 90 0.779 23.577 43.686 1.00 0.00 C ATOM 1433 O PRO A 90 0.010 22.688 43.307 1.00 0.00 O ATOM 1434 CB PRO A 90 2.481 22.411 45.249 1.00 0.00 C ATOM 1435 CG PRO A 90 2.871 23.431 46.320 1.00 0.00 C ATOM 1436 CD PRO A 90 3.703 24.468 45.566 1.00 0.00 C ATOM 0 HA PRO A 90 2.466 22.709 43.025 1.00 0.00 H new ATOM 0 HB2 PRO A 90 1.572 21.878 45.527 1.00 0.00 H new ATOM 0 HB3 PRO A 90 3.262 21.662 45.117 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.991 23.883 46.778 1.00 0.00 H new ATOM 0 HG3 PRO A 90 3.445 22.967 47.122 1.00 0.00 H new ATOM 0 HD2 PRO A 90 3.524 25.474 45.947 1.00 0.00 H new ATOM 0 HD3 PRO A 90 4.770 24.273 45.671 1.00 0.00 H new ATOM 1444 N ASP A 91 0.418 24.844 43.907 1.00 0.00 N ATOM 1445 CA ASP A 91 -0.919 25.432 43.654 1.00 0.00 C ATOM 1446 C ASP A 91 -1.138 26.034 42.231 1.00 0.00 C ATOM 1447 O ASP A 91 -2.312 26.275 41.929 1.00 0.00 O ATOM 1448 CB ASP A 91 -1.211 26.435 44.814 1.00 0.00 C ATOM 1449 CG ASP A 91 -0.310 27.683 44.916 1.00 0.00 C ATOM 1450 OD1 ASP A 91 -0.634 28.715 44.288 1.00 0.00 O ATOM 1451 OD2 ASP A 91 0.724 27.628 45.618 1.00 0.00 O ATOM 0 H ASP A 91 1.074 25.527 44.285 1.00 0.00 H new ATOM 0 HA ASP A 91 -1.652 24.626 43.652 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -2.243 26.772 44.717 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -1.141 25.891 45.756 1.00 0.00 H new ATOM 1456 N GLN A 92 -0.093 26.288 41.390 1.00 0.00 N ATOM 1457 CA GLN A 92 -0.275 26.885 40.030 1.00 0.00 C ATOM 1458 C GLN A 92 -0.105 25.707 39.045 1.00 0.00 C ATOM 1459 O GLN A 92 0.908 24.995 39.075 1.00 0.00 O ATOM 1460 CB GLN A 92 0.753 28.000 39.693 1.00 0.00 C ATOM 1461 CG GLN A 92 0.647 29.293 40.529 1.00 0.00 C ATOM 1462 CD GLN A 92 1.715 30.327 40.133 1.00 0.00 C ATOM 1463 OE1 GLN A 92 2.845 30.298 40.621 1.00 0.00 O ATOM 1464 NE2 GLN A 92 1.392 31.252 39.240 1.00 0.00 N ATOM 0 H GLN A 92 0.879 26.090 41.627 1.00 0.00 H new ATOM 0 HA GLN A 92 -1.250 27.369 39.971 1.00 0.00 H new ATOM 0 HB2 GLN A 92 1.756 27.592 39.817 1.00 0.00 H new ATOM 0 HB3 GLN A 92 0.644 28.261 38.640 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -0.344 29.728 40.399 1.00 0.00 H new ATOM 0 HG3 GLN A 92 0.752 29.050 41.586 1.00 0.00 H new ATOM 0 HE21 GLN A 92 0.454 31.269 38.840 1.00 0.00 H new ATOM 0 HE22 GLN A 92 2.082 31.946 38.953 1.00 0.00 H new ATOM 1473 N GLU A 93 -1.099 25.560 38.148 1.00 0.00 N ATOM 1474 CA GLU A 93 -1.133 24.527 37.067 1.00 0.00 C ATOM 1475 C GLU A 93 -0.149 24.942 35.947 1.00 0.00 C ATOM 1476 O GLU A 93 0.063 26.135 35.702 1.00 0.00 O ATOM 1477 CB GLU A 93 -2.564 24.347 36.480 1.00 0.00 C ATOM 1478 CG GLU A 93 -3.564 23.655 37.433 1.00 0.00 C ATOM 1479 CD GLU A 93 -4.962 23.504 36.825 1.00 0.00 C ATOM 1480 OE1 GLU A 93 -5.175 22.568 36.023 1.00 0.00 O ATOM 1481 OE2 GLU A 93 -5.855 24.319 37.148 1.00 0.00 O ATOM 0 H GLU A 93 -1.922 26.162 38.145 1.00 0.00 H new ATOM 0 HA GLU A 93 -0.837 23.570 37.496 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.958 25.327 36.209 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -2.496 23.765 35.561 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -3.181 22.670 37.700 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.635 24.230 38.356 1.00 0.00 H new ATOM 1488 N LEU A 94 0.470 23.938 35.310 1.00 0.00 N ATOM 1489 CA LEU A 94 1.434 24.156 34.233 1.00 0.00 C ATOM 1490 C LEU A 94 0.695 23.991 32.893 1.00 0.00 C ATOM 1491 O LEU A 94 -0.033 23.017 32.661 1.00 0.00 O ATOM 1492 CB LEU A 94 2.595 23.136 34.430 1.00 0.00 C ATOM 1493 CG LEU A 94 3.888 23.354 33.597 1.00 0.00 C ATOM 1494 CD1 LEU A 94 4.653 24.614 34.043 1.00 0.00 C ATOM 1495 CD2 LEU A 94 4.821 22.128 33.681 1.00 0.00 C ATOM 0 H LEU A 94 0.314 22.954 35.530 1.00 0.00 H new ATOM 0 HA LEU A 94 1.867 25.156 34.241 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.870 23.138 35.485 1.00 0.00 H new ATOM 0 HB3 LEU A 94 2.212 22.141 34.202 1.00 0.00 H new ATOM 0 HG LEU A 94 3.572 23.491 32.563 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.550 24.729 33.435 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.016 25.490 33.919 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.935 24.516 35.091 1.00 0.00 H new ATOM 0 HD21 LEU A 94 5.717 22.311 33.088 1.00 0.00 H new ATOM 0 HD22 LEU A 94 5.103 21.956 34.720 1.00 0.00 H new ATOM 0 HD23 LEU A 94 4.304 21.250 33.295 1.00 0.00 H new ATOM 1507 N VAL A 95 0.958 24.980 32.040 1.00 0.00 N ATOM 1508 CA VAL A 95 0.296 25.145 30.730 1.00 0.00 C ATOM 1509 C VAL A 95 1.505 25.436 29.801 1.00 0.00 C ATOM 1510 O VAL A 95 2.289 26.362 30.028 1.00 0.00 O ATOM 1511 CB VAL A 95 -0.846 26.228 30.696 1.00 0.00 C ATOM 1512 CG1 VAL A 95 -1.493 26.286 29.299 1.00 0.00 C ATOM 1513 CG2 VAL A 95 -1.972 25.982 31.726 1.00 0.00 C ATOM 0 H VAL A 95 1.648 25.706 32.236 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.278 24.270 30.424 1.00 0.00 H new ATOM 0 HB VAL A 95 -0.355 27.167 30.950 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.280 27.040 29.294 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -0.737 26.546 28.558 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.920 25.313 29.055 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.721 26.769 31.641 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.438 25.016 31.532 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -1.552 25.987 32.732 1.00 0.00 H new ATOM 1523 N ILE A 96 1.541 24.658 28.715 1.00 0.00 N ATOM 1524 CA ILE A 96 2.603 24.710 27.677 1.00 0.00 C ATOM 1525 C ILE A 96 1.863 25.359 26.515 1.00 0.00 C ATOM 1526 O ILE A 96 1.022 24.722 25.879 1.00 0.00 O ATOM 1527 CB ILE A 96 3.235 23.296 27.339 1.00 0.00 C ATOM 1528 CG1 ILE A 96 3.633 22.395 28.548 1.00 0.00 C ATOM 1529 CG2 ILE A 96 4.412 23.406 26.343 1.00 0.00 C ATOM 1530 CD1 ILE A 96 4.596 22.993 29.587 1.00 0.00 C ATOM 0 H ILE A 96 0.825 23.958 28.519 1.00 0.00 H new ATOM 0 HA ILE A 96 3.490 25.264 27.984 1.00 0.00 H new ATOM 0 HB ILE A 96 2.399 22.775 26.873 1.00 0.00 H new ATOM 0 HG12 ILE A 96 2.719 22.101 29.065 1.00 0.00 H new ATOM 0 HG13 ILE A 96 4.084 21.484 28.155 1.00 0.00 H new ATOM 0 HG21 ILE A 96 4.813 22.412 26.142 1.00 0.00 H new ATOM 0 HG22 ILE A 96 4.060 23.851 25.412 1.00 0.00 H new ATOM 0 HG23 ILE A 96 5.194 24.032 26.772 1.00 0.00 H new ATOM 0 HD11 ILE A 96 4.787 22.260 30.371 1.00 0.00 H new ATOM 0 HD12 ILE A 96 5.535 23.258 29.102 1.00 0.00 H new ATOM 0 HD13 ILE A 96 4.150 23.885 30.026 1.00 0.00 H new ATOM 1542 N ALA A 97 2.217 26.611 26.277 1.00 0.00 N ATOM 1543 CA ALA A 97 1.609 27.392 25.185 1.00 0.00 C ATOM 1544 C ALA A 97 2.345 27.469 23.838 1.00 0.00 C ATOM 1545 O ALA A 97 1.807 28.109 22.921 1.00 0.00 O ATOM 1546 CB ALA A 97 1.370 28.753 25.792 1.00 0.00 C ATOM 0 H ALA A 97 2.919 27.117 26.817 1.00 0.00 H new ATOM 0 HA ALA A 97 0.708 26.873 24.857 1.00 0.00 H new ATOM 0 HB1 ALA A 97 0.916 29.408 25.049 1.00 0.00 H new ATOM 0 HB2 ALA A 97 0.702 28.657 26.648 1.00 0.00 H new ATOM 0 HB3 ALA A 97 2.319 29.177 26.119 1.00 0.00 H new ATOM 1552 N GLY A 98 3.497 26.790 23.684 1.00 0.00 N ATOM 1553 CA GLY A 98 4.121 26.627 22.381 1.00 0.00 C ATOM 1554 C GLY A 98 5.378 27.473 22.110 1.00 0.00 C ATOM 1555 O GLY A 98 5.863 28.172 22.996 1.00 0.00 O ATOM 0 H GLY A 98 4.005 26.350 24.452 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.384 25.576 22.258 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.380 26.862 21.616 1.00 0.00 H new ATOM 1559 N GLY A 99 6.005 27.474 20.920 1.00 0.00 N ATOM 1560 CA GLY A 99 5.504 26.823 19.688 1.00 0.00 C ATOM 1561 C GLY A 99 5.851 25.342 19.612 1.00 0.00 C ATOM 1562 O GLY A 99 5.906 24.631 20.622 1.00 0.00 O ATOM 0 H GLY A 99 6.901 27.941 20.781 1.00 0.00 H new ATOM 0 HA2 GLY A 99 4.421 26.940 19.637 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.921 27.333 18.819 1.00 0.00 H new ATOM 1566 N ALA A 100 6.056 24.925 18.361 1.00 0.00 N ATOM 1567 CA ALA A 100 6.356 23.528 17.990 1.00 0.00 C ATOM 1568 C ALA A 100 7.618 22.856 18.548 1.00 0.00 C ATOM 1569 O ALA A 100 7.533 21.663 18.862 1.00 0.00 O ATOM 1570 CB ALA A 100 6.368 23.416 16.478 1.00 0.00 C ATOM 0 H ALA A 100 6.019 25.554 17.559 1.00 0.00 H new ATOM 0 HA ALA A 100 5.555 22.973 18.478 1.00 0.00 H new ATOM 0 HB1 ALA A 100 6.589 22.388 16.191 1.00 0.00 H new ATOM 0 HB2 ALA A 100 5.392 23.701 16.084 1.00 0.00 H new ATOM 0 HB3 ALA A 100 7.132 24.078 16.070 1.00 0.00 H new ATOM 1576 N GLN A 101 8.737 23.601 18.694 1.00 0.00 N ATOM 1577 CA GLN A 101 9.943 23.100 19.404 1.00 0.00 C ATOM 1578 C GLN A 101 9.751 22.922 20.923 1.00 0.00 C ATOM 1579 O GLN A 101 10.392 22.013 21.463 1.00 0.00 O ATOM 1580 CB GLN A 101 11.166 24.001 19.175 1.00 0.00 C ATOM 1581 CG GLN A 101 11.696 24.014 17.721 1.00 0.00 C ATOM 1582 CD GLN A 101 12.923 24.921 17.534 1.00 0.00 C ATOM 1583 OE1 GLN A 101 12.800 26.133 17.359 1.00 0.00 O ATOM 1584 NE2 GLN A 101 14.124 24.363 17.563 1.00 0.00 N ATOM 0 H GLN A 101 8.833 24.550 18.332 1.00 0.00 H new ATOM 0 HA GLN A 101 10.113 22.116 18.967 1.00 0.00 H new ATOM 0 HB2 GLN A 101 10.908 25.020 19.463 1.00 0.00 H new ATOM 0 HB3 GLN A 101 11.969 23.676 19.837 1.00 0.00 H new ATOM 0 HG2 GLN A 101 11.955 22.997 17.426 1.00 0.00 H new ATOM 0 HG3 GLN A 101 10.901 24.347 17.054 1.00 0.00 H new ATOM 0 HE21 GLN A 101 14.216 23.358 17.709 1.00 0.00 H new ATOM 0 HE22 GLN A 101 14.957 24.939 17.440 1.00 0.00 H new ATOM 1593 N ILE A 102 8.885 23.736 21.581 1.00 0.00 N ATOM 1594 CA ILE A 102 8.506 23.491 23.006 1.00 0.00 C ATOM 1595 C ILE A 102 7.473 22.382 23.188 1.00 0.00 C ATOM 1596 O ILE A 102 7.635 21.599 24.135 1.00 0.00 O ATOM 1597 CB ILE A 102 8.330 24.877 23.742 1.00 0.00 C ATOM 1598 CG1 ILE A 102 9.646 25.348 24.435 1.00 0.00 C ATOM 1599 CG2 ILE A 102 7.193 24.972 24.788 1.00 0.00 C ATOM 1600 CD1 ILE A 102 10.853 25.603 23.517 1.00 0.00 C ATOM 0 H ILE A 102 8.441 24.553 21.162 1.00 0.00 H new ATOM 0 HA ILE A 102 9.314 23.015 23.562 1.00 0.00 H new ATOM 0 HB ILE A 102 8.051 25.528 22.914 1.00 0.00 H new ATOM 0 HG12 ILE A 102 9.433 26.267 24.982 1.00 0.00 H new ATOM 0 HG13 ILE A 102 9.931 24.597 25.172 1.00 0.00 H new ATOM 0 HG21 ILE A 102 7.179 25.973 25.220 1.00 0.00 H new ATOM 0 HG22 ILE A 102 6.237 24.771 24.305 1.00 0.00 H new ATOM 0 HG23 ILE A 102 7.362 24.239 25.577 1.00 0.00 H new ATOM 0 HD11 ILE A 102 11.704 25.925 24.117 1.00 0.00 H new ATOM 0 HD12 ILE A 102 11.108 24.685 22.988 1.00 0.00 H new ATOM 0 HD13 ILE A 102 10.603 26.380 22.795 1.00 0.00 H new ATOM 1612 N PHE A 103 6.446 22.330 22.322 1.00 0.00 N ATOM 1613 CA PHE A 103 5.537 21.155 22.357 1.00 0.00 C ATOM 1614 C PHE A 103 6.187 19.767 22.067 1.00 0.00 C ATOM 1615 O PHE A 103 5.691 18.782 22.626 1.00 0.00 O ATOM 1616 CB PHE A 103 4.378 21.306 21.372 1.00 0.00 C ATOM 1617 CG PHE A 103 3.391 22.476 21.504 1.00 0.00 C ATOM 1618 CD1 PHE A 103 2.702 22.706 22.701 1.00 0.00 C ATOM 1619 CD2 PHE A 103 3.100 23.267 20.386 1.00 0.00 C ATOM 1620 CE1 PHE A 103 1.760 23.727 22.781 1.00 0.00 C ATOM 1621 CE2 PHE A 103 2.179 24.305 20.478 1.00 0.00 C ATOM 1622 CZ PHE A 103 1.521 24.540 21.680 1.00 0.00 C ATOM 0 H PHE A 103 6.225 23.040 21.624 1.00 0.00 H new ATOM 0 HA PHE A 103 5.208 21.155 23.396 1.00 0.00 H new ATOM 0 HB2 PHE A 103 4.810 21.360 20.373 1.00 0.00 H new ATOM 0 HB3 PHE A 103 3.795 20.386 21.418 1.00 0.00 H new ATOM 0 HD1 PHE A 103 2.902 22.089 23.565 1.00 0.00 H new ATOM 0 HD2 PHE A 103 3.594 23.070 19.446 1.00 0.00 H new ATOM 0 HE1 PHE A 103 1.215 23.888 23.699 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.976 24.927 19.619 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.821 25.358 21.758 1.00 0.00 H new ATOM 1632 N THR A 104 7.291 19.710 21.264 1.00 0.00 N ATOM 1633 CA THR A 104 8.193 18.525 21.252 1.00 0.00 C ATOM 1634 C THR A 104 8.887 18.292 22.641 1.00 0.00 C ATOM 1635 O THR A 104 8.788 17.161 23.132 1.00 0.00 O ATOM 1636 CB THR A 104 9.201 18.614 20.075 1.00 0.00 C ATOM 1637 OG1 THR A 104 8.545 18.896 18.844 1.00 0.00 O ATOM 1638 CG2 THR A 104 10.023 17.332 19.839 1.00 0.00 C ATOM 0 H THR A 104 7.571 20.458 20.629 1.00 0.00 H new ATOM 0 HA THR A 104 7.582 17.638 21.083 1.00 0.00 H new ATOM 0 HB THR A 104 9.872 19.418 20.377 1.00 0.00 H new ATOM 0 HG1 THR A 104 8.209 19.817 18.856 1.00 0.00 H new ATOM 0 HG21 THR A 104 10.701 17.484 18.999 1.00 0.00 H new ATOM 0 HG22 THR A 104 10.601 17.100 20.734 1.00 0.00 H new ATOM 0 HG23 THR A 104 9.350 16.504 19.617 1.00 0.00 H new ATOM 1646 N ALA A 105 9.561 19.318 23.221 1.00 0.00 N ATOM 1647 CA ALA A 105 10.264 19.160 24.517 1.00 0.00 C ATOM 1648 C ALA A 105 9.408 18.761 25.765 1.00 0.00 C ATOM 1649 O ALA A 105 10.001 18.191 26.687 1.00 0.00 O ATOM 1650 CB ALA A 105 10.987 20.472 24.788 1.00 0.00 C ATOM 0 H ALA A 105 9.631 20.252 22.817 1.00 0.00 H new ATOM 0 HA ALA A 105 10.922 18.300 24.395 1.00 0.00 H new ATOM 0 HB1 ALA A 105 11.521 20.404 25.736 1.00 0.00 H new ATOM 0 HB2 ALA A 105 11.697 20.669 23.985 1.00 0.00 H new ATOM 0 HB3 ALA A 105 10.261 21.284 24.838 1.00 0.00 H new ATOM 1656 N PHE A 106 8.067 19.008 25.783 1.00 0.00 N ATOM 1657 CA PHE A 106 7.131 18.405 26.792 1.00 0.00 C ATOM 1658 C PHE A 106 6.117 17.384 26.196 1.00 0.00 C ATOM 1659 O PHE A 106 5.171 17.023 26.917 1.00 0.00 O ATOM 1660 CB PHE A 106 6.308 19.531 27.475 1.00 0.00 C ATOM 1661 CG PHE A 106 7.113 20.541 28.290 1.00 0.00 C ATOM 1662 CD1 PHE A 106 7.400 20.315 29.640 1.00 0.00 C ATOM 1663 CD2 PHE A 106 7.580 21.701 27.668 1.00 0.00 C ATOM 1664 CE1 PHE A 106 8.170 21.232 30.349 1.00 0.00 C ATOM 1665 CE2 PHE A 106 8.360 22.602 28.372 1.00 0.00 C ATOM 1666 CZ PHE A 106 8.670 22.359 29.705 1.00 0.00 C ATOM 0 H PHE A 106 7.604 19.621 25.111 1.00 0.00 H new ATOM 0 HA PHE A 106 7.768 17.867 27.494 1.00 0.00 H new ATOM 0 HB2 PHE A 106 5.757 20.071 26.705 1.00 0.00 H new ATOM 0 HB3 PHE A 106 5.570 19.069 28.131 1.00 0.00 H new ATOM 0 HD1 PHE A 106 7.024 19.430 30.132 1.00 0.00 H new ATOM 0 HD2 PHE A 106 7.332 21.895 26.635 1.00 0.00 H new ATOM 0 HE1 PHE A 106 8.379 21.069 31.396 1.00 0.00 H new ATOM 0 HE2 PHE A 106 8.728 23.494 27.886 1.00 0.00 H new ATOM 0 HZ PHE A 106 9.303 23.049 30.244 1.00 0.00 H new ATOM 1676 N LYS A 107 6.304 16.846 24.956 1.00 0.00 N ATOM 1677 CA LYS A 107 5.458 15.743 24.399 1.00 0.00 C ATOM 1678 C LYS A 107 5.083 14.600 25.403 1.00 0.00 C ATOM 1679 O LYS A 107 3.910 14.211 25.404 1.00 0.00 O ATOM 1680 CB LYS A 107 6.182 15.185 23.149 1.00 0.00 C ATOM 1681 CG LYS A 107 5.335 14.188 22.340 1.00 0.00 C ATOM 1682 CD LYS A 107 6.012 13.738 21.029 1.00 0.00 C ATOM 1683 CE LYS A 107 5.152 12.750 20.217 1.00 0.00 C ATOM 1684 NZ LYS A 107 5.778 12.415 18.926 1.00 0.00 N ATOM 0 H LYS A 107 7.037 17.159 24.319 1.00 0.00 H new ATOM 0 HA LYS A 107 4.489 16.175 24.148 1.00 0.00 H new ATOM 0 HB2 LYS A 107 6.466 16.016 22.503 1.00 0.00 H new ATOM 0 HB3 LYS A 107 7.104 14.695 23.462 1.00 0.00 H new ATOM 0 HG2 LYS A 107 5.131 13.312 22.955 1.00 0.00 H new ATOM 0 HG3 LYS A 107 4.373 14.644 22.106 1.00 0.00 H new ATOM 0 HD2 LYS A 107 6.225 14.614 20.417 1.00 0.00 H new ATOM 0 HD3 LYS A 107 6.969 13.272 21.262 1.00 0.00 H new ATOM 0 HE2 LYS A 107 5.001 11.839 20.795 1.00 0.00 H new ATOM 0 HE3 LYS A 107 4.167 13.183 20.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 5.170 11.748 18.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 5.899 13.281 18.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 6.707 11.978 19.094 1.00 0.00 H new ATOM 1698 N ASP A 108 6.064 14.086 26.185 1.00 0.00 N ATOM 1699 CA ASP A 108 5.806 12.945 27.096 1.00 0.00 C ATOM 1700 C ASP A 108 5.033 13.260 28.369 1.00 0.00 C ATOM 1701 O ASP A 108 4.388 12.338 28.886 1.00 0.00 O ATOM 1702 CB ASP A 108 7.100 12.215 27.447 1.00 0.00 C ATOM 1703 CG ASP A 108 7.752 11.487 26.258 1.00 0.00 C ATOM 1704 OD1 ASP A 108 7.293 10.380 25.901 1.00 0.00 O ATOM 1705 OD2 ASP A 108 8.722 12.023 25.678 1.00 0.00 O ATOM 0 H ASP A 108 7.022 14.435 26.204 1.00 0.00 H new ATOM 0 HA ASP A 108 5.144 12.303 26.514 1.00 0.00 H new ATOM 0 HB2 ASP A 108 7.811 12.934 27.854 1.00 0.00 H new ATOM 0 HB3 ASP A 108 6.894 11.490 28.234 1.00 0.00 H new ATOM 1710 N ASP A 109 5.122 14.502 28.862 1.00 0.00 N ATOM 1711 CA ASP A 109 4.486 14.844 30.152 1.00 0.00 C ATOM 1712 C ASP A 109 3.125 15.541 30.030 1.00 0.00 C ATOM 1713 O ASP A 109 2.557 15.864 31.087 1.00 0.00 O ATOM 1714 CB ASP A 109 5.469 15.697 30.946 1.00 0.00 C ATOM 1715 CG ASP A 109 6.767 15.000 31.388 1.00 0.00 C ATOM 1716 OD1 ASP A 109 6.728 14.202 32.350 1.00 0.00 O ATOM 1717 OD2 ASP A 109 7.828 15.253 30.776 1.00 0.00 O ATOM 0 H ASP A 109 5.613 15.272 28.406 1.00 0.00 H new ATOM 0 HA ASP A 109 4.262 13.910 30.667 1.00 0.00 H new ATOM 0 HB2 ASP A 109 5.734 16.566 30.343 1.00 0.00 H new ATOM 0 HB3 ASP A 109 4.960 16.069 31.835 1.00 0.00 H new ATOM 1722 N VAL A 110 2.528 15.720 28.817 1.00 0.00 N ATOM 1723 CA VAL A 110 1.162 16.315 28.719 1.00 0.00 C ATOM 1724 C VAL A 110 0.113 15.245 29.204 1.00 0.00 C ATOM 1725 O VAL A 110 0.169 14.078 28.795 1.00 0.00 O ATOM 1726 CB VAL A 110 0.916 16.954 27.305 1.00 0.00 C ATOM 1727 CG1 VAL A 110 0.943 15.981 26.102 1.00 0.00 C ATOM 1728 CG2 VAL A 110 -0.385 17.776 27.259 1.00 0.00 C ATOM 0 H VAL A 110 2.952 15.471 27.923 1.00 0.00 H new ATOM 0 HA VAL A 110 1.045 17.168 29.388 1.00 0.00 H new ATOM 0 HB VAL A 110 1.784 17.603 27.185 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.761 16.536 25.181 1.00 0.00 H new ATOM 0 HG12 VAL A 110 1.918 15.497 26.047 1.00 0.00 H new ATOM 0 HG13 VAL A 110 0.169 15.224 26.229 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.513 18.199 26.262 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.232 17.130 27.491 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -0.332 18.582 27.991 1.00 0.00 H new ATOM 1738 N ASP A 111 -0.841 15.734 30.002 1.00 0.00 N ATOM 1739 CA ASP A 111 -2.098 14.995 30.318 1.00 0.00 C ATOM 1740 C ASP A 111 -3.407 15.577 29.742 1.00 0.00 C ATOM 1741 O ASP A 111 -4.366 14.802 29.656 1.00 0.00 O ATOM 1742 CB ASP A 111 -2.200 14.690 31.824 1.00 0.00 C ATOM 1743 CG ASP A 111 -2.281 15.856 32.827 1.00 0.00 C ATOM 1744 OD1 ASP A 111 -3.089 16.790 32.631 1.00 0.00 O ATOM 1745 OD2 ASP A 111 -1.540 15.823 33.835 1.00 0.00 O ATOM 0 H ASP A 111 -0.778 16.647 30.452 1.00 0.00 H new ATOM 0 HA ASP A 111 -1.999 14.057 29.771 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.083 14.068 31.973 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.335 14.085 32.095 1.00 0.00 H new ATOM 1750 N THR A 112 -3.469 16.879 29.365 1.00 0.00 N ATOM 1751 CA THR A 112 -4.701 17.506 28.809 1.00 0.00 C ATOM 1752 C THR A 112 -4.314 18.282 27.526 1.00 0.00 C ATOM 1753 O THR A 112 -3.216 18.849 27.435 1.00 0.00 O ATOM 1754 CB THR A 112 -5.322 18.401 29.919 1.00 0.00 C ATOM 1755 OG1 THR A 112 -5.634 17.606 31.060 1.00 0.00 O ATOM 1756 CG2 THR A 112 -6.614 19.160 29.559 1.00 0.00 C ATOM 0 H THR A 112 -2.678 17.519 29.435 1.00 0.00 H new ATOM 0 HA THR A 112 -5.456 16.775 28.521 1.00 0.00 H new ATOM 0 HB THR A 112 -4.551 19.152 30.091 1.00 0.00 H new ATOM 0 HG1 THR A 112 -4.807 17.367 31.528 1.00 0.00 H new ATOM 0 HG21 THR A 112 -6.943 19.746 30.417 1.00 0.00 H new ATOM 0 HG22 THR A 112 -6.422 19.826 28.717 1.00 0.00 H new ATOM 0 HG23 THR A 112 -7.392 18.446 29.287 1.00 0.00 H new ATOM 1764 N LEU A 113 -5.300 18.381 26.605 1.00 0.00 N ATOM 1765 CA LEU A 113 -5.112 19.130 25.343 1.00 0.00 C ATOM 1766 C LEU A 113 -6.214 20.172 25.247 1.00 0.00 C ATOM 1767 O LEU A 113 -7.399 19.827 25.186 1.00 0.00 O ATOM 1768 CB LEU A 113 -5.091 18.202 24.093 1.00 0.00 C ATOM 1769 CG LEU A 113 -4.122 16.979 24.072 1.00 0.00 C ATOM 1770 CD1 LEU A 113 -4.380 16.064 22.861 1.00 0.00 C ATOM 1771 CD2 LEU A 113 -2.631 17.366 24.135 1.00 0.00 C ATOM 0 H LEU A 113 -6.222 17.957 26.710 1.00 0.00 H new ATOM 0 HA LEU A 113 -4.136 19.615 25.358 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -6.102 17.822 23.949 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -4.857 18.822 23.228 1.00 0.00 H new ATOM 0 HG LEU A 113 -4.345 16.429 24.986 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -3.684 15.225 22.884 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -5.403 15.689 22.900 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -4.236 16.630 21.940 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -2.020 16.464 24.116 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -2.381 17.992 23.278 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -2.437 17.917 25.055 1.00 0.00 H new ATOM 1783 N LEU A 114 -5.790 21.438 25.236 1.00 0.00 N ATOM 1784 CA LEU A 114 -6.714 22.588 25.098 1.00 0.00 C ATOM 1785 C LEU A 114 -6.502 23.105 23.679 1.00 0.00 C ATOM 1786 O LEU A 114 -5.620 23.941 23.424 1.00 0.00 O ATOM 1787 CB LEU A 114 -6.440 23.677 26.183 1.00 0.00 C ATOM 1788 CG LEU A 114 -6.620 23.305 27.682 1.00 0.00 C ATOM 1789 CD1 LEU A 114 -6.057 24.422 28.585 1.00 0.00 C ATOM 1790 CD2 LEU A 114 -8.085 23.003 28.053 1.00 0.00 C ATOM 0 H LEU A 114 -4.809 21.703 25.321 1.00 0.00 H new ATOM 0 HA LEU A 114 -7.753 22.300 25.256 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -5.415 24.024 26.050 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -7.093 24.524 25.973 1.00 0.00 H new ATOM 0 HG LEU A 114 -6.057 22.386 27.847 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -6.191 24.146 29.631 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -4.995 24.557 28.378 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -6.587 25.353 28.385 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -8.148 22.750 29.111 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -8.699 23.881 27.853 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -8.446 22.164 27.457 1.00 0.00 H new ATOM 1802 N VAL A 115 -7.277 22.517 22.748 1.00 0.00 N ATOM 1803 CA VAL A 115 -7.107 22.796 21.297 1.00 0.00 C ATOM 1804 C VAL A 115 -8.259 23.773 20.924 1.00 0.00 C ATOM 1805 O VAL A 115 -9.419 23.535 21.279 1.00 0.00 O ATOM 1806 CB VAL A 115 -6.912 21.483 20.442 1.00 0.00 C ATOM 1807 CG1 VAL A 115 -8.068 20.464 20.478 1.00 0.00 C ATOM 1808 CG2 VAL A 115 -6.580 21.791 18.964 1.00 0.00 C ATOM 0 H VAL A 115 -8.020 21.853 22.964 1.00 0.00 H new ATOM 0 HA VAL A 115 -6.171 23.297 21.048 1.00 0.00 H new ATOM 0 HB VAL A 115 -6.068 21.009 20.943 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -7.817 19.607 19.853 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -8.228 20.131 21.504 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -8.978 20.932 20.102 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -6.455 20.857 18.417 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -7.393 22.365 18.520 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -5.657 22.369 18.911 1.00 0.00 H new ATOM 1818 N THR A 116 -7.918 24.782 20.105 1.00 0.00 N ATOM 1819 CA THR A 116 -8.919 25.479 19.269 1.00 0.00 C ATOM 1820 C THR A 116 -8.655 24.952 17.831 1.00 0.00 C ATOM 1821 O THR A 116 -7.515 24.911 17.355 1.00 0.00 O ATOM 1822 CB THR A 116 -8.782 27.014 19.429 1.00 0.00 C ATOM 1823 OG1 THR A 116 -8.773 27.373 20.806 1.00 0.00 O ATOM 1824 CG2 THR A 116 -9.913 27.790 18.738 1.00 0.00 C ATOM 0 H THR A 116 -6.966 25.133 20.002 1.00 0.00 H new ATOM 0 HA THR A 116 -9.952 25.280 19.553 1.00 0.00 H new ATOM 0 HB THR A 116 -7.840 27.283 18.952 1.00 0.00 H new ATOM 0 HG1 THR A 116 -8.502 28.310 20.898 1.00 0.00 H new ATOM 0 HG21 THR A 116 -9.763 28.860 18.885 1.00 0.00 H new ATOM 0 HG22 THR A 116 -9.909 27.566 17.671 1.00 0.00 H new ATOM 0 HG23 THR A 116 -10.871 27.496 19.167 1.00 0.00 H new ATOM 1832 N ARG A 117 -9.755 24.603 17.159 1.00 0.00 N ATOM 1833 CA ARG A 117 -9.716 24.027 15.790 1.00 0.00 C ATOM 1834 C ARG A 117 -10.422 25.046 14.904 1.00 0.00 C ATOM 1835 O ARG A 117 -11.619 25.277 15.108 1.00 0.00 O ATOM 1836 CB ARG A 117 -10.418 22.647 15.707 1.00 0.00 C ATOM 1837 CG ARG A 117 -9.588 21.533 16.373 1.00 0.00 C ATOM 1838 CD ARG A 117 -10.083 20.112 16.040 1.00 0.00 C ATOM 1839 NE ARG A 117 -9.225 19.065 16.657 1.00 0.00 N ATOM 1840 CZ ARG A 117 -9.450 17.742 16.548 1.00 0.00 C ATOM 1841 NH1 ARG A 117 -10.489 17.213 15.903 1.00 0.00 N ATOM 1842 NH2 ARG A 117 -8.592 16.917 17.115 1.00 0.00 N ATOM 0 H ARG A 117 -10.697 24.706 17.535 1.00 0.00 H new ATOM 0 HA ARG A 117 -8.688 23.845 15.477 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -11.394 22.708 16.188 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -10.593 22.392 14.662 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -8.548 21.629 16.060 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -9.609 21.672 17.454 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -11.108 19.994 16.391 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -10.098 19.977 14.958 1.00 0.00 H new ATOM 0 HE ARG A 117 -8.415 19.369 17.197 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -11.174 17.821 15.454 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -10.600 16.200 15.859 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -7.786 17.287 17.618 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -8.735 15.909 17.050 1.00 0.00 H new ATOM 1856 N LEU A 118 -9.707 25.624 13.912 1.00 0.00 N ATOM 1857 CA LEU A 118 -10.340 26.571 12.943 1.00 0.00 C ATOM 1858 C LEU A 118 -10.879 25.754 11.767 1.00 0.00 C ATOM 1859 O LEU A 118 -10.138 24.927 11.216 1.00 0.00 O ATOM 1860 CB LEU A 118 -9.412 27.733 12.465 1.00 0.00 C ATOM 1861 CG LEU A 118 -9.128 28.892 13.461 1.00 0.00 C ATOM 1862 CD1 LEU A 118 -8.165 28.532 14.613 1.00 0.00 C ATOM 1863 CD2 LEU A 118 -8.560 30.092 12.683 1.00 0.00 C ATOM 0 H LEU A 118 -8.712 25.462 13.756 1.00 0.00 H new ATOM 0 HA LEU A 118 -11.149 27.086 13.462 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -8.455 27.299 12.175 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -9.852 28.165 11.566 1.00 0.00 H new ATOM 0 HG LEU A 118 -10.082 29.126 13.933 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -8.026 29.401 15.256 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -8.585 27.712 15.196 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -7.203 28.228 14.201 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -8.358 30.911 13.374 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -7.635 29.799 12.187 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -9.285 30.418 11.937 1.00 0.00 H new ATOM 1875 N ALA A 119 -12.145 26.025 11.370 1.00 0.00 N ATOM 1876 CA ALA A 119 -12.737 25.325 10.194 1.00 0.00 C ATOM 1877 C ALA A 119 -12.037 25.513 8.817 1.00 0.00 C ATOM 1878 O ALA A 119 -12.226 24.647 7.956 1.00 0.00 O ATOM 1879 CB ALA A 119 -14.194 25.742 10.049 1.00 0.00 C ATOM 0 H ALA A 119 -12.762 26.698 11.825 1.00 0.00 H new ATOM 0 HA ALA A 119 -12.602 24.269 10.428 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -14.634 25.234 9.191 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -14.742 25.470 10.951 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -14.251 26.820 9.901 1.00 0.00 H new ATOM 1885 N GLY A 120 -11.255 26.607 8.638 1.00 0.00 N ATOM 1886 CA GLY A 120 -10.541 26.890 7.394 1.00 0.00 C ATOM 1887 C GLY A 120 -9.120 26.388 7.302 1.00 0.00 C ATOM 1888 O GLY A 120 -8.618 25.673 8.180 1.00 0.00 O ATOM 0 H GLY A 120 -11.110 27.311 9.361 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -11.109 26.459 6.569 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -10.531 27.970 7.244 1.00 0.00 H new ATOM 1892 N SER A 121 -8.510 26.796 6.172 1.00 0.00 N ATOM 1893 CA SER A 121 -7.110 26.439 5.861 1.00 0.00 C ATOM 1894 C SER A 121 -6.338 27.710 5.502 1.00 0.00 C ATOM 1895 O SER A 121 -6.758 28.487 4.636 1.00 0.00 O ATOM 1896 CB SER A 121 -7.084 25.441 4.708 1.00 0.00 C ATOM 1897 OG SER A 121 -5.760 24.971 4.476 1.00 0.00 O ATOM 0 H SER A 121 -8.962 27.371 5.461 1.00 0.00 H new ATOM 0 HA SER A 121 -6.638 25.975 6.727 1.00 0.00 H new ATOM 0 HB2 SER A 121 -7.739 24.600 4.934 1.00 0.00 H new ATOM 0 HB3 SER A 121 -7.471 25.912 3.804 1.00 0.00 H new ATOM 0 HG SER A 121 -5.667 24.064 4.834 1.00 0.00 H new ATOM 1903 N PHE A 122 -5.216 27.886 6.213 1.00 0.00 N ATOM 1904 CA PHE A 122 -4.344 29.080 6.121 1.00 0.00 C ATOM 1905 C PHE A 122 -2.981 28.598 5.599 1.00 0.00 C ATOM 1906 O PHE A 122 -2.618 27.419 5.741 1.00 0.00 O ATOM 1907 CB PHE A 122 -4.266 29.771 7.519 1.00 0.00 C ATOM 1908 CG PHE A 122 -5.571 30.482 7.932 1.00 0.00 C ATOM 1909 CD1 PHE A 122 -6.579 29.783 8.608 1.00 0.00 C ATOM 1910 CD2 PHE A 122 -5.790 31.816 7.568 1.00 0.00 C ATOM 1911 CE1 PHE A 122 -7.794 30.399 8.892 1.00 0.00 C ATOM 1912 CE2 PHE A 122 -7.006 32.431 7.856 1.00 0.00 C ATOM 1913 CZ PHE A 122 -8.009 31.720 8.509 1.00 0.00 C ATOM 0 H PHE A 122 -4.877 27.194 6.882 1.00 0.00 H new ATOM 0 HA PHE A 122 -4.731 29.833 5.434 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.017 29.023 8.271 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -3.454 30.498 7.511 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -6.412 28.760 8.911 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -5.013 32.370 7.062 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -8.569 29.853 9.409 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -7.171 33.460 7.573 1.00 0.00 H new ATOM 0 HZ PHE A 122 -8.956 32.194 8.719 1.00 0.00 H new ATOM 1923 N GLU A 123 -2.217 29.531 4.990 1.00 0.00 N ATOM 1924 CA GLU A 123 -0.819 29.264 4.598 1.00 0.00 C ATOM 1925 C GLU A 123 0.078 29.653 5.803 1.00 0.00 C ATOM 1926 O GLU A 123 -0.112 30.694 6.447 1.00 0.00 O ATOM 1927 CB GLU A 123 -0.528 30.088 3.331 1.00 0.00 C ATOM 1928 CG GLU A 123 0.821 29.777 2.645 1.00 0.00 C ATOM 1929 CD GLU A 123 1.068 30.631 1.397 1.00 0.00 C ATOM 1930 OE1 GLU A 123 0.671 30.208 0.289 1.00 0.00 O ATOM 1931 OE2 GLU A 123 1.658 31.727 1.518 1.00 0.00 O ATOM 0 H GLU A 123 -2.544 30.470 4.761 1.00 0.00 H new ATOM 0 HA GLU A 123 -0.624 28.218 4.361 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -1.331 29.919 2.613 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -0.551 31.146 3.591 1.00 0.00 H new ATOM 0 HG2 GLU A 123 1.630 29.940 3.356 1.00 0.00 H new ATOM 0 HG3 GLU A 123 0.847 28.723 2.369 1.00 0.00 H new ATOM 1938 N GLY A 124 1.075 28.791 5.995 1.00 0.00 N ATOM 1939 CA GLY A 124 2.178 29.065 6.905 1.00 0.00 C ATOM 1940 C GLY A 124 3.237 27.995 6.736 1.00 0.00 C ATOM 1941 O GLY A 124 3.372 27.319 5.704 1.00 0.00 O ATOM 0 H GLY A 124 1.138 27.888 5.525 1.00 0.00 H new ATOM 0 HA2 GLY A 124 2.601 30.048 6.698 1.00 0.00 H new ATOM 0 HA3 GLY A 124 1.821 29.081 7.935 1.00 0.00 H new ATOM 1945 N ASP A 125 4.040 27.931 7.798 1.00 0.00 N ATOM 1946 CA ASP A 125 5.265 27.082 7.853 1.00 0.00 C ATOM 1947 C ASP A 125 5.479 26.230 9.120 1.00 0.00 C ATOM 1948 O ASP A 125 6.389 25.389 9.087 1.00 0.00 O ATOM 1949 CB ASP A 125 6.507 27.935 7.507 1.00 0.00 C ATOM 1950 CG ASP A 125 6.842 29.163 8.385 1.00 0.00 C ATOM 1951 OD1 ASP A 125 6.816 29.059 9.632 1.00 0.00 O ATOM 1952 OD2 ASP A 125 7.142 30.235 7.816 1.00 0.00 O ATOM 0 H ASP A 125 3.873 28.461 8.653 1.00 0.00 H new ATOM 0 HA ASP A 125 5.102 26.315 7.096 1.00 0.00 H new ATOM 0 HB2 ASP A 125 7.374 27.274 7.521 1.00 0.00 H new ATOM 0 HB3 ASP A 125 6.390 28.286 6.482 1.00 0.00 H new ATOM 1957 N THR A 126 4.666 26.397 10.186 1.00 0.00 N ATOM 1958 CA THR A 126 4.789 25.579 11.415 1.00 0.00 C ATOM 1959 C THR A 126 3.426 24.862 11.551 1.00 0.00 C ATOM 1960 O THR A 126 2.358 25.468 11.404 1.00 0.00 O ATOM 1961 CB THR A 126 5.164 26.514 12.594 1.00 0.00 C ATOM 1962 OG1 THR A 126 6.310 27.296 12.264 1.00 0.00 O ATOM 1963 CG2 THR A 126 5.491 25.779 13.902 1.00 0.00 C ATOM 0 H THR A 126 3.918 27.090 10.221 1.00 0.00 H new ATOM 0 HA THR A 126 5.577 24.826 11.395 1.00 0.00 H new ATOM 0 HB THR A 126 4.276 27.125 12.754 1.00 0.00 H new ATOM 0 HG1 THR A 126 6.534 27.882 13.017 1.00 0.00 H new ATOM 0 HG21 THR A 126 5.742 26.506 14.675 1.00 0.00 H new ATOM 0 HG22 THR A 126 4.625 25.197 14.219 1.00 0.00 H new ATOM 0 HG23 THR A 126 6.338 25.111 13.742 1.00 0.00 H new ATOM 1971 N LYS A 127 3.530 23.574 11.896 1.00 0.00 N ATOM 1972 CA LYS A 127 2.375 22.728 12.277 1.00 0.00 C ATOM 1973 C LYS A 127 2.493 22.446 13.778 1.00 0.00 C ATOM 1974 O LYS A 127 3.572 22.519 14.388 1.00 0.00 O ATOM 1975 CB LYS A 127 2.318 21.426 11.419 1.00 0.00 C ATOM 1976 CG LYS A 127 1.662 21.701 10.058 1.00 0.00 C ATOM 1977 CD LYS A 127 1.307 20.435 9.255 1.00 0.00 C ATOM 1978 CE LYS A 127 0.466 20.756 8.004 1.00 0.00 C ATOM 1979 NZ LYS A 127 0.119 19.532 7.259 1.00 0.00 N ATOM 0 H LYS A 127 4.421 23.078 11.921 1.00 0.00 H new ATOM 0 HA LYS A 127 1.434 23.241 12.079 1.00 0.00 H new ATOM 0 HB2 LYS A 127 3.326 21.038 11.271 1.00 0.00 H new ATOM 0 HB3 LYS A 127 1.756 20.658 11.951 1.00 0.00 H new ATOM 0 HG2 LYS A 127 0.754 22.282 10.217 1.00 0.00 H new ATOM 0 HG3 LYS A 127 2.335 22.318 9.462 1.00 0.00 H new ATOM 0 HD2 LYS A 127 2.224 19.929 8.954 1.00 0.00 H new ATOM 0 HD3 LYS A 127 0.756 19.744 9.894 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -0.446 21.274 8.300 1.00 0.00 H new ATOM 0 HE3 LYS A 127 1.021 21.434 7.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -0.447 19.783 6.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 0.990 19.051 6.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -0.431 18.897 7.872 1.00 0.00 H new ATOM 1993 N MET A 128 1.350 21.995 14.342 1.00 0.00 N ATOM 1994 CA MET A 128 1.362 21.166 15.549 1.00 0.00 C ATOM 1995 C MET A 128 2.138 19.845 15.293 1.00 0.00 C ATOM 1996 O MET A 128 2.033 19.191 14.250 1.00 0.00 O ATOM 1997 CB MET A 128 -0.094 20.929 16.014 1.00 0.00 C ATOM 1998 CG MET A 128 -0.229 20.319 17.421 1.00 0.00 C ATOM 1999 SD MET A 128 0.445 21.464 18.645 1.00 0.00 S ATOM 2000 CE MET A 128 0.455 20.434 20.121 1.00 0.00 C ATOM 0 H MET A 128 0.418 22.194 13.977 1.00 0.00 H new ATOM 0 HA MET A 128 1.888 21.678 16.355 1.00 0.00 H new ATOM 0 HB2 MET A 128 -0.627 21.879 15.992 1.00 0.00 H new ATOM 0 HB3 MET A 128 -0.587 20.271 15.299 1.00 0.00 H new ATOM 0 HG2 MET A 128 -1.277 20.112 17.640 1.00 0.00 H new ATOM 0 HG3 MET A 128 0.300 19.367 17.468 1.00 0.00 H new ATOM 0 HE1 MET A 128 0.847 21.007 20.962 1.00 0.00 H new ATOM 0 HE2 MET A 128 -0.561 20.109 20.345 1.00 0.00 H new ATOM 0 HE3 MET A 128 1.086 19.561 19.951 1.00 0.00 H new ATOM 2010 N ILE A 129 2.848 19.509 16.368 1.00 0.00 N ATOM 2011 CA ILE A 129 3.532 18.235 16.589 1.00 0.00 C ATOM 2012 C ILE A 129 2.560 17.010 16.458 1.00 0.00 C ATOM 2013 O ILE A 129 1.411 17.176 16.894 1.00 0.00 O ATOM 2014 CB ILE A 129 4.393 18.158 17.902 1.00 0.00 C ATOM 2015 CG1 ILE A 129 3.620 18.096 19.256 1.00 0.00 C ATOM 2016 CG2 ILE A 129 5.470 19.268 17.939 1.00 0.00 C ATOM 2017 CD1 ILE A 129 4.294 17.185 20.292 1.00 0.00 C ATOM 0 H ILE A 129 2.968 20.152 17.151 1.00 0.00 H new ATOM 0 HA ILE A 129 4.259 18.179 15.779 1.00 0.00 H new ATOM 0 HB ILE A 129 4.861 17.177 17.826 1.00 0.00 H new ATOM 0 HG12 ILE A 129 3.536 19.102 19.666 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.606 17.740 19.073 1.00 0.00 H new ATOM 0 HG21 ILE A 129 6.047 19.185 18.860 1.00 0.00 H new ATOM 0 HG22 ILE A 129 6.136 19.158 17.083 1.00 0.00 H new ATOM 0 HG23 ILE A 129 4.987 20.245 17.900 1.00 0.00 H new ATOM 0 HD11 ILE A 129 3.709 17.184 21.211 1.00 0.00 H new ATOM 0 HD12 ILE A 129 4.354 16.170 19.899 1.00 0.00 H new ATOM 0 HD13 ILE A 129 5.298 17.553 20.502 1.00 0.00 H new ATOM 2029 N PRO A 130 2.960 15.803 15.972 1.00 0.00 N ATOM 2030 CA PRO A 130 2.047 14.636 15.949 1.00 0.00 C ATOM 2031 C PRO A 130 1.770 14.053 17.355 1.00 0.00 C ATOM 2032 O PRO A 130 2.740 13.903 18.111 1.00 0.00 O ATOM 2033 CB PRO A 130 2.807 13.669 15.059 1.00 0.00 C ATOM 2034 CG PRO A 130 4.289 14.044 15.162 1.00 0.00 C ATOM 2035 CD PRO A 130 4.288 15.562 15.354 1.00 0.00 C ATOM 0 HA PRO A 130 1.047 14.877 15.588 1.00 0.00 H new ATOM 0 HB2 PRO A 130 2.645 12.640 15.380 1.00 0.00 H new ATOM 0 HB3 PRO A 130 2.461 13.739 14.028 1.00 0.00 H new ATOM 0 HG2 PRO A 130 4.769 13.538 16.000 1.00 0.00 H new ATOM 0 HG3 PRO A 130 4.834 13.758 14.262 1.00 0.00 H new ATOM 0 HD2 PRO A 130 5.102 15.891 16.000 1.00 0.00 H new ATOM 0 HD3 PRO A 130 4.398 16.091 14.408 1.00 0.00 H new ATOM 2043 N LEU A 131 0.498 13.738 17.673 1.00 0.00 N ATOM 2044 CA LEU A 131 0.167 13.233 19.041 1.00 0.00 C ATOM 2045 C LEU A 131 -0.705 11.988 18.903 1.00 0.00 C ATOM 2046 O LEU A 131 -1.484 11.882 17.942 1.00 0.00 O ATOM 2047 CB LEU A 131 -0.566 14.334 19.891 1.00 0.00 C ATOM 2048 CG LEU A 131 0.279 15.549 20.373 1.00 0.00 C ATOM 2049 CD1 LEU A 131 -0.632 16.709 20.818 1.00 0.00 C ATOM 2050 CD2 LEU A 131 1.252 15.169 21.509 1.00 0.00 C ATOM 0 H LEU A 131 -0.296 13.816 17.037 1.00 0.00 H new ATOM 0 HA LEU A 131 1.089 12.982 19.566 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -1.399 14.716 19.300 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -0.994 13.851 20.770 1.00 0.00 H new ATOM 0 HG LEU A 131 0.878 15.875 19.523 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -0.019 17.546 21.151 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -1.254 17.025 19.981 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -1.269 16.378 21.638 1.00 0.00 H new ATOM 0 HD21 LEU A 131 1.819 16.049 21.812 1.00 0.00 H new ATOM 0 HD22 LEU A 131 0.687 14.791 22.361 1.00 0.00 H new ATOM 0 HD23 LEU A 131 1.938 14.398 21.158 1.00 0.00 H new ATOM 2062 N ASN A 132 -0.626 11.065 19.900 1.00 0.00 N ATOM 2063 CA ASN A 132 -1.513 9.867 19.877 1.00 0.00 C ATOM 2064 C ASN A 132 -2.940 10.278 20.404 1.00 0.00 C ATOM 2065 O ASN A 132 -3.268 10.064 21.577 1.00 0.00 O ATOM 2066 CB ASN A 132 -0.821 8.700 20.624 1.00 0.00 C ATOM 2067 CG ASN A 132 -1.451 7.324 20.322 1.00 0.00 C ATOM 2068 OD1 ASN A 132 -2.540 6.999 20.792 1.00 0.00 O ATOM 2069 ND2 ASN A 132 -0.792 6.492 19.530 1.00 0.00 N ATOM 0 H ASN A 132 0.011 11.119 20.695 1.00 0.00 H new ATOM 0 HA ASN A 132 -1.678 9.490 18.868 1.00 0.00 H new ATOM 0 HB2 ASN A 132 0.234 8.677 20.350 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -0.868 8.886 21.697 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -1.187 5.578 19.308 1.00 0.00 H new ATOM 0 HD22 ASN A 132 0.111 6.765 19.142 1.00 0.00 H new ATOM 2076 N TRP A 133 -3.778 10.876 19.505 1.00 0.00 N ATOM 2077 CA TRP A 133 -5.230 11.218 19.758 1.00 0.00 C ATOM 2078 C TRP A 133 -6.135 10.055 20.271 1.00 0.00 C ATOM 2079 O TRP A 133 -7.096 10.316 21.002 1.00 0.00 O ATOM 2080 CB TRP A 133 -5.911 11.848 18.502 1.00 0.00 C ATOM 2081 CG TRP A 133 -5.301 13.184 18.038 1.00 0.00 C ATOM 2082 CD1 TRP A 133 -4.380 13.349 16.980 1.00 0.00 C ATOM 2083 CD2 TRP A 133 -5.525 14.458 18.534 1.00 0.00 C ATOM 2084 NE1 TRP A 133 -4.020 14.698 16.803 1.00 0.00 N ATOM 2085 CE2 TRP A 133 -4.752 15.370 17.770 1.00 0.00 C ATOM 2086 CE3 TRP A 133 -6.347 14.924 19.591 1.00 0.00 C ATOM 2087 CZ2 TRP A 133 -4.817 16.759 18.045 1.00 0.00 C ATOM 2088 CZ3 TRP A 133 -6.388 16.295 19.847 1.00 0.00 C ATOM 2089 CH2 TRP A 133 -5.641 17.198 19.083 1.00 0.00 C ATOM 0 H TRP A 133 -3.469 11.141 18.570 1.00 0.00 H new ATOM 0 HA TRP A 133 -5.158 11.938 20.573 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -5.856 11.134 17.680 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -6.968 12.003 18.719 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -3.998 12.537 16.379 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -3.371 15.091 16.121 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -6.928 14.234 20.184 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -4.241 17.463 17.463 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -7.008 16.666 20.650 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -5.703 18.254 19.300 1.00 0.00 H new ATOM 2100 N ASP A 134 -5.773 8.809 19.906 1.00 0.00 N ATOM 2101 CA ASP A 134 -6.318 7.554 20.490 1.00 0.00 C ATOM 2102 C ASP A 134 -6.093 7.340 22.029 1.00 0.00 C ATOM 2103 O ASP A 134 -6.980 6.759 22.664 1.00 0.00 O ATOM 2104 CB ASP A 134 -5.797 6.340 19.676 1.00 0.00 C ATOM 2105 CG ASP A 134 -6.212 6.300 18.196 1.00 0.00 C ATOM 2106 OD1 ASP A 134 -7.358 5.894 17.900 1.00 0.00 O ATOM 2107 OD2 ASP A 134 -5.395 6.677 17.327 1.00 0.00 O ATOM 0 H ASP A 134 -5.077 8.637 19.180 1.00 0.00 H new ATOM 0 HA ASP A 134 -7.401 7.650 20.409 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -4.708 6.331 19.729 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -6.147 5.427 20.157 1.00 0.00 H new ATOM 2112 N ASP A 135 -4.959 7.819 22.595 1.00 0.00 N ATOM 2113 CA ASP A 135 -4.717 7.901 24.066 1.00 0.00 C ATOM 2114 C ASP A 135 -5.524 8.947 24.882 1.00 0.00 C ATOM 2115 O ASP A 135 -5.401 8.928 26.110 1.00 0.00 O ATOM 2116 CB ASP A 135 -3.192 8.080 24.335 1.00 0.00 C ATOM 2117 CG ASP A 135 -2.257 6.919 23.955 1.00 0.00 C ATOM 2118 OD1 ASP A 135 -2.715 5.761 23.826 1.00 0.00 O ATOM 2119 OD2 ASP A 135 -1.041 7.168 23.798 1.00 0.00 O ATOM 0 H ASP A 135 -4.175 8.164 22.042 1.00 0.00 H new ATOM 0 HA ASP A 135 -5.101 6.951 24.438 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -2.859 8.968 23.798 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -3.061 8.282 25.398 1.00 0.00 H new ATOM 2124 N PHE A 136 -6.324 9.823 24.248 1.00 0.00 N ATOM 2125 CA PHE A 136 -7.060 10.914 24.935 1.00 0.00 C ATOM 2126 C PHE A 136 -8.551 10.814 24.567 1.00 0.00 C ATOM 2127 O PHE A 136 -8.892 10.445 23.433 1.00 0.00 O ATOM 2128 CB PHE A 136 -6.497 12.287 24.498 1.00 0.00 C ATOM 2129 CG PHE A 136 -5.051 12.655 24.897 1.00 0.00 C ATOM 2130 CD1 PHE A 136 -3.973 12.135 24.173 1.00 0.00 C ATOM 2131 CD2 PHE A 136 -4.796 13.566 25.931 1.00 0.00 C ATOM 2132 CE1 PHE A 136 -2.665 12.482 24.499 1.00 0.00 C ATOM 2133 CE2 PHE A 136 -3.487 13.915 26.257 1.00 0.00 C ATOM 2134 CZ PHE A 136 -2.424 13.369 25.545 1.00 0.00 C ATOM 0 H PHE A 136 -6.483 9.799 23.241 1.00 0.00 H new ATOM 0 HA PHE A 136 -6.940 10.818 26.014 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -6.564 12.342 23.411 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -7.157 13.057 24.897 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -4.157 11.457 23.353 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -5.619 14.000 26.479 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -1.839 12.064 23.942 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -3.298 14.609 27.062 1.00 0.00 H new ATOM 0 HZ PHE A 136 -1.409 13.634 25.804 1.00 0.00 H new ATOM 2144 N THR A 137 -9.428 11.207 25.522 1.00 0.00 N ATOM 2145 CA THR A 137 -10.880 11.341 25.233 1.00 0.00 C ATOM 2146 C THR A 137 -11.136 12.844 24.994 1.00 0.00 C ATOM 2147 O THR A 137 -10.653 13.649 25.797 1.00 0.00 O ATOM 2148 CB THR A 137 -11.667 10.726 26.420 1.00 0.00 C ATOM 2149 OG1 THR A 137 -11.251 9.379 26.627 1.00 0.00 O ATOM 2150 CG2 THR A 137 -13.195 10.696 26.237 1.00 0.00 C ATOM 0 H THR A 137 -9.165 11.433 26.481 1.00 0.00 H new ATOM 0 HA THR A 137 -11.215 10.804 24.346 1.00 0.00 H new ATOM 0 HB THR A 137 -11.446 11.377 27.266 1.00 0.00 H new ATOM 0 HG1 THR A 137 -11.749 8.995 27.378 1.00 0.00 H new ATOM 0 HG21 THR A 137 -13.658 10.249 27.117 1.00 0.00 H new ATOM 0 HG22 THR A 137 -13.566 11.713 26.108 1.00 0.00 H new ATOM 0 HG23 THR A 137 -13.444 10.105 25.356 1.00 0.00 H new ATOM 2158 N LYS A 138 -12.027 13.200 24.022 1.00 0.00 N ATOM 2159 CA LYS A 138 -12.612 14.557 23.970 1.00 0.00 C ATOM 2160 C LYS A 138 -13.727 14.557 25.040 1.00 0.00 C ATOM 2161 O LYS A 138 -14.719 13.824 24.940 1.00 0.00 O ATOM 2162 CB LYS A 138 -13.153 14.848 22.552 1.00 0.00 C ATOM 2163 CG LYS A 138 -13.647 16.291 22.340 1.00 0.00 C ATOM 2164 CD LYS A 138 -13.741 16.752 20.870 1.00 0.00 C ATOM 2165 CE LYS A 138 -14.747 15.996 19.982 1.00 0.00 C ATOM 2166 NZ LYS A 138 -14.782 16.541 18.614 1.00 0.00 N ATOM 0 H LYS A 138 -12.345 12.574 23.282 1.00 0.00 H new ATOM 0 HA LYS A 138 -11.884 15.342 24.175 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -12.367 14.636 21.827 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -13.974 14.162 22.342 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -14.631 16.390 22.797 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -12.978 16.967 22.873 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -14.002 17.810 20.859 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -12.752 16.663 20.419 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -14.479 14.940 19.946 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -15.741 16.058 20.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -15.769 16.707 18.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -14.258 17.439 18.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -14.344 15.862 17.959 1.00 0.00 H new ATOM 2180 N VAL A 139 -13.487 15.412 26.036 1.00 0.00 N ATOM 2181 CA VAL A 139 -14.445 15.652 27.152 1.00 0.00 C ATOM 2182 C VAL A 139 -15.474 16.727 26.668 1.00 0.00 C ATOM 2183 O VAL A 139 -16.675 16.437 26.712 1.00 0.00 O ATOM 2184 CB VAL A 139 -13.694 15.949 28.505 1.00 0.00 C ATOM 2185 CG1 VAL A 139 -14.645 16.207 29.699 1.00 0.00 C ATOM 2186 CG2 VAL A 139 -12.717 14.819 28.924 1.00 0.00 C ATOM 0 H VAL A 139 -12.631 15.962 26.105 1.00 0.00 H new ATOM 0 HA VAL A 139 -15.021 14.761 27.401 1.00 0.00 H new ATOM 0 HB VAL A 139 -13.135 16.858 28.284 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -14.058 16.404 30.596 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -15.276 17.069 29.482 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -15.272 15.330 29.861 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -12.233 15.086 29.863 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -13.270 13.889 29.053 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -11.960 14.687 28.151 1.00 0.00 H new ATOM 2196 N SER A 140 -14.992 17.936 26.290 1.00 0.00 N ATOM 2197 CA SER A 140 -15.852 19.116 26.096 1.00 0.00 C ATOM 2198 C SER A 140 -15.544 19.754 24.755 1.00 0.00 C ATOM 2199 O SER A 140 -14.371 19.877 24.401 1.00 0.00 O ATOM 2200 CB SER A 140 -15.571 20.110 27.216 1.00 0.00 C ATOM 2201 OG SER A 140 -16.473 21.208 27.139 1.00 0.00 O ATOM 0 H SER A 140 -14.003 18.114 26.114 1.00 0.00 H new ATOM 0 HA SER A 140 -16.901 18.822 26.115 1.00 0.00 H new ATOM 0 HB2 SER A 140 -15.670 19.616 28.183 1.00 0.00 H new ATOM 0 HB3 SER A 140 -14.544 20.468 27.144 1.00 0.00 H new ATOM 0 HG SER A 140 -16.283 21.839 27.865 1.00 0.00 H new ATOM 2207 N SER A 141 -16.605 20.153 24.022 1.00 0.00 N ATOM 2208 CA SER A 141 -16.464 20.764 22.680 1.00 0.00 C ATOM 2209 C SER A 141 -17.488 21.909 22.569 1.00 0.00 C ATOM 2210 O SER A 141 -18.691 21.667 22.748 1.00 0.00 O ATOM 2211 CB SER A 141 -16.723 19.682 21.622 1.00 0.00 C ATOM 2212 OG SER A 141 -16.529 20.193 20.313 1.00 0.00 O ATOM 0 H SER A 141 -17.571 20.063 24.337 1.00 0.00 H new ATOM 0 HA SER A 141 -15.463 21.167 22.524 1.00 0.00 H new ATOM 0 HB2 SER A 141 -16.054 18.838 21.789 1.00 0.00 H new ATOM 0 HB3 SER A 141 -17.741 19.307 21.722 1.00 0.00 H new ATOM 0 HG SER A 141 -16.698 19.485 19.657 1.00 0.00 H new ATOM 2218 N ARG A 142 -17.009 23.146 22.302 1.00 0.00 N ATOM 2219 CA ARG A 142 -17.887 24.341 22.206 1.00 0.00 C ATOM 2220 C ARG A 142 -17.495 25.024 20.873 1.00 0.00 C ATOM 2221 O ARG A 142 -16.350 25.459 20.728 1.00 0.00 O ATOM 2222 CB ARG A 142 -17.656 25.239 23.459 1.00 0.00 C ATOM 2223 CG ARG A 142 -18.590 26.464 23.511 1.00 0.00 C ATOM 2224 CD ARG A 142 -18.565 27.263 24.833 1.00 0.00 C ATOM 2225 NE ARG A 142 -17.313 28.028 25.089 1.00 0.00 N ATOM 2226 CZ ARG A 142 -17.115 29.319 24.751 1.00 0.00 C ATOM 2227 NH1 ARG A 142 -17.966 30.040 24.024 1.00 0.00 N ATOM 2228 NH2 ARG A 142 -16.007 29.903 25.167 1.00 0.00 N ATOM 0 H ARG A 142 -16.020 23.345 22.149 1.00 0.00 H new ATOM 0 HA ARG A 142 -18.953 24.112 22.198 1.00 0.00 H new ATOM 0 HB2 ARG A 142 -17.802 24.641 24.358 1.00 0.00 H new ATOM 0 HB3 ARG A 142 -16.621 25.579 23.468 1.00 0.00 H new ATOM 0 HG2 ARG A 142 -18.325 27.136 22.695 1.00 0.00 H new ATOM 0 HG3 ARG A 142 -19.611 26.129 23.328 1.00 0.00 H new ATOM 0 HD2 ARG A 142 -19.404 27.959 24.834 1.00 0.00 H new ATOM 0 HD3 ARG A 142 -18.724 26.571 25.660 1.00 0.00 H new ATOM 0 HE ARG A 142 -16.548 27.539 25.555 1.00 0.00 H new ATOM 0 HH11 ARG A 142 -18.831 29.619 23.686 1.00 0.00 H new ATOM 0 HH12 ARG A 142 -17.753 31.013 23.805 1.00 0.00 H new ATOM 0 HH21 ARG A 142 -15.333 29.379 25.725 1.00 0.00 H new ATOM 0 HH22 ARG A 142 -15.825 30.878 24.930 1.00 0.00 H new ATOM 2242 N THR A 143 -18.469 25.187 19.964 1.00 0.00 N ATOM 2243 CA THR A 143 -18.248 25.869 18.665 1.00 0.00 C ATOM 2244 C THR A 143 -18.662 27.369 18.803 1.00 0.00 C ATOM 2245 O THR A 143 -19.614 27.733 19.504 1.00 0.00 O ATOM 2246 CB THR A 143 -18.967 25.055 17.553 1.00 0.00 C ATOM 2247 OG1 THR A 143 -18.546 23.693 17.587 1.00 0.00 O ATOM 2248 CG2 THR A 143 -18.705 25.549 16.117 1.00 0.00 C ATOM 0 H THR A 143 -19.424 24.856 20.100 1.00 0.00 H new ATOM 0 HA THR A 143 -17.200 25.897 18.368 1.00 0.00 H new ATOM 0 HB THR A 143 -20.027 25.182 17.773 1.00 0.00 H new ATOM 0 HG1 THR A 143 -17.624 23.627 17.260 1.00 0.00 H new ATOM 0 HG21 THR A 143 -19.248 24.920 15.411 1.00 0.00 H new ATOM 0 HG22 THR A 143 -19.044 26.580 16.019 1.00 0.00 H new ATOM 0 HG23 THR A 143 -17.637 25.496 15.903 1.00 0.00 H new ATOM 2256 N VAL A 144 -17.918 28.183 18.033 1.00 0.00 N ATOM 2257 CA VAL A 144 -18.104 29.648 17.919 1.00 0.00 C ATOM 2258 C VAL A 144 -18.072 29.857 16.388 1.00 0.00 C ATOM 2259 O VAL A 144 -17.074 29.525 15.738 1.00 0.00 O ATOM 2260 CB VAL A 144 -17.018 30.469 18.693 1.00 0.00 C ATOM 2261 CG1 VAL A 144 -17.165 31.996 18.495 1.00 0.00 C ATOM 2262 CG2 VAL A 144 -16.999 30.176 20.214 1.00 0.00 C ATOM 0 H VAL A 144 -17.151 27.836 17.457 1.00 0.00 H new ATOM 0 HA VAL A 144 -19.024 30.009 18.379 1.00 0.00 H new ATOM 0 HB VAL A 144 -16.076 30.137 18.257 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -16.385 32.512 19.055 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -17.071 32.236 17.436 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -18.143 32.317 18.854 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -16.224 30.777 20.691 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -17.969 30.426 20.645 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -16.791 29.119 20.378 1.00 0.00 H new ATOM 2272 N GLU A 145 -19.126 30.504 15.867 1.00 0.00 N ATOM 2273 CA GLU A 145 -19.205 30.811 14.410 1.00 0.00 C ATOM 2274 C GLU A 145 -18.742 32.262 14.187 1.00 0.00 C ATOM 2275 O GLU A 145 -19.189 33.170 14.901 1.00 0.00 O ATOM 2276 CB GLU A 145 -20.621 30.624 13.841 1.00 0.00 C ATOM 2277 CG GLU A 145 -21.092 29.155 13.742 1.00 0.00 C ATOM 2278 CD GLU A 145 -22.469 29.012 13.092 1.00 0.00 C ATOM 2279 OE1 GLU A 145 -23.487 29.048 13.819 1.00 0.00 O ATOM 2280 OE2 GLU A 145 -22.542 28.864 11.852 1.00 0.00 O ATOM 0 H GLU A 145 -19.927 30.824 16.412 1.00 0.00 H new ATOM 0 HA GLU A 145 -18.558 30.110 13.883 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -21.324 31.175 14.466 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -20.660 31.071 12.848 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -20.364 28.584 13.167 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -21.121 28.720 14.741 1.00 0.00 H new ATOM 2287 N ASP A 146 -17.877 32.445 13.169 1.00 0.00 N ATOM 2288 CA ASP A 146 -17.336 33.782 12.805 1.00 0.00 C ATOM 2289 C ASP A 146 -17.852 34.154 11.392 1.00 0.00 C ATOM 2290 O ASP A 146 -17.953 33.281 10.518 1.00 0.00 O ATOM 2291 CB ASP A 146 -15.795 33.714 12.884 1.00 0.00 C ATOM 2292 CG ASP A 146 -15.097 35.081 12.901 1.00 0.00 C ATOM 2293 OD1 ASP A 146 -14.821 35.638 11.817 1.00 0.00 O ATOM 2294 OD2 ASP A 146 -14.818 35.601 14.004 1.00 0.00 O ATOM 0 H ASP A 146 -17.534 31.686 12.580 1.00 0.00 H new ATOM 0 HA ASP A 146 -17.670 34.562 13.489 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -15.514 33.166 13.783 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -15.425 33.142 12.033 1.00 0.00 H new ATOM 2299 N THR A 147 -18.120 35.461 11.162 1.00 0.00 N ATOM 2300 CA THR A 147 -18.563 35.980 9.820 1.00 0.00 C ATOM 2301 C THR A 147 -17.514 35.866 8.672 1.00 0.00 C ATOM 2302 O THR A 147 -17.941 35.860 7.511 1.00 0.00 O ATOM 2303 CB THR A 147 -19.057 37.447 9.864 1.00 0.00 C ATOM 2304 OG1 THR A 147 -18.028 38.313 10.337 1.00 0.00 O ATOM 2305 CG2 THR A 147 -20.319 37.668 10.719 1.00 0.00 C ATOM 0 H THR A 147 -18.041 36.183 11.878 1.00 0.00 H new ATOM 0 HA THR A 147 -19.387 35.306 9.586 1.00 0.00 H new ATOM 0 HB THR A 147 -19.323 37.683 8.834 1.00 0.00 H new ATOM 0 HG1 THR A 147 -18.359 39.235 10.356 1.00 0.00 H new ATOM 0 HG21 THR A 147 -20.595 38.722 10.694 1.00 0.00 H new ATOM 0 HG22 THR A 147 -21.138 37.069 10.321 1.00 0.00 H new ATOM 0 HG23 THR A 147 -20.118 37.370 11.748 1.00 0.00 H new ATOM 2313 N ASN A 148 -16.197 35.689 8.980 1.00 0.00 N ATOM 2314 CA ASN A 148 -15.267 34.992 8.067 1.00 0.00 C ATOM 2315 C ASN A 148 -15.454 33.455 8.333 1.00 0.00 C ATOM 2316 O ASN A 148 -15.110 33.051 9.455 1.00 0.00 O ATOM 2317 CB ASN A 148 -13.816 35.438 8.257 1.00 0.00 C ATOM 2318 CG ASN A 148 -12.752 34.897 7.272 1.00 0.00 C ATOM 2319 OD1 ASN A 148 -12.999 34.052 6.410 1.00 0.00 O ATOM 2320 ND2 ASN A 148 -11.526 35.381 7.391 1.00 0.00 N ATOM 0 H ASN A 148 -15.768 36.018 9.845 1.00 0.00 H new ATOM 0 HA ASN A 148 -15.495 35.237 7.030 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -13.793 36.527 8.208 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -13.510 35.158 9.265 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -10.786 35.054 6.769 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -11.321 36.081 8.104 1.00 0.00 H new ATOM 2327 N PRO A 149 -16.007 32.596 7.416 1.00 0.00 N ATOM 2328 CA PRO A 149 -16.229 31.153 7.747 1.00 0.00 C ATOM 2329 C PRO A 149 -14.979 30.222 7.949 1.00 0.00 C ATOM 2330 O PRO A 149 -15.115 29.244 8.691 1.00 0.00 O ATOM 2331 CB PRO A 149 -17.131 30.708 6.601 1.00 0.00 C ATOM 2332 CG PRO A 149 -16.793 31.621 5.416 1.00 0.00 C ATOM 2333 CD PRO A 149 -16.466 32.978 6.043 1.00 0.00 C ATOM 0 HA PRO A 149 -16.647 31.058 8.749 1.00 0.00 H new ATOM 0 HB2 PRO A 149 -16.955 29.662 6.350 1.00 0.00 H new ATOM 0 HB3 PRO A 149 -18.182 30.798 6.875 1.00 0.00 H new ATOM 0 HG2 PRO A 149 -15.947 31.234 4.848 1.00 0.00 H new ATOM 0 HG3 PRO A 149 -17.632 31.697 4.725 1.00 0.00 H new ATOM 0 HD2 PRO A 149 -15.691 33.506 5.488 1.00 0.00 H new ATOM 0 HD3 PRO A 149 -17.337 33.632 6.073 1.00 0.00 H new ATOM 2341 N ALA A 150 -13.796 30.539 7.356 1.00 0.00 N ATOM 2342 CA ALA A 150 -12.463 29.999 7.781 1.00 0.00 C ATOM 2343 C ALA A 150 -12.036 30.166 9.290 1.00 0.00 C ATOM 2344 O ALA A 150 -11.200 29.401 9.778 1.00 0.00 O ATOM 2345 CB ALA A 150 -11.394 30.660 6.876 1.00 0.00 C ATOM 0 H ALA A 150 -13.734 31.180 6.565 1.00 0.00 H new ATOM 0 HA ALA A 150 -12.550 28.918 7.673 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -10.406 30.293 7.153 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -11.595 30.411 5.834 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -11.428 31.742 7.003 1.00 0.00 H new ATOM 2351 N LEU A 151 -12.632 31.163 9.972 1.00 0.00 N ATOM 2352 CA LEU A 151 -12.450 31.530 11.401 1.00 0.00 C ATOM 2353 C LEU A 151 -13.462 30.986 12.433 1.00 0.00 C ATOM 2354 O LEU A 151 -13.165 31.052 13.632 1.00 0.00 O ATOM 2355 CB LEU A 151 -12.374 33.094 11.524 1.00 0.00 C ATOM 2356 CG LEU A 151 -11.177 33.872 10.904 1.00 0.00 C ATOM 2357 CD1 LEU A 151 -11.264 35.374 11.256 1.00 0.00 C ATOM 2358 CD2 LEU A 151 -9.794 33.359 11.337 1.00 0.00 C ATOM 0 H LEU A 151 -13.301 31.780 9.512 1.00 0.00 H new ATOM 0 HA LEU A 151 -11.523 31.026 11.674 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -13.285 33.497 11.082 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -12.401 33.336 12.586 1.00 0.00 H new ATOM 0 HG LEU A 151 -11.265 33.708 9.830 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -10.419 35.901 10.814 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -12.194 35.786 10.864 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -11.241 35.496 12.339 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -9.018 33.957 10.859 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -9.699 33.440 12.420 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -9.683 32.316 11.040 1.00 0.00 H new ATOM 2370 N THR A 152 -14.585 30.386 11.988 1.00 0.00 N ATOM 2371 CA THR A 152 -15.442 29.479 12.788 1.00 0.00 C ATOM 2372 C THR A 152 -14.570 28.385 13.445 1.00 0.00 C ATOM 2373 O THR A 152 -13.805 27.722 12.749 1.00 0.00 O ATOM 2374 CB THR A 152 -16.504 28.869 11.838 1.00 0.00 C ATOM 2375 OG1 THR A 152 -17.344 29.901 11.327 1.00 0.00 O ATOM 2376 CG2 THR A 152 -17.418 27.789 12.453 1.00 0.00 C ATOM 0 H THR A 152 -14.932 30.521 11.038 1.00 0.00 H new ATOM 0 HA THR A 152 -15.946 30.019 13.590 1.00 0.00 H new ATOM 0 HB THR A 152 -15.916 28.375 11.065 1.00 0.00 H new ATOM 0 HG1 THR A 152 -18.012 29.511 10.726 1.00 0.00 H new ATOM 0 HG21 THR A 152 -18.120 27.434 11.699 1.00 0.00 H new ATOM 0 HG22 THR A 152 -16.810 26.955 12.804 1.00 0.00 H new ATOM 0 HG23 THR A 152 -17.970 28.214 13.292 1.00 0.00 H new ATOM 2384 N HIS A 153 -14.699 28.268 14.768 1.00 0.00 N ATOM 2385 CA HIS A 153 -13.730 27.509 15.596 1.00 0.00 C ATOM 2386 C HIS A 153 -14.438 26.705 16.691 1.00 0.00 C ATOM 2387 O HIS A 153 -15.442 27.167 17.238 1.00 0.00 O ATOM 2388 CB HIS A 153 -12.664 28.463 16.189 1.00 0.00 C ATOM 2389 CG HIS A 153 -13.127 29.607 17.116 1.00 0.00 C ATOM 2390 ND1 HIS A 153 -13.535 30.854 16.663 1.00 0.00 N ATOM 2391 CD2 HIS A 153 -13.056 29.614 18.521 1.00 0.00 C ATOM 2392 CE1 HIS A 153 -13.622 31.531 17.848 1.00 0.00 C ATOM 2393 NE2 HIS A 153 -13.371 30.869 19.015 1.00 0.00 N ATOM 0 H HIS A 153 -15.463 28.686 15.300 1.00 0.00 H new ATOM 0 HA HIS A 153 -13.221 26.791 14.953 1.00 0.00 H new ATOM 0 HB2 HIS A 153 -11.950 27.856 16.745 1.00 0.00 H new ATOM 0 HB3 HIS A 153 -12.122 28.911 15.356 1.00 0.00 H new ATOM 0 HD1 HIS A 153 -13.719 31.175 15.713 1.00 0.00 H new ATOM 0 HD2 HIS A 153 -12.793 28.761 19.129 1.00 0.00 H new ATOM 0 HE1 HIS A 153 -13.886 32.578 17.860 1.00 0.00 H new ATOM 0 HE2 HIS A 153 -13.406 31.204 19.978 1.00 0.00 H new ATOM 2402 N THR A 154 -13.852 25.549 17.039 1.00 0.00 N ATOM 2403 CA THR A 154 -14.328 24.722 18.157 1.00 0.00 C ATOM 2404 C THR A 154 -13.201 24.702 19.222 1.00 0.00 C ATOM 2405 O THR A 154 -12.060 24.349 18.910 1.00 0.00 O ATOM 2406 CB THR A 154 -14.711 23.340 17.585 1.00 0.00 C ATOM 2407 OG1 THR A 154 -15.641 23.464 16.511 1.00 0.00 O ATOM 2408 CG2 THR A 154 -15.374 22.429 18.625 1.00 0.00 C ATOM 0 H THR A 154 -13.040 25.164 16.556 1.00 0.00 H new ATOM 0 HA THR A 154 -15.220 25.106 18.651 1.00 0.00 H new ATOM 0 HB THR A 154 -13.769 22.903 17.252 1.00 0.00 H new ATOM 0 HG1 THR A 154 -15.864 22.574 16.167 1.00 0.00 H new ATOM 0 HG21 THR A 154 -15.621 21.472 18.166 1.00 0.00 H new ATOM 0 HG22 THR A 154 -14.688 22.266 19.456 1.00 0.00 H new ATOM 0 HG23 THR A 154 -16.285 22.900 18.994 1.00 0.00 H new ATOM 2416 N TYR A 155 -13.608 24.963 20.480 1.00 0.00 N ATOM 2417 CA TYR A 155 -12.749 24.781 21.679 1.00 0.00 C ATOM 2418 C TYR A 155 -12.976 23.371 22.227 1.00 0.00 C ATOM 2419 O TYR A 155 -14.124 23.019 22.524 1.00 0.00 O ATOM 2420 CB TYR A 155 -13.111 25.801 22.798 1.00 0.00 C ATOM 2421 CG TYR A 155 -12.914 27.296 22.492 1.00 0.00 C ATOM 2422 CD1 TYR A 155 -11.640 27.785 22.195 1.00 0.00 C ATOM 2423 CD2 TYR A 155 -13.989 28.189 22.573 1.00 0.00 C ATOM 2424 CE1 TYR A 155 -11.437 29.145 21.986 1.00 0.00 C ATOM 2425 CE2 TYR A 155 -13.782 29.553 22.381 1.00 0.00 C ATOM 2426 CZ TYR A 155 -12.504 30.030 22.102 1.00 0.00 C ATOM 2427 OH TYR A 155 -12.291 31.371 21.961 1.00 0.00 O ATOM 0 H TYR A 155 -14.543 25.307 20.699 1.00 0.00 H new ATOM 0 HA TYR A 155 -11.711 24.937 21.386 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -14.156 25.648 23.066 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -12.517 25.558 23.679 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -10.806 27.102 22.127 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -14.981 27.819 22.785 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -10.453 29.513 21.734 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -14.612 30.240 22.449 1.00 0.00 H new ATOM 0 HH TYR A 155 -13.149 31.826 21.829 1.00 0.00 H new ATOM 2437 N GLU A 156 -11.890 22.597 22.358 1.00 0.00 N ATOM 2438 CA GLU A 156 -11.990 21.146 22.661 1.00 0.00 C ATOM 2439 C GLU A 156 -11.006 20.858 23.792 1.00 0.00 C ATOM 2440 O GLU A 156 -9.826 21.228 23.720 1.00 0.00 O ATOM 2441 CB GLU A 156 -11.716 20.189 21.482 1.00 0.00 C ATOM 2442 CG GLU A 156 -12.623 20.399 20.243 1.00 0.00 C ATOM 2443 CD GLU A 156 -12.397 19.474 19.042 1.00 0.00 C ATOM 2444 OE1 GLU A 156 -11.393 18.731 18.995 1.00 0.00 O ATOM 2445 OE2 GLU A 156 -13.242 19.496 18.122 1.00 0.00 O ATOM 0 H GLU A 156 -10.934 22.940 22.261 1.00 0.00 H new ATOM 0 HA GLU A 156 -13.029 20.950 22.926 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -10.676 20.303 21.176 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -11.835 19.163 21.831 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -13.660 20.291 20.562 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -12.499 21.428 19.905 1.00 0.00 H new ATOM 2452 N VAL A 157 -11.530 20.161 24.809 1.00 0.00 N ATOM 2453 CA VAL A 157 -10.755 19.785 26.019 1.00 0.00 C ATOM 2454 C VAL A 157 -10.602 18.273 25.792 1.00 0.00 C ATOM 2455 O VAL A 157 -11.623 17.572 25.717 1.00 0.00 O ATOM 2456 CB VAL A 157 -11.483 20.145 27.358 1.00 0.00 C ATOM 2457 CG1 VAL A 157 -10.690 19.706 28.613 1.00 0.00 C ATOM 2458 CG2 VAL A 157 -11.811 21.652 27.492 1.00 0.00 C ATOM 0 H VAL A 157 -12.498 19.839 24.825 1.00 0.00 H new ATOM 0 HA VAL A 157 -9.811 20.318 26.133 1.00 0.00 H new ATOM 0 HB VAL A 157 -12.416 19.584 27.307 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -11.245 19.983 29.509 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -10.547 18.626 28.594 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -9.719 20.200 28.621 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -12.314 21.832 28.442 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -10.888 22.230 27.456 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -12.462 21.957 26.673 1.00 0.00 H new ATOM 2468 N TRP A 158 -9.344 17.801 25.762 1.00 0.00 N ATOM 2469 CA TRP A 158 -9.098 16.338 25.734 1.00 0.00 C ATOM 2470 C TRP A 158 -8.325 15.958 26.997 1.00 0.00 C ATOM 2471 O TRP A 158 -7.494 16.745 27.463 1.00 0.00 O ATOM 2472 CB TRP A 158 -8.374 15.878 24.458 1.00 0.00 C ATOM 2473 CG TRP A 158 -9.048 16.104 23.088 1.00 0.00 C ATOM 2474 CD1 TRP A 158 -9.374 17.349 22.503 1.00 0.00 C ATOM 2475 CD2 TRP A 158 -9.361 15.159 22.117 1.00 0.00 C ATOM 2476 NE1 TRP A 158 -9.911 17.201 21.214 1.00 0.00 N ATOM 2477 CE2 TRP A 158 -9.883 15.840 20.987 1.00 0.00 C ATOM 2478 CE3 TRP A 158 -9.210 13.747 22.090 1.00 0.00 C ATOM 2479 CZ2 TRP A 158 -10.260 15.119 19.829 1.00 0.00 C ATOM 2480 CZ3 TRP A 158 -9.599 13.054 20.944 1.00 0.00 C ATOM 2481 CH2 TRP A 158 -10.116 13.730 19.830 1.00 0.00 C ATOM 0 H TRP A 158 -8.505 18.382 25.756 1.00 0.00 H new ATOM 0 HA TRP A 158 -10.057 15.820 25.716 1.00 0.00 H new ATOM 0 HB2 TRP A 158 -7.405 16.376 24.433 1.00 0.00 H new ATOM 0 HB3 TRP A 158 -8.181 14.810 24.557 1.00 0.00 H new ATOM 0 HD1 TRP A 158 -9.227 18.302 22.990 1.00 0.00 H new ATOM 0 HE1 TRP A 158 -10.246 17.933 20.588 1.00 0.00 H new ATOM 0 HE3 TRP A 158 -8.802 13.220 22.940 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 -10.651 15.632 18.963 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 -9.500 11.979 20.914 1.00 0.00 H new ATOM 0 HH2 TRP A 158 -10.408 13.166 18.956 1.00 0.00 H new ATOM 2492 N GLN A 159 -8.606 14.758 27.547 1.00 0.00 N ATOM 2493 CA GLN A 159 -7.934 14.295 28.788 1.00 0.00 C ATOM 2494 C GLN A 159 -7.512 12.841 28.552 1.00 0.00 C ATOM 2495 O GLN A 159 -8.284 12.006 28.065 1.00 0.00 O ATOM 2496 CB GLN A 159 -8.833 14.419 30.040 1.00 0.00 C ATOM 2497 CG GLN A 159 -9.077 15.873 30.516 1.00 0.00 C ATOM 2498 CD GLN A 159 -9.922 15.985 31.797 1.00 0.00 C ATOM 2499 OE1 GLN A 159 -9.657 15.332 32.807 1.00 0.00 O ATOM 2500 NE2 GLN A 159 -10.939 16.834 31.799 1.00 0.00 N ATOM 0 H GLN A 159 -9.282 14.098 27.162 1.00 0.00 H new ATOM 0 HA GLN A 159 -7.071 14.929 28.993 1.00 0.00 H new ATOM 0 HB2 GLN A 159 -9.796 13.954 29.828 1.00 0.00 H new ATOM 0 HB3 GLN A 159 -8.379 13.855 30.855 1.00 0.00 H new ATOM 0 HG2 GLN A 159 -8.114 16.354 30.687 1.00 0.00 H new ATOM 0 HG3 GLN A 159 -9.572 16.426 29.718 1.00 0.00 H new ATOM 0 HE21 GLN A 159 -11.155 17.373 30.960 1.00 0.00 H new ATOM 0 HE22 GLN A 159 -11.506 16.949 32.639 1.00 0.00 H new ATOM 2509 N LYS A 160 -6.267 12.569 28.975 1.00 0.00 N ATOM 2510 CA LYS A 160 -5.554 11.304 28.739 1.00 0.00 C ATOM 2511 C LYS A 160 -6.250 10.118 29.470 1.00 0.00 C ATOM 2512 O LYS A 160 -6.619 10.253 30.643 1.00 0.00 O ATOM 2513 CB LYS A 160 -4.056 11.476 29.137 1.00 0.00 C ATOM 2514 CG LYS A 160 -3.233 10.573 28.212 1.00 0.00 C ATOM 2515 CD LYS A 160 -1.715 10.811 28.276 1.00 0.00 C ATOM 2516 CE LYS A 160 -0.967 10.023 27.184 1.00 0.00 C ATOM 2517 NZ LYS A 160 0.484 10.274 27.237 1.00 0.00 N ATOM 0 H LYS A 160 -5.714 13.242 29.505 1.00 0.00 H new ATOM 0 HA LYS A 160 -5.589 11.054 27.679 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -3.748 12.516 29.033 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -3.901 11.201 30.180 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -3.436 9.533 28.466 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -3.569 10.722 27.186 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -1.509 11.875 28.162 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -1.342 10.517 29.257 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -1.158 8.957 27.307 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -1.351 10.304 26.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 0.958 9.729 26.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 0.666 11.288 27.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 0.853 9.983 28.165 1.00 0.00 H new ATOM 2531 N LYS A 161 -6.375 8.988 28.751 1.00 0.00 N ATOM 2532 CA LYS A 161 -7.096 7.773 29.289 1.00 0.00 C ATOM 2533 C LYS A 161 -6.224 7.044 30.393 1.00 0.00 C ATOM 2534 O LYS A 161 -4.992 7.126 30.286 1.00 0.00 O ATOM 2535 CB LYS A 161 -7.363 6.787 28.119 1.00 0.00 C ATOM 2536 CG LYS A 161 -8.367 7.293 27.065 1.00 0.00 C ATOM 2537 CD LYS A 161 -8.598 6.287 25.918 1.00 0.00 C ATOM 2538 CE LYS A 161 -9.610 6.784 24.866 1.00 0.00 C ATOM 2539 NZ LYS A 161 -9.840 5.778 23.814 1.00 0.00 N ATOM 0 H LYS A 161 -6.000 8.870 27.810 1.00 0.00 H new ATOM 0 HA LYS A 161 -8.035 8.093 29.742 1.00 0.00 H new ATOM 0 HB2 LYS A 161 -6.417 6.568 27.624 1.00 0.00 H new ATOM 0 HB3 LYS A 161 -7.732 5.848 28.531 1.00 0.00 H new ATOM 0 HG2 LYS A 161 -9.319 7.506 27.551 1.00 0.00 H new ATOM 0 HG3 LYS A 161 -8.005 8.233 26.649 1.00 0.00 H new ATOM 0 HD2 LYS A 161 -7.647 6.081 25.428 1.00 0.00 H new ATOM 0 HD3 LYS A 161 -8.952 5.345 26.336 1.00 0.00 H new ATOM 0 HE2 LYS A 161 -10.555 7.023 25.354 1.00 0.00 H new ATOM 0 HE3 LYS A 161 -9.243 7.706 24.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 -10.730 5.990 23.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 -9.053 5.800 23.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 -9.899 4.833 24.244 1.00 0.00 H new ATOM 2553 N ALA A 162 -6.795 6.303 31.398 1.00 0.00 N ATOM 2554 CA ALA A 162 -5.978 5.506 32.383 1.00 0.00 C ATOM 2555 C ALA A 162 -5.197 4.340 31.728 1.00 0.00 C ATOM 2556 O ALA A 162 -4.101 4.011 32.231 1.00 0.00 O ATOM 2557 CB ALA A 162 -6.866 4.876 33.468 1.00 0.00 C ATOM 2558 OXT ALA A 162 -5.671 3.758 30.721 1.00 0.00 O ATOM 0 H ALA A 162 -7.802 6.240 31.548 1.00 0.00 H new ATOM 0 HA ALA A 162 -5.278 6.227 32.804 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -6.246 4.308 34.162 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -7.391 5.662 34.011 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -7.592 4.210 33.002 1.00 0.00 H new TER 2564 ALA A 162 HETATM 2565 N1 BDM A 163 -4.508 31.289 21.030 1.00 0.00 N HETATM 2566 C2 BDM A 163 -4.473 30.040 21.467 1.00 0.00 C HETATM 2567 N2 BDM A 163 -5.607 29.515 21.900 1.00 0.00 N HETATM 2568 N3 BDM A 163 -3.402 29.278 21.578 1.00 0.00 N HETATM 2569 C4 BDM A 163 -2.224 29.807 21.269 1.00 0.00 C HETATM 2570 N4 BDM A 163 -1.144 29.045 21.423 1.00 0.00 N HETATM 2571 C5 BDM A 163 -2.127 31.162 20.833 1.00 0.00 C HETATM 2572 C6 BDM A 163 -3.352 31.858 20.701 1.00 0.00 C HETATM 2573 C7 BDM A 163 -0.798 31.900 20.648 1.00 0.00 C HETATM 2574 C8 BDM A 163 -0.787 33.403 20.814 1.00 0.00 C HETATM 2575 C9 BDM A 163 -1.249 34.208 21.861 1.00 0.00 C HETATM 2576 C10 BDM A 163 -1.062 35.601 21.812 1.00 0.00 C HETATM 2577 O10 BDM A 163 -1.412 36.510 22.786 1.00 0.00 O HETATM 2578 C11 BDM A 163 -0.452 36.162 20.700 1.00 0.00 C HETATM 2579 BR11 BDM A 163 -0.320 38.071 20.504 1.00 0.00 BR HETATM 2580 C12 BDM A 163 0.087 35.350 19.716 1.00 0.00 C HETATM 2581 O12 BDM A 163 0.804 35.908 18.686 1.00 0.00 O HETATM 2582 C13 BDM A 163 -0.091 33.975 19.778 1.00 0.00 C HETATM 2583 C14 BDM A 163 2.209 35.700 18.828 1.00 0.00 C HETATM 2584 C15 BDM A 163 -2.404 36.351 23.811 1.00 0.00 C HETATM 2585 C16 BDM A 163 -2.809 37.788 24.194 1.00 0.00 C HETATM 2586 C17 BDM A 163 -3.508 37.993 25.549 1.00 0.00 C HETATM 2587 C18 BDM A 163 -3.754 39.497 25.843 1.00 0.00 C HETATM 2588 C19 BDM A 163 -5.178 39.879 25.396 1.00 0.00 C HETATM 2589 C20 BDM A 163 -5.382 39.702 23.879 1.00 0.00 C HETATM 2590 C21 BDM A 163 -3.493 39.928 27.304 1.00 0.00 C HETATM 2591 OXV BDM A 163 -3.278 41.139 27.535 1.00 0.00 O HETATM 2592 OXW BDM A 163 -3.489 39.075 28.218 1.00 0.00 O HETATM 2593 C22 BDM A 163 -6.762 40.137 23.363 1.00 0.00 C HETATM 2594 OX5 BDM A 163 -7.445 39.313 22.716 1.00 0.00 O HETATM 2595 OX6 BDM A 163 -7.160 41.303 23.581 1.00 0.00 O HETATM 0 HN42 BDM A 163 -0.221 29.416 21.196 1.00 0.00 H new HETATM 0 HN41 BDM A 163 -1.239 28.090 21.768 1.00 0.00 H new HETATM 0 HN22 BDM A 163 -5.626 28.555 22.246 1.00 0.00 H new HETATM 0 HN21 BDM A 163 -6.463 30.070 21.888 1.00 0.00 H new HETATM 0 H202 BDM A 163 -4.616 40.273 23.354 1.00 0.00 H new HETATM 0 H201 BDM A 163 -5.228 38.653 23.625 1.00 0.00 H new HETATM 0 H192 BDM A 163 -5.902 39.265 25.932 1.00 0.00 H new HETATM 0 H191 BDM A 163 -5.376 40.916 25.668 1.00 0.00 H new HETATM 0 H172 BDM A 163 -4.459 37.461 25.553 1.00 0.00 H new HETATM 0 H171 BDM A 163 -2.898 37.561 26.343 1.00 0.00 H new HETATM 0 H162 BDM A 163 -1.910 38.405 24.183 1.00 0.00 H new HETATM 0 H161 BDM A 163 -3.468 38.171 23.415 1.00 0.00 H new HETATM 0 H152 BDM A 163 -3.260 35.782 23.448 1.00 0.00 H new HETATM 0 H151 BDM A 163 -2.003 35.811 24.669 1.00 0.00 H new HETATM 0 H143 BDM A 163 2.551 36.151 19.760 1.00 0.00 H new HETATM 0 H142 BDM A 163 2.419 34.630 18.844 1.00 0.00 H new HETATM 0 H141 BDM A 163 2.731 36.160 17.989 1.00 0.00 H new HETATM 0 HN1 BDM A 163 -5.389 31.796 20.949 1.00 0.00 H new HETATM 0 H9 BDM A 163 -1.754 33.756 22.715 1.00 0.00 H new HETATM 0 H72 BDM A 163 -0.083 31.481 21.356 1.00 0.00 H new HETATM 0 H71 BDM A 163 -0.427 31.673 19.649 1.00 0.00 H new HETATM 0 H6 BDM A 163 -3.348 32.880 20.322 1.00 0.00 H new HETATM 0 H18 BDM A 163 -3.012 40.047 25.264 1.00 0.00 H new HETATM 0 H13 BDM A 163 0.327 33.342 18.995 1.00 0.00 H new CONECT 2565 2566 2572 2596 CONECT 2566 2565 2567 2568 CONECT 2567 2566 2597 2598 CONECT 2568 2566 2569 CONECT 2569 2568 2570 2571 CONECT 2570 2569 2599 2600 CONECT 2571 2569 2572 2573 CONECT 2572 2565 2571 2601 CONECT 2573 2571 2574 2602 2603 CONECT 2574 2573 2575 2582 CONECT 2575 2574 2576 2604 CONECT 2576 2575 2577 2578 CONECT 2577 2576 2584 CONECT 2578 2576 2579 2580 CONECT 2579 2578 CONECT 2580 2578 2581 2582 CONECT 2581 2580 2583 CONECT 2582 2574 2580 2605 CONECT 2583 2581 2606 2607 2608 CONECT 2584 2577 2585 2609 2610 CONECT 2585 2584 2586 2611 2612 CONECT 2586 2585 2587 2613 2614 CONECT 2587 2586 2588 2590 2615 CONECT 2588 2587 2589 2616 2617 CONECT 2589 2588 2593 2618 2619 CONECT 2590 2587 2591 2592 CONECT 2591 2590 CONECT 2592 2590 CONECT 2593 2589 2594 2595 CONECT 2594 2593 CONECT 2595 2593 CONECT 2596 2565 CONECT 2597 2567 CONECT 2598 2567 CONECT 2599 2570 CONECT 2600 2570 CONECT 2601 2572 CONECT 2602 2573 CONECT 2603 2573 CONECT 2604 2575 CONECT 2605 2582 CONECT 2606 2583 CONECT 2607 2583 CONECT 2608 2583 CONECT 2609 2584 CONECT 2610 2584 CONECT 2611 2585 CONECT 2612 2585 CONECT 2613 2586 CONECT 2614 2586 CONECT 2615 2587 CONECT 2616 2588 CONECT 2617 2588 CONECT 2618 2589 CONECT 2619 2589 END