USER MOD reduce.3.24.130724 H: found=0, std=0, add=1349, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1349 hydrogens (0 hets) HEADER CYTOKINE 31-JAN-97 1IL6 TITLE HUMAN INTERLEUKIN-6, NMR, MINIMIZED AVERAGE STRUCTURE COMPND MOL_ID: 1; COMPND 2 MOLECULE: INTERLEUKIN-6; COMPND 3 CHAIN: A SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606 KEYWDS CYTOKINE, GLYCOPROTEIN, GROWTH FACTOR EXPDTA SOLUTION NMR AUTHOR G.Y.XU,H.A.YU,J.HONG,M.STAHL,T.MCDONAGH,L.E.KAY,D.A.CUMMING REVDAT 3 24-FEB-09 1IL6 1 VERSN REVDAT 2 01-APR-03 1IL6 1 JRNL REVDAT 1 04-FEB-98 1IL6 0 JRNL AUTH G.Y.XU,H.A.YU,J.HONG,M.STAHL,T.MCDONAGH,L.E.KAY, JRNL AUTH 2 D.A.CUMMING JRNL TITL SOLUTION STRUCTURE OF RECOMBINANT HUMAN JRNL TITL 2 INTERLEUKIN-6. JRNL REF J.MOL.BIOL. V. 268 468 1997 JRNL REFN ISSN 0022-2836 JRNL PMID 9159484 JRNL DOI 10.1006/JMBI.1997.0933 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH G.Y.XU,J.HONG,T.MCDONAGH,M.STAHL,L.E.KAY,J.SEEHRA, REMARK 1 AUTH 2 D.A.CUMMING REMARK 1 TITL COMPLETE 1H, 15N AND 13C ASSIGNMENTS, SECONDARY REMARK 1 TITL 2 STRUCTURE, AND TOPOLOGY OF RECOMBINANT HUMAN REMARK 1 TITL 3 INTERLEUKIN-6 REMARK 1 REF J.BIOMOL.NMR V. 8 123 1996 REMARK 1 REFN ISSN 0925-2738 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.1 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: STRUCTURES ARE BASED ON 2961 REMARK 3 INTERPROTON DISTANCE RESTRAINTS DERIVED FROM NMR MEASUREMENTS REMARK 3 INCLUDING 138 HYDROGEN BOND RESTRAINTS FROM 69 HYDROGEN BONDS REMARK 3 IDENTIFIED USING AMIDE EXCHANGE DATA AND INITIAL STRUCTURE REMARK 3 CALCULATIONS. IN ADDITION, 83 PHI BACKBONE TORSION ANGLE REMARK 3 RESTRAINTS WERE DERIVED FROM COUPLING CONSTANTS. THE METHOD REMARK 3 USED TO DERIVE THE FINAL ENSEMBLE OF STRUCTURES IS THE HYBRID REMARK 3 METRIC MATRIX DISTANCE GEOMETRY-DYNAMICAL SIMULATED ANNEALING REMARK 3 METHOD (M. NILGES, G.M. CLORE, AND A.M. GRONENBORN (1988) FEBS REMARK 3 LETT. 229, 317-324. REMARK 4 REMARK 4 1IL6 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) : 298 REMARK 210 PH : 6.1 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2/3/4D NOESY, TOCSY, ETC. REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : UNITY PLUS 600 REMARK 210 SPECTROMETER MANUFACTURER : VARIAN REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR REMARK 210 METHOD USED : DISTANCE GEOMETRY AND REMARK 210 SIMULATED ANNEALING. REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 75 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : LEAST RESTRAINT VIOLATION 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 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 465 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 RES C SSSEQI REMARK 465 ALA A 1 REMARK 465 PRO A 2 REMARK 465 VAL A 3 REMARK 465 PRO A 4 REMARK 465 PRO A 5 REMARK 465 GLY A 6 REMARK 465 GLU A 7 REMARK 465 ASP A 8 REMARK 465 SER A 9 REMARK 465 LYS A 10 REMARK 465 ASP A 11 REMARK 465 VAL A 12 REMARK 465 ALA A 13 REMARK 465 ALA A 14 REMARK 465 PRO A 15 REMARK 465 HIS A 16 REMARK 465 ARG A 17 REMARK 465 GLN A 18 REMARK 465 PRO A 19 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 THR A 44 41.79 -86.35 REMARK 500 CYS A 45 -47.87 -149.28 REMARK 500 LYS A 47 30.24 -92.90 REMARK 500 ASN A 49 19.80 47.82 REMARK 500 MET A 50 39.36 -152.26 REMARK 500 CYS A 51 -60.29 -155.33 REMARK 500 GLU A 52 44.31 -163.23 REMARK 500 SER A 53 -73.56 -49.03 REMARK 500 SER A 54 33.64 -172.83 REMARK 500 LYS A 55 -50.93 -157.87 REMARK 500 GLU A 56 -69.58 177.72 REMARK 500 ALA A 57 82.57 77.44 REMARK 500 LEU A 58 95.61 -58.58 REMARK 500 ASN A 62 93.63 63.76 REMARK 500 LEU A 63 -168.53 -57.61 REMARK 500 LYS A 67 54.77 175.48 REMARK 500 MET A 68 138.87 -174.60 REMARK 500 ALA A 69 -163.16 -177.92 REMARK 500 SER A 77 104.29 -55.64 REMARK 500 PHE A 79 98.09 -63.88 REMARK 500 GLU A 81 -56.08 -141.46 REMARK 500 LEU A 134 -150.89 -136.03 REMARK 500 ALA A 136 -19.84 84.19 REMARK 500 ILE A 137 17.09 59.33 REMARK 500 THR A 138 -154.93 48.97 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 ARG A 25 0.26 SIDE_CHAIN REMARK 500 ARG A 31 0.19 SIDE_CHAIN REMARK 500 ARG A 41 0.24 SIDE_CHAIN REMARK 500 ARG A 105 0.30 SIDE_CHAIN REMARK 500 ARG A 114 0.18 SIDE_CHAIN REMARK 500 ARG A 169 0.16 SIDE_CHAIN REMARK 500 ARG A 180 0.28 SIDE_CHAIN REMARK 500 ARG A 183 0.25 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2IL6 RELATED DB: PDB DBREF 1IL6 A 1 185 UNP P05231 IL6_HUMAN 28 212 SEQRES 1 A 185 ALA PRO VAL PRO PRO GLY GLU ASP SER LYS ASP VAL ALA SEQRES 2 A 185 ALA PRO HIS ARG GLN PRO LEU THR SER SER GLU ARG ILE SEQRES 3 A 185 ASP LYS GLN ILE ARG TYR ILE LEU ASP GLY ILE SER ALA SEQRES 4 A 185 LEU ARG LYS GLU THR CYS ASN LYS SER ASN MET CYS GLU SEQRES 5 A 185 SER SER LYS GLU ALA LEU ALA GLU ASN ASN LEU ASN LEU SEQRES 6 A 185 PRO LYS MET ALA GLU LYS ASP GLY CYS PHE GLN SER GLY SEQRES 7 A 185 PHE ASN GLU GLU THR CYS LEU VAL LYS ILE ILE THR GLY SEQRES 8 A 185 LEU LEU GLU PHE GLU VAL TYR LEU GLU TYR LEU GLN ASN SEQRES 9 A 185 ARG PHE GLU SER SER GLU GLU GLN ALA ARG ALA VAL GLN SEQRES 10 A 185 MET SER THR LYS VAL LEU ILE GLN PHE LEU GLN LYS LYS SEQRES 11 A 185 ALA LYS ASN LEU ASP ALA ILE THR THR PRO ASP PRO THR SEQRES 12 A 185 THR ASN ALA SER LEU LEU THR LYS LEU GLN ALA GLN ASN SEQRES 13 A 185 GLN TRP LEU GLN ASP MET THR THR HIS LEU ILE LEU ARG SEQRES 14 A 185 SER PHE LYS GLU PHE LEU GLN SER SER LEU ARG ALA LEU SEQRES 15 A 185 ARG GLN MET HELIX 1 1 SER A 22 ARG A 41 1 20 HELIX 2 2 GLU A 43 ASN A 46 1 4 HELIX 3 3 GLU A 82 ASN A 104 1 23 HELIX 4 4 GLU A 110 LYS A 130 1 21 HELIX 5 5 PRO A 142 GLN A 153 1 12 HELIX 6 6 GLN A 157 ARG A 183 1 27 SSBOND *** CYS A 45 CYS A 51 1555 1555 2.02 SSBOND *** CYS A 74 CYS A 84 1555 1555 2.02 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 143 THR OG1 : rot -85:sc= 1.15 USER MOD Set 1.2: A 144 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 23 SER OG : rot 180:sc= -0.429 USER MOD Set 2.2: A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 80 ASN : amide:sc= -0.295 K(o=-0.3,f=-0.96!) USER MOD Set 3.2: A 83 THR OG1 : rot -170:sc= 0 USER MOD Set 4.1: A 44 THR OG1 : rot -50:sc= 0.502 USER MOD Set 4.2: A 48 SER OG : rot -39:sc= 0.339 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.378 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.838 K(o=-0.84,f=-3!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.433 K(o=-0.43,f=-2.4!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0.12) USER MOD Single : A 50 MET CE :methyl -162:sc= -1.71 (180deg=-3.43!) USER MOD Single : A 53 SER OG : rot 180:sc= -0.0188 USER MOD Single : A 54 SER OG : rot 53:sc= 0.707 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -6.25! C(o=-6.2!,f=-7.5!) USER MOD Single : A 62 ASN : amide:sc= -0.992! C(o=-0.99!,f=-6.2!) USER MOD Single : A 64 ASN : amide:sc= -0.205 K(o=-0.21,f=-2.5!) USER MOD Single : A 67 LYS NZ :NH3+ 169:sc= 0.253 (180deg=0.191) USER MOD Single : A 68 MET CE :methyl 170:sc= -0.393 (180deg=-0.446) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -0.125 K(o=-0.13,f=-1.8!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= -1.84! USER MOD Single : A 101 TYR OH : rot 141:sc= -2.12! USER MOD Single : A 103 GLN : amide:sc= -0.086 K(o=-0.086,f=-3.2!) USER MOD Single : A 104 ASN : amide:sc= -0.255 K(o=-0.25,f=-3!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 170:sc= -1.22 USER MOD Single : A 112 GLN : amide:sc= -1.72 K(o=-1.7,f=-4.4!) USER MOD Single : A 117 GLN : amide:sc= -1.3 K(o=-1.3,f=-4.4!) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 SER OG : rot 140:sc= 0 USER MOD Single : A 120 THR OG1 : rot -1:sc= -2.69! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= -0.0107 K(o=-0.011,f=-0.9) USER MOD Single : A 128 GLN : amide:sc= -0.0302 K(o=-0.03,f=-1.6!) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= -0.322 K(o=-0.32,f=-1.6!) USER MOD Single : A 138 THR OG1 : rot 180:sc= -0.0259 USER MOD Single : A 139 THR OG1 : rot -140:sc= -7.17! USER MOD Single : A 145 ASN : amide:sc= -3.85! K(o=-3.8!,f=-2) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 GLN : amide:sc= -0.0523 X(o=-0.052,f=-0.28) USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 156 ASN : amide:sc= -0.0167 X(o=-0.017,f=-0.42) USER MOD Single : A 157 GLN : amide:sc= -0.263 K(o=-0.26,f=-2.6!) USER MOD Single : A 160 GLN : amide:sc= -0.436 X(o=-0.44,f=-0.08) USER MOD Single : A 162 MET CE :methyl -133:sc= -9.51! (180deg=-18.8!) USER MOD Single : A 163 THR OG1 : rot 65:sc= 0.701 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 HIS : no HD1:sc= -1.2 K(o=-1.2,f=-0.65) USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 SER OG : rot -127:sc= 0.112 USER MOD Single : A 178 SER OG : rot 180:sc= -0.239 USER MOD Single : A 184 GLN : amide:sc= -0.0699 K(o=-0.07,f=-2.4!) USER MOD Single : A 185 MET CE :methyl 156:sc= -2.12 (180deg=-3.2) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 20 21.459 14.423 2.637 1.00 1.83 N ATOM 2 CA LEU A 20 20.256 13.832 1.985 1.00 1.70 C ATOM 3 C LEU A 20 20.696 12.792 0.952 1.00 1.45 C ATOM 4 O LEU A 20 21.532 13.054 0.111 1.00 1.82 O ATOM 5 CB LEU A 20 19.457 14.936 1.290 1.00 1.93 C ATOM 6 CG LEU A 20 17.999 14.499 1.146 1.00 2.11 C ATOM 7 CD1 LEU A 20 17.118 15.343 2.069 1.00 2.26 C ATOM 8 CD2 LEU A 20 17.549 14.695 -0.304 1.00 2.59 C ATOM 0 HA LEU A 20 19.632 13.354 2.740 1.00 1.70 H new ATOM 0 HB2 LEU A 20 19.515 15.859 1.866 1.00 1.93 H new ATOM 0 HB3 LEU A 20 19.883 15.145 0.309 1.00 1.93 H new ATOM 0 HG LEU A 20 17.908 13.447 1.418 1.00 2.11 H new ATOM 0 HD11 LEU A 20 16.079 15.031 1.966 1.00 2.26 H new ATOM 0 HD12 LEU A 20 17.437 15.206 3.102 1.00 2.26 H new ATOM 0 HD13 LEU A 20 17.210 16.395 1.798 1.00 2.26 H new ATOM 0 HD21 LEU A 20 16.510 14.384 -0.408 1.00 2.59 H new ATOM 0 HD22 LEU A 20 17.641 15.747 -0.575 1.00 2.59 H new ATOM 0 HD23 LEU A 20 18.175 14.094 -0.964 1.00 2.59 H new ATOM 20 N THR A 21 20.139 11.613 1.011 1.00 1.11 N ATOM 21 CA THR A 21 20.526 10.557 0.034 1.00 0.98 C ATOM 22 C THR A 21 19.269 9.993 -0.634 1.00 0.82 C ATOM 23 O THR A 21 18.157 10.322 -0.267 1.00 0.74 O ATOM 24 CB THR A 21 21.263 9.433 0.766 1.00 1.09 C ATOM 25 OG1 THR A 21 21.541 8.378 -0.144 1.00 1.45 O ATOM 26 CG2 THR A 21 20.391 8.909 1.908 1.00 1.37 C ATOM 0 H THR A 21 19.433 11.336 1.693 1.00 1.11 H new ATOM 0 HA THR A 21 21.179 10.986 -0.726 1.00 0.98 H new ATOM 0 HB THR A 21 22.199 9.816 1.173 1.00 1.09 H new ATOM 0 HG1 THR A 21 22.014 7.659 0.324 1.00 1.45 H new ATOM 0 HG21 THR A 21 20.916 8.109 2.429 1.00 1.37 H new ATOM 0 HG22 THR A 21 20.180 9.719 2.606 1.00 1.37 H new ATOM 0 HG23 THR A 21 19.454 8.525 1.504 1.00 1.37 H new ATOM 34 N SER A 22 19.436 9.145 -1.614 1.00 0.84 N ATOM 35 CA SER A 22 18.252 8.559 -2.306 1.00 0.76 C ATOM 36 C SER A 22 17.310 7.937 -1.274 1.00 0.65 C ATOM 37 O SER A 22 16.106 7.939 -1.437 1.00 0.60 O ATOM 38 CB SER A 22 18.716 7.481 -3.286 1.00 0.87 C ATOM 39 OG SER A 22 19.184 8.099 -4.478 1.00 1.49 O ATOM 0 H SER A 22 20.341 8.833 -1.965 1.00 0.84 H new ATOM 0 HA SER A 22 17.726 9.344 -2.850 1.00 0.76 H new ATOM 0 HB2 SER A 22 19.509 6.883 -2.837 1.00 0.87 H new ATOM 0 HB3 SER A 22 17.894 6.802 -3.513 1.00 0.87 H new ATOM 0 HG SER A 22 19.484 7.410 -5.108 1.00 1.49 H new ATOM 45 N SER A 23 17.847 7.407 -0.209 1.00 0.66 N ATOM 46 CA SER A 23 16.980 6.791 0.833 1.00 0.61 C ATOM 47 C SER A 23 16.109 7.874 1.469 1.00 0.55 C ATOM 48 O SER A 23 14.920 7.702 1.647 1.00 0.50 O ATOM 49 CB SER A 23 17.854 6.141 1.907 1.00 0.75 C ATOM 50 OG SER A 23 17.132 5.083 2.523 1.00 1.24 O ATOM 0 H SER A 23 18.848 7.374 -0.016 1.00 0.66 H new ATOM 0 HA SER A 23 16.344 6.032 0.377 1.00 0.61 H new ATOM 0 HB2 SER A 23 18.773 5.759 1.462 1.00 0.75 H new ATOM 0 HB3 SER A 23 18.144 6.881 2.653 1.00 0.75 H new ATOM 0 HG SER A 23 17.690 4.663 3.211 1.00 1.24 H new ATOM 56 N GLU A 24 16.690 8.993 1.808 1.00 0.63 N ATOM 57 CA GLU A 24 15.889 10.087 2.426 1.00 0.68 C ATOM 58 C GLU A 24 14.739 10.455 1.488 1.00 0.63 C ATOM 59 O GLU A 24 13.654 10.785 1.922 1.00 0.68 O ATOM 60 CB GLU A 24 16.778 11.312 2.649 1.00 0.86 C ATOM 61 CG GLU A 24 17.446 11.215 4.022 1.00 1.46 C ATOM 62 CD GLU A 24 16.723 12.134 5.008 1.00 1.89 C ATOM 63 OE1 GLU A 24 15.538 12.354 4.822 1.00 2.20 O ATOM 64 OE2 GLU A 24 17.368 12.603 5.932 1.00 2.66 O ATOM 0 H GLU A 24 17.682 9.196 1.684 1.00 0.63 H new ATOM 0 HA GLU A 24 15.491 9.753 3.384 1.00 0.68 H new ATOM 0 HB2 GLU A 24 17.536 11.372 1.868 1.00 0.86 H new ATOM 0 HB3 GLU A 24 16.183 12.223 2.586 1.00 0.86 H new ATOM 0 HG2 GLU A 24 17.418 10.186 4.380 1.00 1.46 H new ATOM 0 HG3 GLU A 24 18.496 11.498 3.948 1.00 1.46 H new ATOM 71 N ARG A 25 14.966 10.393 0.204 1.00 0.62 N ATOM 72 CA ARG A 25 13.879 10.732 -0.757 1.00 0.69 C ATOM 73 C ARG A 25 12.845 9.605 -0.756 1.00 0.59 C ATOM 74 O ARG A 25 11.668 9.828 -0.956 1.00 0.70 O ATOM 75 CB ARG A 25 14.464 10.893 -2.162 1.00 0.81 C ATOM 76 CG ARG A 25 14.615 12.382 -2.480 1.00 1.14 C ATOM 77 CD ARG A 25 15.012 12.554 -3.947 1.00 1.57 C ATOM 78 NE ARG A 25 16.164 13.493 -4.042 1.00 1.81 N ATOM 79 CZ ARG A 25 16.147 14.462 -4.917 1.00 2.31 C ATOM 80 NH1 ARG A 25 15.155 15.310 -4.934 1.00 2.71 N ATOM 81 NH2 ARG A 25 17.122 14.582 -5.775 1.00 3.04 N ATOM 0 H ARG A 25 15.854 10.123 -0.220 1.00 0.62 H new ATOM 0 HA ARG A 25 13.405 11.667 -0.460 1.00 0.69 H new ATOM 0 HB2 ARG A 25 15.432 10.396 -2.224 1.00 0.81 H new ATOM 0 HB3 ARG A 25 13.814 10.417 -2.896 1.00 0.81 H new ATOM 0 HG2 ARG A 25 13.678 12.903 -2.282 1.00 1.14 H new ATOM 0 HG3 ARG A 25 15.371 12.828 -1.833 1.00 1.14 H new ATOM 0 HD2 ARG A 25 15.279 11.589 -4.378 1.00 1.57 H new ATOM 0 HD3 ARG A 25 14.168 12.937 -4.521 1.00 1.57 H new ATOM 0 HE ARG A 25 16.967 13.379 -3.423 1.00 1.81 H new ATOM 0 HH11 ARG A 25 14.392 15.216 -4.263 1.00 2.71 H new ATOM 0 HH12 ARG A 25 15.143 16.067 -5.618 1.00 2.71 H new ATOM 0 HH21 ARG A 25 17.897 13.919 -5.762 1.00 3.04 H new ATOM 0 HH22 ARG A 25 17.109 15.339 -6.459 1.00 3.04 H new ATOM 95 N ILE A 26 13.277 8.396 -0.520 1.00 0.48 N ATOM 96 CA ILE A 26 12.322 7.252 -0.492 1.00 0.50 C ATOM 97 C ILE A 26 11.296 7.496 0.624 1.00 0.40 C ATOM 98 O ILE A 26 10.111 7.306 0.446 1.00 0.44 O ATOM 99 CB ILE A 26 13.098 5.953 -0.219 1.00 0.59 C ATOM 100 CG1 ILE A 26 13.996 5.622 -1.432 1.00 0.90 C ATOM 101 CG2 ILE A 26 12.123 4.796 0.055 1.00 0.75 C ATOM 102 CD1 ILE A 26 13.176 4.997 -2.573 1.00 0.46 C ATOM 0 H ILE A 26 14.252 8.151 -0.345 1.00 0.48 H new ATOM 0 HA ILE A 26 11.807 7.164 -1.448 1.00 0.50 H new ATOM 0 HB ILE A 26 13.725 6.090 0.662 1.00 0.59 H new ATOM 0 HG12 ILE A 26 14.484 6.530 -1.786 1.00 0.90 H new ATOM 0 HG13 ILE A 26 14.785 4.934 -1.128 1.00 0.90 H new ATOM 0 HG21 ILE A 26 12.687 3.883 0.247 1.00 0.75 H new ATOM 0 HG22 ILE A 26 11.511 5.034 0.925 1.00 0.75 H new ATOM 0 HG23 ILE A 26 11.479 4.650 -0.812 1.00 0.75 H new ATOM 0 HD11 ILE A 26 13.833 4.774 -3.414 1.00 0.46 H new ATOM 0 HD12 ILE A 26 12.709 4.076 -2.223 1.00 0.46 H new ATOM 0 HD13 ILE A 26 12.404 5.697 -2.892 1.00 0.46 H new ATOM 114 N ASP A 27 11.749 7.915 1.775 1.00 0.39 N ATOM 115 CA ASP A 27 10.808 8.169 2.904 1.00 0.36 C ATOM 116 C ASP A 27 9.936 9.390 2.591 1.00 0.34 C ATOM 117 O ASP A 27 8.728 9.350 2.712 1.00 0.34 O ATOM 118 CB ASP A 27 11.612 8.431 4.181 1.00 0.44 C ATOM 119 CG ASP A 27 10.655 8.718 5.340 1.00 0.68 C ATOM 120 OD1 ASP A 27 10.167 9.833 5.419 1.00 1.17 O ATOM 121 OD2 ASP A 27 10.427 7.816 6.130 1.00 1.44 O ATOM 0 H ASP A 27 12.732 8.093 1.982 1.00 0.39 H new ATOM 0 HA ASP A 27 10.167 7.298 3.043 1.00 0.36 H new ATOM 0 HB2 ASP A 27 12.234 7.567 4.415 1.00 0.44 H new ATOM 0 HB3 ASP A 27 12.284 9.276 4.033 1.00 0.44 H new ATOM 126 N LYS A 28 10.541 10.475 2.195 1.00 0.40 N ATOM 127 CA LYS A 28 9.773 11.696 1.879 1.00 0.46 C ATOM 128 C LYS A 28 8.715 11.385 0.819 1.00 0.42 C ATOM 129 O LYS A 28 7.704 12.052 0.721 1.00 0.47 O ATOM 130 CB LYS A 28 10.743 12.758 1.344 1.00 0.59 C ATOM 131 CG LYS A 28 10.367 14.132 1.900 1.00 1.32 C ATOM 132 CD LYS A 28 8.882 14.371 1.661 1.00 1.99 C ATOM 133 CE LYS A 28 8.565 15.863 1.780 1.00 2.53 C ATOM 134 NZ LYS A 28 8.178 16.396 0.443 1.00 3.34 N ATOM 0 H LYS A 28 11.550 10.562 2.077 1.00 0.40 H new ATOM 0 HA LYS A 28 9.274 12.063 2.776 1.00 0.46 H new ATOM 0 HB2 LYS A 28 11.765 12.507 1.630 1.00 0.59 H new ATOM 0 HB3 LYS A 28 10.712 12.776 0.255 1.00 0.59 H new ATOM 0 HG2 LYS A 28 10.590 14.181 2.966 1.00 1.32 H new ATOM 0 HG3 LYS A 28 10.957 14.909 1.415 1.00 1.32 H new ATOM 0 HD2 LYS A 28 8.602 14.009 0.672 1.00 1.99 H new ATOM 0 HD3 LYS A 28 8.294 13.807 2.385 1.00 1.99 H new ATOM 0 HE2 LYS A 28 7.756 16.018 2.494 1.00 2.53 H new ATOM 0 HE3 LYS A 28 9.433 16.401 2.161 1.00 2.53 H new ATOM 0 HZ1 LYS A 28 7.962 17.410 0.523 1.00 3.34 H new ATOM 0 HZ2 LYS A 28 8.963 16.261 -0.225 1.00 3.34 H new ATOM 0 HZ3 LYS A 28 7.338 15.890 0.097 1.00 3.34 H new ATOM 148 N GLN A 29 8.941 10.382 0.019 1.00 0.41 N ATOM 149 CA GLN A 29 7.951 10.039 -1.040 1.00 0.41 C ATOM 150 C GLN A 29 6.793 9.236 -0.434 1.00 0.34 C ATOM 151 O GLN A 29 5.645 9.433 -0.784 1.00 0.35 O ATOM 152 CB GLN A 29 8.641 9.217 -2.129 1.00 0.47 C ATOM 153 CG GLN A 29 9.466 10.146 -3.022 1.00 1.00 C ATOM 154 CD GLN A 29 8.538 11.141 -3.721 1.00 1.28 C ATOM 155 OE1 GLN A 29 7.337 10.958 -3.741 1.00 2.00 O ATOM 156 NE2 GLN A 29 9.048 12.194 -4.299 1.00 1.91 N ATOM 0 H GLN A 29 9.767 9.785 0.052 1.00 0.41 H new ATOM 0 HA GLN A 29 7.553 10.956 -1.474 1.00 0.41 H new ATOM 0 HB2 GLN A 29 9.285 8.463 -1.677 1.00 0.47 H new ATOM 0 HB3 GLN A 29 7.898 8.687 -2.725 1.00 0.47 H new ATOM 0 HG2 GLN A 29 10.205 10.680 -2.425 1.00 1.00 H new ATOM 0 HG3 GLN A 29 10.015 9.563 -3.762 1.00 1.00 H new ATOM 0 HE21 GLN A 29 10.056 12.347 -4.282 1.00 1.91 H new ATOM 0 HE22 GLN A 29 8.438 12.864 -4.768 1.00 1.91 H new ATOM 165 N ILE A 30 7.073 8.337 0.474 1.00 0.32 N ATOM 166 CA ILE A 30 5.963 7.549 1.087 1.00 0.30 C ATOM 167 C ILE A 30 5.042 8.506 1.843 1.00 0.29 C ATOM 168 O ILE A 30 3.839 8.337 1.867 1.00 0.29 O ATOM 169 CB ILE A 30 6.515 6.514 2.071 1.00 0.34 C ATOM 170 CG1 ILE A 30 7.601 5.654 1.390 1.00 0.53 C ATOM 171 CG2 ILE A 30 5.370 5.636 2.572 1.00 0.36 C ATOM 172 CD1 ILE A 30 6.969 4.546 0.533 1.00 0.74 C ATOM 0 H ILE A 30 8.009 8.116 0.814 1.00 0.32 H new ATOM 0 HA ILE A 30 5.419 7.030 0.298 1.00 0.30 H new ATOM 0 HB ILE A 30 6.971 7.025 2.919 1.00 0.34 H new ATOM 0 HG12 ILE A 30 8.232 6.286 0.766 1.00 0.53 H new ATOM 0 HG13 ILE A 30 8.246 5.209 2.148 1.00 0.53 H new ATOM 0 HG21 ILE A 30 5.758 4.897 3.273 1.00 0.36 H new ATOM 0 HG22 ILE A 30 4.628 6.257 3.073 1.00 0.36 H new ATOM 0 HG23 ILE A 30 4.906 5.126 1.728 1.00 0.36 H new ATOM 0 HD11 ILE A 30 7.756 3.955 0.064 1.00 0.74 H new ATOM 0 HD12 ILE A 30 6.358 3.901 1.165 1.00 0.74 H new ATOM 0 HD13 ILE A 30 6.344 4.995 -0.239 1.00 0.74 H new ATOM 184 N ARG A 31 5.599 9.516 2.461 1.00 0.34 N ATOM 185 CA ARG A 31 4.753 10.488 3.210 1.00 0.38 C ATOM 186 C ARG A 31 3.707 11.064 2.260 1.00 0.35 C ATOM 187 O ARG A 31 2.610 11.408 2.656 1.00 0.35 O ATOM 188 CB ARG A 31 5.628 11.619 3.757 1.00 0.49 C ATOM 189 CG ARG A 31 4.924 12.279 4.945 1.00 0.67 C ATOM 190 CD ARG A 31 5.577 13.630 5.243 1.00 1.20 C ATOM 191 NE ARG A 31 4.936 14.238 6.444 1.00 1.72 N ATOM 192 CZ ARG A 31 5.189 15.479 6.761 1.00 2.24 C ATOM 193 NH1 ARG A 31 6.388 15.965 6.591 1.00 2.64 N ATOM 194 NH2 ARG A 31 4.242 16.233 7.251 1.00 3.03 N ATOM 0 H ARG A 31 6.601 9.708 2.478 1.00 0.34 H new ATOM 0 HA ARG A 31 4.261 9.985 4.042 1.00 0.38 H new ATOM 0 HB2 ARG A 31 6.597 11.227 4.067 1.00 0.49 H new ATOM 0 HB3 ARG A 31 5.817 12.357 2.977 1.00 0.49 H new ATOM 0 HG2 ARG A 31 3.866 12.416 4.723 1.00 0.67 H new ATOM 0 HG3 ARG A 31 4.985 11.633 5.821 1.00 0.67 H new ATOM 0 HD2 ARG A 31 6.645 13.499 5.415 1.00 1.20 H new ATOM 0 HD3 ARG A 31 5.471 14.294 4.385 1.00 1.20 H new ATOM 0 HE ARG A 31 4.300 13.684 7.018 1.00 1.72 H new ATOM 0 HH11 ARG A 31 7.128 15.375 6.210 1.00 2.64 H new ATOM 0 HH12 ARG A 31 6.585 16.935 6.839 1.00 2.64 H new ATOM 0 HH21 ARG A 31 3.305 15.852 7.386 1.00 3.03 H new ATOM 0 HH22 ARG A 31 4.439 17.203 7.499 1.00 3.03 H new ATOM 208 N TYR A 32 4.034 11.152 1.000 1.00 0.36 N ATOM 209 CA TYR A 32 3.061 11.680 0.012 1.00 0.38 C ATOM 210 C TYR A 32 2.036 10.587 -0.268 1.00 0.34 C ATOM 211 O TYR A 32 0.866 10.847 -0.467 1.00 0.35 O ATOM 212 CB TYR A 32 3.793 12.043 -1.281 1.00 0.43 C ATOM 213 CG TYR A 32 3.356 13.412 -1.743 1.00 0.40 C ATOM 214 CD1 TYR A 32 1.994 13.717 -1.837 1.00 1.22 C ATOM 215 CD2 TYR A 32 4.315 14.375 -2.079 1.00 1.18 C ATOM 216 CE1 TYR A 32 1.590 14.986 -2.267 1.00 1.38 C ATOM 217 CE2 TYR A 32 3.911 15.644 -2.508 1.00 1.24 C ATOM 218 CZ TYR A 32 2.548 15.950 -2.603 1.00 0.84 C ATOM 219 OH TYR A 32 2.148 17.201 -3.027 1.00 1.12 O ATOM 0 H TYR A 32 4.938 10.879 0.614 1.00 0.36 H new ATOM 0 HA TYR A 32 2.568 12.572 0.400 1.00 0.38 H new ATOM 0 HB2 TYR A 32 4.870 12.030 -1.117 1.00 0.43 H new ATOM 0 HB3 TYR A 32 3.579 11.303 -2.052 1.00 0.43 H new ATOM 0 HD1 TYR A 32 1.255 12.974 -1.578 1.00 1.22 H new ATOM 0 HD2 TYR A 32 5.366 14.138 -2.007 1.00 1.18 H new ATOM 0 HE1 TYR A 32 0.539 15.222 -2.340 1.00 1.38 H new ATOM 0 HE2 TYR A 32 4.651 16.388 -2.766 1.00 1.24 H new ATOM 0 HH TYR A 32 2.937 17.749 -3.219 1.00 1.12 H new ATOM 229 N ILE A 33 2.475 9.358 -0.272 1.00 0.32 N ATOM 230 CA ILE A 33 1.538 8.233 -0.524 1.00 0.31 C ATOM 231 C ILE A 33 0.400 8.288 0.497 1.00 0.31 C ATOM 232 O ILE A 33 -0.757 8.145 0.161 1.00 0.33 O ATOM 233 CB ILE A 33 2.284 6.905 -0.385 1.00 0.28 C ATOM 234 CG1 ILE A 33 3.407 6.841 -1.424 1.00 0.31 C ATOM 235 CG2 ILE A 33 1.312 5.746 -0.613 1.00 0.30 C ATOM 236 CD1 ILE A 33 4.136 5.501 -1.309 1.00 0.67 C ATOM 0 H ILE A 33 3.445 9.087 -0.111 1.00 0.32 H new ATOM 0 HA ILE A 33 1.131 8.315 -1.532 1.00 0.31 H new ATOM 0 HB ILE A 33 2.709 6.830 0.616 1.00 0.28 H new ATOM 0 HG12 ILE A 33 2.996 6.958 -2.427 1.00 0.31 H new ATOM 0 HG13 ILE A 33 4.107 7.662 -1.269 1.00 0.31 H new ATOM 0 HG21 ILE A 33 1.844 4.800 -0.514 1.00 0.30 H new ATOM 0 HG22 ILE A 33 0.512 5.791 0.126 1.00 0.30 H new ATOM 0 HG23 ILE A 33 0.886 5.820 -1.614 1.00 0.30 H new ATOM 0 HD11 ILE A 33 4.935 5.457 -2.049 1.00 0.67 H new ATOM 0 HD12 ILE A 33 4.561 5.402 -0.310 1.00 0.67 H new ATOM 0 HD13 ILE A 33 3.432 4.688 -1.486 1.00 0.67 H new ATOM 248 N LEU A 34 0.724 8.493 1.746 1.00 0.30 N ATOM 249 CA LEU A 34 -0.333 8.555 2.795 1.00 0.32 C ATOM 250 C LEU A 34 -1.168 9.825 2.618 1.00 0.31 C ATOM 251 O LEU A 34 -2.371 9.813 2.785 1.00 0.30 O ATOM 252 CB LEU A 34 0.325 8.574 4.177 1.00 0.34 C ATOM 253 CG LEU A 34 0.082 7.237 4.878 1.00 0.47 C ATOM 254 CD1 LEU A 34 1.159 6.238 4.455 1.00 0.70 C ATOM 255 CD2 LEU A 34 0.144 7.440 6.394 1.00 0.56 C ATOM 0 H LEU A 34 1.678 8.620 2.085 1.00 0.30 H new ATOM 0 HA LEU A 34 -0.980 7.682 2.704 1.00 0.32 H new ATOM 0 HB2 LEU A 34 1.395 8.756 4.079 1.00 0.34 H new ATOM 0 HB3 LEU A 34 -0.083 9.389 4.774 1.00 0.34 H new ATOM 0 HG LEU A 34 -0.900 6.853 4.601 1.00 0.47 H new ATOM 0 HD11 LEU A 34 0.987 5.284 4.954 1.00 0.70 H new ATOM 0 HD12 LEU A 34 1.119 6.095 3.375 1.00 0.70 H new ATOM 0 HD13 LEU A 34 2.141 6.621 4.734 1.00 0.70 H new ATOM 0 HD21 LEU A 34 -0.029 6.488 6.896 1.00 0.56 H new ATOM 0 HD22 LEU A 34 1.127 7.822 6.670 1.00 0.56 H new ATOM 0 HD23 LEU A 34 -0.622 8.154 6.697 1.00 0.56 H new ATOM 267 N ASP A 35 -0.545 10.924 2.276 1.00 0.35 N ATOM 268 CA ASP A 35 -1.317 12.187 2.085 1.00 0.37 C ATOM 269 C ASP A 35 -2.435 11.927 1.083 1.00 0.33 C ATOM 270 O ASP A 35 -3.514 12.477 1.176 1.00 0.31 O ATOM 271 CB ASP A 35 -0.391 13.284 1.555 1.00 0.44 C ATOM 272 CG ASP A 35 -0.529 14.534 2.426 1.00 0.91 C ATOM 273 OD1 ASP A 35 -1.646 14.849 2.803 1.00 1.73 O ATOM 274 OD2 ASP A 35 0.484 15.156 2.700 1.00 1.18 O ATOM 0 H ASP A 35 0.460 11.001 2.122 1.00 0.35 H new ATOM 0 HA ASP A 35 -1.739 12.513 3.036 1.00 0.37 H new ATOM 0 HB2 ASP A 35 0.642 12.936 1.560 1.00 0.44 H new ATOM 0 HB3 ASP A 35 -0.643 13.519 0.521 1.00 0.44 H new ATOM 279 N GLY A 36 -2.188 11.068 0.138 1.00 0.33 N ATOM 280 CA GLY A 36 -3.237 10.741 -0.856 1.00 0.31 C ATOM 281 C GLY A 36 -4.283 9.863 -0.173 1.00 0.27 C ATOM 282 O GLY A 36 -5.462 10.123 -0.235 1.00 0.26 O ATOM 0 H GLY A 36 -1.302 10.578 0.013 1.00 0.33 H new ATOM 0 HA2 GLY A 36 -3.696 11.653 -1.238 1.00 0.31 H new ATOM 0 HA3 GLY A 36 -2.803 10.221 -1.710 1.00 0.31 H new ATOM 286 N ILE A 37 -3.845 8.825 0.482 1.00 0.28 N ATOM 287 CA ILE A 37 -4.791 7.909 1.182 1.00 0.25 C ATOM 288 C ILE A 37 -5.757 8.702 2.068 1.00 0.25 C ATOM 289 O ILE A 37 -6.839 8.243 2.374 1.00 0.24 O ATOM 290 CB ILE A 37 -4.006 6.929 2.056 1.00 0.29 C ATOM 291 CG1 ILE A 37 -3.041 6.122 1.182 1.00 0.32 C ATOM 292 CG2 ILE A 37 -4.984 5.977 2.750 1.00 0.28 C ATOM 293 CD1 ILE A 37 -3.835 5.304 0.166 1.00 0.29 C ATOM 0 H ILE A 37 -2.861 8.568 0.564 1.00 0.28 H new ATOM 0 HA ILE A 37 -5.363 7.366 0.430 1.00 0.25 H new ATOM 0 HB ILE A 37 -3.438 7.481 2.805 1.00 0.29 H new ATOM 0 HG12 ILE A 37 -2.353 6.793 0.667 1.00 0.32 H new ATOM 0 HG13 ILE A 37 -2.437 5.461 1.804 1.00 0.32 H new ATOM 0 HG21 ILE A 37 -4.429 5.277 3.374 1.00 0.28 H new ATOM 0 HG22 ILE A 37 -5.671 6.551 3.372 1.00 0.28 H new ATOM 0 HG23 ILE A 37 -5.549 5.425 1.999 1.00 0.28 H new ATOM 0 HD11 ILE A 37 -3.148 4.730 -0.456 1.00 0.29 H new ATOM 0 HD12 ILE A 37 -4.505 4.623 0.691 1.00 0.29 H new ATOM 0 HD13 ILE A 37 -4.420 5.975 -0.464 1.00 0.29 H new ATOM 305 N SER A 38 -5.395 9.888 2.478 1.00 0.29 N ATOM 306 CA SER A 38 -6.321 10.677 3.329 1.00 0.31 C ATOM 307 C SER A 38 -7.517 11.039 2.470 1.00 0.28 C ATOM 308 O SER A 38 -8.659 10.850 2.845 1.00 0.29 O ATOM 309 CB SER A 38 -5.625 11.948 3.817 1.00 0.38 C ATOM 310 OG SER A 38 -5.804 12.071 5.222 1.00 1.14 O ATOM 0 H SER A 38 -4.506 10.338 2.261 1.00 0.29 H new ATOM 0 HA SER A 38 -6.630 10.103 4.203 1.00 0.31 H new ATOM 0 HB2 SER A 38 -4.563 11.910 3.576 1.00 0.38 H new ATOM 0 HB3 SER A 38 -6.036 12.820 3.309 1.00 0.38 H new ATOM 0 HG SER A 38 -5.358 12.884 5.539 1.00 1.14 H new ATOM 316 N ALA A 39 -7.255 11.529 1.295 1.00 0.28 N ATOM 317 CA ALA A 39 -8.362 11.874 0.384 1.00 0.29 C ATOM 318 C ALA A 39 -8.924 10.585 -0.223 1.00 0.26 C ATOM 319 O ALA A 39 -9.972 10.586 -0.839 1.00 0.29 O ATOM 320 CB ALA A 39 -7.851 12.792 -0.728 1.00 0.35 C ATOM 0 H ALA A 39 -6.319 11.704 0.930 1.00 0.28 H new ATOM 0 HA ALA A 39 -9.146 12.393 0.936 1.00 0.29 H new ATOM 0 HB1 ALA A 39 -8.673 13.044 -1.398 1.00 0.35 H new ATOM 0 HB2 ALA A 39 -7.448 13.705 -0.290 1.00 0.35 H new ATOM 0 HB3 ALA A 39 -7.068 12.282 -1.290 1.00 0.35 H new ATOM 326 N LEU A 40 -8.241 9.478 -0.048 1.00 0.23 N ATOM 327 CA LEU A 40 -8.750 8.199 -0.609 1.00 0.22 C ATOM 328 C LEU A 40 -9.336 7.333 0.503 1.00 0.24 C ATOM 329 O LEU A 40 -9.809 6.245 0.256 1.00 0.33 O ATOM 330 CB LEU A 40 -7.618 7.432 -1.288 1.00 0.25 C ATOM 331 CG LEU A 40 -6.864 8.359 -2.232 1.00 0.31 C ATOM 332 CD1 LEU A 40 -5.530 7.719 -2.608 1.00 0.54 C ATOM 333 CD2 LEU A 40 -7.695 8.579 -3.491 1.00 0.32 C ATOM 0 H LEU A 40 -7.358 9.411 0.458 1.00 0.23 H new ATOM 0 HA LEU A 40 -9.524 8.431 -1.340 1.00 0.22 H new ATOM 0 HB2 LEU A 40 -6.937 7.029 -0.538 1.00 0.25 H new ATOM 0 HB3 LEU A 40 -8.021 6.584 -1.841 1.00 0.25 H new ATOM 0 HG LEU A 40 -6.684 9.316 -1.742 1.00 0.31 H new ATOM 0 HD11 LEU A 40 -4.987 8.380 -3.284 1.00 0.54 H new ATOM 0 HD12 LEU A 40 -4.938 7.555 -1.707 1.00 0.54 H new ATOM 0 HD13 LEU A 40 -5.711 6.764 -3.102 1.00 0.54 H new ATOM 0 HD21 LEU A 40 -7.159 9.242 -4.170 1.00 0.32 H new ATOM 0 HD22 LEU A 40 -7.871 7.622 -3.982 1.00 0.32 H new ATOM 0 HD23 LEU A 40 -8.650 9.030 -3.222 1.00 0.32 H new ATOM 345 N ARG A 41 -9.312 7.796 1.723 1.00 0.24 N ATOM 346 CA ARG A 41 -9.880 6.981 2.828 1.00 0.32 C ATOM 347 C ARG A 41 -10.809 7.841 3.690 1.00 0.32 C ATOM 348 O ARG A 41 -11.363 7.376 4.662 1.00 0.42 O ATOM 349 CB ARG A 41 -8.754 6.423 3.694 1.00 0.42 C ATOM 350 CG ARG A 41 -9.293 5.248 4.508 1.00 0.51 C ATOM 351 CD ARG A 41 -8.287 4.873 5.597 1.00 0.69 C ATOM 352 NE ARG A 41 -8.678 5.526 6.878 1.00 0.94 N ATOM 353 CZ ARG A 41 -8.578 4.869 8.001 1.00 1.18 C ATOM 354 NH1 ARG A 41 -9.069 3.663 8.097 1.00 1.98 N ATOM 355 NH2 ARG A 41 -7.990 5.418 9.029 1.00 1.64 N ATOM 0 H ARG A 41 -8.925 8.699 1.999 1.00 0.24 H new ATOM 0 HA ARG A 41 -10.449 6.156 2.400 1.00 0.32 H new ATOM 0 HB2 ARG A 41 -7.923 6.098 3.068 1.00 0.42 H new ATOM 0 HB3 ARG A 41 -8.370 7.197 4.358 1.00 0.42 H new ATOM 0 HG2 ARG A 41 -10.250 5.513 4.958 1.00 0.51 H new ATOM 0 HG3 ARG A 41 -9.474 4.393 3.856 1.00 0.51 H new ATOM 0 HD2 ARG A 41 -8.257 3.791 5.722 1.00 0.69 H new ATOM 0 HD3 ARG A 41 -7.285 5.189 5.306 1.00 0.69 H new ATOM 0 HE ARG A 41 -9.024 6.486 6.877 1.00 0.94 H new ATOM 0 HH11 ARG A 41 -9.530 3.235 7.294 1.00 1.98 H new ATOM 0 HH12 ARG A 41 -8.991 3.149 8.975 1.00 1.98 H new ATOM 0 HH21 ARG A 41 -7.608 6.361 8.955 1.00 1.64 H new ATOM 0 HH22 ARG A 41 -7.912 4.904 9.907 1.00 1.64 H new ATOM 369 N LYS A 42 -10.996 9.087 3.345 1.00 0.29 N ATOM 370 CA LYS A 42 -11.902 9.947 4.147 1.00 0.35 C ATOM 371 C LYS A 42 -13.328 9.755 3.634 1.00 0.39 C ATOM 372 O LYS A 42 -14.270 9.621 4.396 1.00 0.45 O ATOM 373 CB LYS A 42 -11.487 11.410 3.974 1.00 0.38 C ATOM 374 CG LYS A 42 -12.129 12.264 5.069 1.00 0.73 C ATOM 375 CD LYS A 42 -11.700 13.722 4.891 1.00 1.48 C ATOM 376 CE LYS A 42 -11.989 14.501 6.175 1.00 2.11 C ATOM 377 NZ LYS A 42 -11.582 15.924 5.995 1.00 2.87 N ATOM 0 H LYS A 42 -10.560 9.542 2.543 1.00 0.29 H new ATOM 0 HA LYS A 42 -11.846 9.679 5.202 1.00 0.35 H new ATOM 0 HB2 LYS A 42 -10.402 11.498 4.021 1.00 0.38 H new ATOM 0 HB3 LYS A 42 -11.793 11.771 2.992 1.00 0.38 H new ATOM 0 HG2 LYS A 42 -13.215 12.184 5.019 1.00 0.73 H new ATOM 0 HG3 LYS A 42 -11.828 11.902 6.052 1.00 0.73 H new ATOM 0 HD2 LYS A 42 -10.637 13.773 4.654 1.00 1.48 H new ATOM 0 HD3 LYS A 42 -12.235 14.170 4.054 1.00 1.48 H new ATOM 0 HE2 LYS A 42 -13.050 14.443 6.417 1.00 2.11 H new ATOM 0 HE3 LYS A 42 -11.447 14.059 7.011 1.00 2.11 H new ATOM 0 HZ1 LYS A 42 -11.778 16.454 6.868 1.00 2.87 H new ATOM 0 HZ2 LYS A 42 -10.565 15.970 5.783 1.00 2.87 H new ATOM 0 HZ3 LYS A 42 -12.119 16.342 5.208 1.00 2.87 H new ATOM 391 N GLU A 43 -13.484 9.723 2.338 1.00 0.41 N ATOM 392 CA GLU A 43 -14.831 9.531 1.748 1.00 0.51 C ATOM 393 C GLU A 43 -15.175 8.047 1.768 1.00 0.54 C ATOM 394 O GLU A 43 -16.284 7.660 2.097 1.00 0.61 O ATOM 395 CB GLU A 43 -14.828 10.036 0.303 1.00 0.56 C ATOM 396 CG GLU A 43 -16.108 10.832 0.040 1.00 0.83 C ATOM 397 CD GLU A 43 -16.272 11.054 -1.465 1.00 1.48 C ATOM 398 OE1 GLU A 43 -15.268 11.051 -2.157 1.00 2.23 O ATOM 399 OE2 GLU A 43 -17.400 11.222 -1.899 1.00 1.97 O ATOM 0 H GLU A 43 -12.727 9.823 1.661 1.00 0.41 H new ATOM 0 HA GLU A 43 -15.571 10.087 2.324 1.00 0.51 H new ATOM 0 HB2 GLU A 43 -13.954 10.663 0.127 1.00 0.56 H new ATOM 0 HB3 GLU A 43 -14.761 9.195 -0.388 1.00 0.56 H new ATOM 0 HG2 GLU A 43 -16.970 10.295 0.435 1.00 0.83 H new ATOM 0 HG3 GLU A 43 -16.065 11.791 0.557 1.00 0.83 H new ATOM 406 N THR A 44 -14.226 7.208 1.428 1.00 0.55 N ATOM 407 CA THR A 44 -14.490 5.742 1.426 1.00 0.62 C ATOM 408 C THR A 44 -14.248 5.157 2.823 1.00 0.67 C ATOM 409 O THR A 44 -13.703 4.082 2.975 1.00 1.06 O ATOM 410 CB THR A 44 -13.585 5.049 0.402 1.00 0.79 C ATOM 411 OG1 THR A 44 -13.962 3.683 0.290 1.00 1.32 O ATOM 412 CG2 THR A 44 -12.126 5.140 0.847 1.00 0.64 C ATOM 0 H THR A 44 -13.282 7.479 1.153 1.00 0.55 H new ATOM 0 HA THR A 44 -15.531 5.573 1.152 1.00 0.62 H new ATOM 0 HB THR A 44 -13.694 5.542 -0.564 1.00 0.79 H new ATOM 0 HG1 THR A 44 -14.018 3.285 1.184 1.00 1.32 H new ATOM 0 HG21 THR A 44 -11.490 4.645 0.113 1.00 0.64 H new ATOM 0 HG22 THR A 44 -11.836 6.187 0.931 1.00 0.64 H new ATOM 0 HG23 THR A 44 -12.010 4.653 1.815 1.00 0.64 H new ATOM 420 N CYS A 45 -14.680 5.850 3.836 1.00 0.59 N ATOM 421 CA CYS A 45 -14.523 5.353 5.225 1.00 0.67 C ATOM 422 C CYS A 45 -15.702 5.896 6.020 1.00 0.73 C ATOM 423 O CYS A 45 -16.383 5.175 6.722 1.00 0.87 O ATOM 424 CB CYS A 45 -13.208 5.854 5.831 1.00 0.88 C ATOM 425 SG CYS A 45 -13.098 5.353 7.573 1.00 1.59 S ATOM 0 H CYS A 45 -15.143 6.755 3.757 1.00 0.59 H new ATOM 0 HA CYS A 45 -14.499 4.263 5.245 1.00 0.67 H new ATOM 0 HB2 CYS A 45 -12.363 5.449 5.273 1.00 0.88 H new ATOM 0 HB3 CYS A 45 -13.152 6.940 5.752 1.00 0.88 H new ATOM 430 N ASN A 46 -15.967 7.168 5.886 1.00 0.75 N ATOM 431 CA ASN A 46 -17.124 7.758 6.601 1.00 1.01 C ATOM 432 C ASN A 46 -18.393 7.399 5.828 1.00 1.03 C ATOM 433 O ASN A 46 -19.341 6.877 6.381 1.00 1.16 O ATOM 434 CB ASN A 46 -16.970 9.280 6.665 1.00 1.24 C ATOM 435 CG ASN A 46 -17.084 9.744 8.119 1.00 1.59 C ATOM 436 OD1 ASN A 46 -17.610 9.037 8.956 1.00 2.00 O ATOM 437 ND2 ASN A 46 -16.610 10.912 8.457 1.00 2.18 N ATOM 0 H ASN A 46 -15.431 7.819 5.312 1.00 0.75 H new ATOM 0 HA ASN A 46 -17.179 7.370 7.618 1.00 1.01 H new ATOM 0 HB2 ASN A 46 -16.006 9.576 6.252 1.00 1.24 H new ATOM 0 HB3 ASN A 46 -17.738 9.760 6.058 1.00 1.24 H new ATOM 0 HD21 ASN A 46 -16.681 11.231 9.423 1.00 2.18 H new ATOM 0 HD22 ASN A 46 -16.168 11.506 7.755 1.00 2.18 H new ATOM 444 N LYS A 47 -18.413 7.660 4.545 1.00 0.97 N ATOM 445 CA LYS A 47 -19.612 7.318 3.735 1.00 1.12 C ATOM 446 C LYS A 47 -19.437 5.924 3.122 1.00 1.07 C ATOM 447 O LYS A 47 -19.935 5.645 2.049 1.00 1.36 O ATOM 448 CB LYS A 47 -19.788 8.352 2.622 1.00 1.24 C ATOM 449 CG LYS A 47 -20.311 9.660 3.221 1.00 1.87 C ATOM 450 CD LYS A 47 -21.123 10.417 2.169 1.00 2.47 C ATOM 451 CE LYS A 47 -22.584 10.501 2.615 1.00 3.16 C ATOM 452 NZ LYS A 47 -23.105 11.874 2.358 1.00 3.73 N ATOM 0 H LYS A 47 -17.649 8.095 4.028 1.00 0.97 H new ATOM 0 HA LYS A 47 -20.495 7.322 4.374 1.00 1.12 H new ATOM 0 HB2 LYS A 47 -18.837 8.525 2.117 1.00 1.24 H new ATOM 0 HB3 LYS A 47 -20.484 7.979 1.871 1.00 1.24 H new ATOM 0 HG2 LYS A 47 -20.931 9.450 4.092 1.00 1.87 H new ATOM 0 HG3 LYS A 47 -19.478 10.274 3.563 1.00 1.87 H new ATOM 0 HD2 LYS A 47 -20.716 11.419 2.031 1.00 2.47 H new ATOM 0 HD3 LYS A 47 -21.054 9.910 1.207 1.00 2.47 H new ATOM 0 HE2 LYS A 47 -23.183 9.767 2.076 1.00 3.16 H new ATOM 0 HE3 LYS A 47 -22.666 10.262 3.675 1.00 3.16 H new ATOM 0 HZ1 LYS A 47 -24.098 11.931 2.661 1.00 3.73 H new ATOM 0 HZ2 LYS A 47 -22.540 12.565 2.891 1.00 3.73 H new ATOM 0 HZ3 LYS A 47 -23.041 12.085 1.342 1.00 3.73 H new ATOM 466 N SER A 48 -18.722 5.051 3.781 1.00 0.93 N ATOM 467 CA SER A 48 -18.510 3.688 3.215 1.00 1.01 C ATOM 468 C SER A 48 -19.266 2.637 4.036 1.00 1.21 C ATOM 469 O SER A 48 -19.283 1.473 3.697 1.00 1.75 O ATOM 470 CB SER A 48 -17.018 3.362 3.229 1.00 1.16 C ATOM 471 OG SER A 48 -16.659 2.757 1.994 1.00 1.88 O ATOM 0 H SER A 48 -18.278 5.222 4.683 1.00 0.93 H new ATOM 0 HA SER A 48 -18.888 3.671 2.193 1.00 1.01 H new ATOM 0 HB2 SER A 48 -16.437 4.271 3.385 1.00 1.16 H new ATOM 0 HB3 SER A 48 -16.788 2.691 4.057 1.00 1.16 H new ATOM 0 HG SER A 48 -17.374 2.151 1.706 1.00 1.88 H new ATOM 477 N ASN A 49 -19.881 3.026 5.120 1.00 1.29 N ATOM 478 CA ASN A 49 -20.632 2.038 5.957 1.00 1.73 C ATOM 479 C ASN A 49 -19.785 0.780 6.221 1.00 1.60 C ATOM 480 O ASN A 49 -20.308 -0.262 6.562 1.00 2.22 O ATOM 481 CB ASN A 49 -21.914 1.633 5.227 1.00 2.21 C ATOM 482 CG ASN A 49 -23.087 1.639 6.208 1.00 2.83 C ATOM 483 OD1 ASN A 49 -23.046 0.976 7.226 1.00 3.24 O ATOM 484 ND2 ASN A 49 -24.139 2.364 5.944 1.00 3.43 N ATOM 0 H ASN A 49 -19.898 3.986 5.465 1.00 1.29 H new ATOM 0 HA ASN A 49 -20.869 2.505 6.913 1.00 1.73 H new ATOM 0 HB2 ASN A 49 -22.110 2.322 4.406 1.00 2.21 H new ATOM 0 HB3 ASN A 49 -21.798 0.641 4.790 1.00 2.21 H new ATOM 0 HD21 ASN A 49 -24.927 2.374 6.592 1.00 3.43 H new ATOM 0 HD22 ASN A 49 -24.174 2.920 5.090 1.00 3.43 H new ATOM 491 N MET A 50 -18.489 0.863 6.073 1.00 1.07 N ATOM 492 CA MET A 50 -17.632 -0.332 6.322 1.00 1.12 C ATOM 493 C MET A 50 -16.243 0.130 6.760 1.00 1.30 C ATOM 494 O MET A 50 -15.237 -0.428 6.368 1.00 1.60 O ATOM 495 CB MET A 50 -17.515 -1.157 5.038 1.00 1.14 C ATOM 496 CG MET A 50 -18.032 -2.574 5.294 1.00 1.53 C ATOM 497 SD MET A 50 -17.971 -3.526 3.755 1.00 1.54 S ATOM 498 CE MET A 50 -19.108 -2.490 2.801 1.00 1.00 C ATOM 0 H MET A 50 -17.988 1.706 5.791 1.00 1.07 H new ATOM 0 HA MET A 50 -18.079 -0.946 7.104 1.00 1.12 H new ATOM 0 HB2 MET A 50 -18.088 -0.688 4.238 1.00 1.14 H new ATOM 0 HB3 MET A 50 -16.477 -1.191 4.708 1.00 1.14 H new ATOM 0 HG2 MET A 50 -17.427 -3.061 6.059 1.00 1.53 H new ATOM 0 HG3 MET A 50 -19.054 -2.537 5.671 1.00 1.53 H new ATOM 0 HE1 MET A 50 -19.470 -3.047 1.937 1.00 1.00 H new ATOM 0 HE2 MET A 50 -19.952 -2.204 3.428 1.00 1.00 H new ATOM 0 HE3 MET A 50 -18.587 -1.594 2.463 1.00 1.00 H new ATOM 508 N CYS A 51 -16.181 1.156 7.565 1.00 1.63 N ATOM 509 CA CYS A 51 -14.861 1.670 8.025 1.00 2.23 C ATOM 510 C CYS A 51 -15.052 2.399 9.353 1.00 3.09 C ATOM 511 O CYS A 51 -14.489 2.035 10.368 1.00 3.76 O ATOM 512 CB CYS A 51 -14.329 2.650 6.979 1.00 2.12 C ATOM 513 SG CYS A 51 -12.755 3.361 7.523 1.00 2.01 S ATOM 0 H CYS A 51 -16.991 1.661 7.924 1.00 1.63 H new ATOM 0 HA CYS A 51 -14.156 0.849 8.156 1.00 2.23 H new ATOM 0 HB2 CYS A 51 -14.194 2.137 6.027 1.00 2.12 H new ATOM 0 HB3 CYS A 51 -15.056 3.445 6.813 1.00 2.12 H new ATOM 518 N GLU A 52 -15.852 3.425 9.346 1.00 3.40 N ATOM 519 CA GLU A 52 -16.107 4.194 10.591 1.00 4.27 C ATOM 520 C GLU A 52 -17.362 5.039 10.388 1.00 3.97 C ATOM 521 O GLU A 52 -17.405 6.204 10.733 1.00 4.48 O ATOM 522 CB GLU A 52 -14.914 5.105 10.888 1.00 4.96 C ATOM 523 CG GLU A 52 -13.932 4.375 11.807 1.00 5.81 C ATOM 524 CD GLU A 52 -13.612 5.255 13.016 1.00 6.60 C ATOM 525 OE1 GLU A 52 -14.518 5.908 13.505 1.00 6.88 O ATOM 526 OE2 GLU A 52 -12.465 5.260 13.433 1.00 7.17 O ATOM 0 H GLU A 52 -16.345 3.767 8.521 1.00 3.40 H new ATOM 0 HA GLU A 52 -16.247 3.512 11.430 1.00 4.27 H new ATOM 0 HB2 GLU A 52 -14.418 5.388 9.959 1.00 4.96 H new ATOM 0 HB3 GLU A 52 -15.255 6.026 11.360 1.00 4.96 H new ATOM 0 HG2 GLU A 52 -14.361 3.429 12.136 1.00 5.81 H new ATOM 0 HG3 GLU A 52 -13.017 4.138 11.264 1.00 5.81 H new ATOM 533 N SER A 53 -18.386 4.457 9.819 1.00 3.41 N ATOM 534 CA SER A 53 -19.646 5.215 9.576 1.00 3.37 C ATOM 535 C SER A 53 -20.068 5.946 10.853 1.00 3.94 C ATOM 536 O SER A 53 -19.943 7.150 10.963 1.00 4.31 O ATOM 537 CB SER A 53 -20.752 4.243 9.160 1.00 3.82 C ATOM 538 OG SER A 53 -22.020 4.840 9.402 1.00 3.91 O ATOM 0 H SER A 53 -18.402 3.485 9.511 1.00 3.41 H new ATOM 0 HA SER A 53 -19.479 5.944 8.783 1.00 3.37 H new ATOM 0 HB2 SER A 53 -20.652 3.991 8.104 1.00 3.82 H new ATOM 0 HB3 SER A 53 -20.663 3.312 9.720 1.00 3.82 H new ATOM 0 HG SER A 53 -22.730 4.220 9.135 1.00 3.91 H new ATOM 544 N SER A 54 -20.564 5.225 11.819 1.00 4.37 N ATOM 545 CA SER A 54 -20.991 5.872 13.088 1.00 5.11 C ATOM 546 C SER A 54 -21.361 4.791 14.102 1.00 5.60 C ATOM 547 O SER A 54 -22.249 4.963 14.913 1.00 6.10 O ATOM 548 CB SER A 54 -22.204 6.763 12.823 1.00 5.55 C ATOM 549 OG SER A 54 -21.787 8.121 12.779 1.00 5.70 O ATOM 0 H SER A 54 -20.692 4.214 11.783 1.00 4.37 H new ATOM 0 HA SER A 54 -20.177 6.480 13.483 1.00 5.11 H new ATOM 0 HB2 SER A 54 -22.676 6.484 11.881 1.00 5.55 H new ATOM 0 HB3 SER A 54 -22.950 6.624 13.606 1.00 5.55 H new ATOM 0 HG SER A 54 -21.047 8.216 12.143 1.00 5.70 H new ATOM 555 N LYS A 55 -20.687 3.676 14.059 1.00 5.73 N ATOM 556 CA LYS A 55 -20.999 2.581 15.016 1.00 6.38 C ATOM 557 C LYS A 55 -19.787 1.658 15.149 1.00 6.02 C ATOM 558 O LYS A 55 -19.345 1.351 16.238 1.00 6.54 O ATOM 559 CB LYS A 55 -22.192 1.776 14.493 1.00 6.90 C ATOM 560 CG LYS A 55 -23.493 2.514 14.816 1.00 7.50 C ATOM 561 CD LYS A 55 -23.956 3.299 13.586 1.00 7.79 C ATOM 562 CE LYS A 55 -25.161 2.597 12.954 1.00 8.57 C ATOM 563 NZ LYS A 55 -25.731 3.458 11.878 1.00 9.17 N ATOM 0 H LYS A 55 -19.933 3.476 13.402 1.00 5.73 H new ATOM 0 HA LYS A 55 -21.241 3.007 15.990 1.00 6.38 H new ATOM 0 HB2 LYS A 55 -22.102 1.632 13.416 1.00 6.90 H new ATOM 0 HB3 LYS A 55 -22.202 0.785 14.947 1.00 6.90 H new ATOM 0 HG2 LYS A 55 -24.262 1.802 15.116 1.00 7.50 H new ATOM 0 HG3 LYS A 55 -23.340 3.191 15.656 1.00 7.50 H new ATOM 0 HD2 LYS A 55 -24.223 4.317 13.871 1.00 7.79 H new ATOM 0 HD3 LYS A 55 -23.144 3.373 12.862 1.00 7.79 H new ATOM 0 HE2 LYS A 55 -24.859 1.634 12.542 1.00 8.57 H new ATOM 0 HE3 LYS A 55 -25.917 2.396 13.713 1.00 8.57 H new ATOM 0 HZ1 LYS A 55 -26.549 2.981 11.449 1.00 9.17 H new ATOM 0 HZ2 LYS A 55 -26.033 4.366 12.284 1.00 9.17 H new ATOM 0 HZ3 LYS A 55 -25.008 3.628 11.150 1.00 9.17 H new ATOM 577 N GLU A 56 -19.251 1.204 14.047 1.00 5.29 N ATOM 578 CA GLU A 56 -18.069 0.286 14.110 1.00 4.96 C ATOM 579 C GLU A 56 -17.670 -0.143 12.711 1.00 3.92 C ATOM 580 O GLU A 56 -16.617 0.203 12.213 1.00 3.82 O ATOM 581 CB GLU A 56 -18.397 -1.002 14.888 1.00 5.43 C ATOM 582 CG GLU A 56 -19.912 -1.232 14.958 1.00 5.76 C ATOM 583 CD GLU A 56 -20.194 -2.712 15.227 1.00 6.70 C ATOM 584 OE1 GLU A 56 -19.604 -3.248 16.151 1.00 7.03 O ATOM 585 OE2 GLU A 56 -20.993 -3.284 14.504 1.00 7.28 O ATOM 0 H GLU A 56 -19.577 1.427 13.107 1.00 5.29 H new ATOM 0 HA GLU A 56 -17.269 0.834 14.607 1.00 4.96 H new ATOM 0 HB2 GLU A 56 -17.918 -1.854 14.406 1.00 5.43 H new ATOM 0 HB3 GLU A 56 -17.989 -0.936 15.896 1.00 5.43 H new ATOM 0 HG2 GLU A 56 -20.347 -0.619 15.747 1.00 5.76 H new ATOM 0 HG3 GLU A 56 -20.380 -0.926 14.022 1.00 5.76 H new ATOM 592 N ALA A 57 -18.500 -0.945 12.100 1.00 3.54 N ATOM 593 CA ALA A 57 -18.200 -1.477 10.754 1.00 2.82 C ATOM 594 C ALA A 57 -17.186 -2.600 10.922 1.00 2.73 C ATOM 595 O ALA A 57 -15.992 -2.411 10.795 1.00 2.74 O ATOM 596 CB ALA A 57 -17.646 -0.379 9.854 1.00 2.63 C ATOM 0 H ALA A 57 -19.389 -1.256 12.491 1.00 3.54 H new ATOM 0 HA ALA A 57 -19.107 -1.853 10.282 1.00 2.82 H new ATOM 0 HB1 ALA A 57 -17.431 -0.791 8.868 1.00 2.63 H new ATOM 0 HB2 ALA A 57 -18.381 0.421 9.761 1.00 2.63 H new ATOM 0 HB3 ALA A 57 -16.729 0.019 10.288 1.00 2.63 H new ATOM 602 N LEU A 58 -17.667 -3.765 11.244 1.00 3.04 N ATOM 603 CA LEU A 58 -16.762 -4.923 11.471 1.00 3.22 C ATOM 604 C LEU A 58 -15.930 -5.197 10.223 1.00 2.88 C ATOM 605 O LEU A 58 -16.352 -5.886 9.316 1.00 3.29 O ATOM 606 CB LEU A 58 -17.600 -6.156 11.807 1.00 3.91 C ATOM 607 CG LEU A 58 -18.399 -5.889 13.083 1.00 4.37 C ATOM 608 CD1 LEU A 58 -19.756 -6.589 12.994 1.00 4.88 C ATOM 609 CD2 LEU A 58 -17.625 -6.428 14.287 1.00 5.08 C ATOM 0 H LEU A 58 -18.660 -3.967 11.361 1.00 3.04 H new ATOM 0 HA LEU A 58 -16.089 -4.694 12.298 1.00 3.22 H new ATOM 0 HB2 LEU A 58 -18.275 -6.387 10.983 1.00 3.91 H new ATOM 0 HB3 LEU A 58 -16.954 -7.023 11.943 1.00 3.91 H new ATOM 0 HG LEU A 58 -18.553 -4.816 13.198 1.00 4.37 H new ATOM 0 HD11 LEU A 58 -20.324 -6.398 13.904 1.00 4.88 H new ATOM 0 HD12 LEU A 58 -20.307 -6.206 12.135 1.00 4.88 H new ATOM 0 HD13 LEU A 58 -19.605 -7.662 12.879 1.00 4.88 H new ATOM 0 HD21 LEU A 58 -18.192 -6.239 15.198 1.00 5.08 H new ATOM 0 HD22 LEU A 58 -17.472 -7.501 14.171 1.00 5.08 H new ATOM 0 HD23 LEU A 58 -16.658 -5.929 14.351 1.00 5.08 H new ATOM 621 N ALA A 59 -14.739 -4.673 10.183 1.00 2.52 N ATOM 622 CA ALA A 59 -13.857 -4.912 9.005 1.00 2.37 C ATOM 623 C ALA A 59 -12.998 -6.147 9.278 1.00 2.14 C ATOM 624 O ALA A 59 -11.787 -6.073 9.347 1.00 2.55 O ATOM 625 CB ALA A 59 -12.952 -3.699 8.783 1.00 2.97 C ATOM 0 H ALA A 59 -14.336 -4.088 10.915 1.00 2.52 H new ATOM 0 HA ALA A 59 -14.465 -5.069 8.114 1.00 2.37 H new ATOM 0 HB1 ALA A 59 -12.309 -3.878 7.921 1.00 2.97 H new ATOM 0 HB2 ALA A 59 -13.565 -2.816 8.602 1.00 2.97 H new ATOM 0 HB3 ALA A 59 -12.336 -3.538 9.668 1.00 2.97 H new ATOM 631 N GLU A 60 -13.620 -7.282 9.450 1.00 2.06 N ATOM 632 CA GLU A 60 -12.850 -8.520 9.739 1.00 2.45 C ATOM 633 C GLU A 60 -12.647 -9.326 8.453 1.00 2.24 C ATOM 634 O GLU A 60 -12.395 -10.514 8.492 1.00 2.64 O ATOM 635 CB GLU A 60 -13.633 -9.357 10.748 1.00 3.15 C ATOM 636 CG GLU A 60 -12.668 -9.976 11.758 1.00 3.96 C ATOM 637 CD GLU A 60 -12.642 -11.494 11.579 1.00 4.57 C ATOM 638 OE1 GLU A 60 -13.708 -12.086 11.546 1.00 4.63 O ATOM 639 OE2 GLU A 60 -11.555 -12.040 11.478 1.00 5.26 O ATOM 0 H GLU A 60 -14.632 -7.403 9.402 1.00 2.06 H new ATOM 0 HA GLU A 60 -11.873 -8.257 10.145 1.00 2.45 H new ATOM 0 HB2 GLU A 60 -14.364 -8.734 11.263 1.00 3.15 H new ATOM 0 HB3 GLU A 60 -14.188 -10.141 10.233 1.00 3.15 H new ATOM 0 HG2 GLU A 60 -11.668 -9.566 11.619 1.00 3.96 H new ATOM 0 HG3 GLU A 60 -12.977 -9.725 12.773 1.00 3.96 H new ATOM 646 N ASN A 61 -12.747 -8.696 7.315 1.00 1.86 N ATOM 647 CA ASN A 61 -12.550 -9.443 6.040 1.00 1.81 C ATOM 648 C ASN A 61 -11.061 -9.746 5.860 1.00 1.61 C ATOM 649 O ASN A 61 -10.676 -10.866 5.589 1.00 2.22 O ATOM 650 CB ASN A 61 -13.049 -8.601 4.865 1.00 2.30 C ATOM 651 CG ASN A 61 -13.769 -9.507 3.864 1.00 2.81 C ATOM 652 OD1 ASN A 61 -13.491 -9.468 2.682 1.00 3.34 O ATOM 653 ND2 ASN A 61 -14.689 -10.328 4.293 1.00 3.32 N ATOM 0 H ASN A 61 -12.955 -7.703 7.212 1.00 1.86 H new ATOM 0 HA ASN A 61 -13.113 -10.376 6.074 1.00 1.81 H new ATOM 0 HB2 ASN A 61 -13.725 -7.823 5.221 1.00 2.30 H new ATOM 0 HB3 ASN A 61 -12.212 -8.098 4.381 1.00 2.30 H new ATOM 0 HD21 ASN A 61 -15.175 -10.938 3.636 1.00 3.32 H new ATOM 0 HD22 ASN A 61 -14.921 -10.360 5.286 1.00 3.32 H new ATOM 660 N ASN A 62 -10.223 -8.756 6.011 1.00 1.34 N ATOM 661 CA ASN A 62 -8.759 -8.977 5.857 1.00 1.44 C ATOM 662 C ASN A 62 -8.450 -9.398 4.424 1.00 1.16 C ATOM 663 O ASN A 62 -8.498 -10.562 4.080 1.00 1.64 O ATOM 664 CB ASN A 62 -8.290 -10.067 6.826 1.00 1.82 C ATOM 665 CG ASN A 62 -8.690 -9.688 8.253 1.00 2.32 C ATOM 666 OD1 ASN A 62 -9.595 -8.904 8.455 1.00 2.85 O ATOM 667 ND2 ASN A 62 -8.048 -10.216 9.259 1.00 2.66 N ATOM 0 H ASN A 62 -10.493 -7.798 6.236 1.00 1.34 H new ATOM 0 HA ASN A 62 -8.234 -8.049 6.082 1.00 1.44 H new ATOM 0 HB2 ASN A 62 -8.734 -11.025 6.555 1.00 1.82 H new ATOM 0 HB3 ASN A 62 -7.209 -10.187 6.760 1.00 1.82 H new ATOM 0 HD21 ASN A 62 -8.306 -9.970 10.215 1.00 2.66 H new ATOM 0 HD22 ASN A 62 -7.288 -10.875 9.090 1.00 2.66 H new ATOM 674 N LEU A 63 -8.123 -8.454 3.591 1.00 1.09 N ATOM 675 CA LEU A 63 -7.796 -8.778 2.179 1.00 0.86 C ATOM 676 C LEU A 63 -6.639 -9.775 2.150 1.00 0.83 C ATOM 677 O LEU A 63 -6.269 -10.338 3.161 1.00 1.06 O ATOM 678 CB LEU A 63 -7.389 -7.494 1.460 1.00 0.96 C ATOM 679 CG LEU A 63 -8.580 -6.963 0.666 1.00 0.92 C ATOM 680 CD1 LEU A 63 -8.206 -5.634 0.009 1.00 1.09 C ATOM 681 CD2 LEU A 63 -8.960 -7.977 -0.415 1.00 1.23 C ATOM 0 H LEU A 63 -8.068 -7.464 3.830 1.00 1.09 H new ATOM 0 HA LEU A 63 -8.662 -9.216 1.683 1.00 0.86 H new ATOM 0 HB2 LEU A 63 -7.057 -6.748 2.182 1.00 0.96 H new ATOM 0 HB3 LEU A 63 -6.549 -7.687 0.793 1.00 0.96 H new ATOM 0 HG LEU A 63 -9.425 -6.809 1.337 1.00 0.92 H new ATOM 0 HD11 LEU A 63 -9.057 -5.256 -0.558 1.00 1.09 H new ATOM 0 HD12 LEU A 63 -7.933 -4.912 0.778 1.00 1.09 H new ATOM 0 HD13 LEU A 63 -7.361 -5.785 -0.663 1.00 1.09 H new ATOM 0 HD21 LEU A 63 -9.810 -7.601 -0.984 1.00 1.23 H new ATOM 0 HD22 LEU A 63 -8.114 -8.129 -1.085 1.00 1.23 H new ATOM 0 HD23 LEU A 63 -9.227 -8.925 0.053 1.00 1.23 H new ATOM 693 N ASN A 64 -6.064 -10.002 1.004 1.00 0.78 N ATOM 694 CA ASN A 64 -4.935 -10.967 0.927 1.00 1.06 C ATOM 695 C ASN A 64 -3.644 -10.224 0.592 1.00 1.04 C ATOM 696 O ASN A 64 -2.861 -10.663 -0.227 1.00 1.41 O ATOM 697 CB ASN A 64 -5.224 -12.009 -0.157 1.00 1.37 C ATOM 698 CG ASN A 64 -4.494 -13.310 0.182 1.00 1.67 C ATOM 699 OD1 ASN A 64 -3.803 -13.390 1.178 1.00 2.33 O ATOM 700 ND2 ASN A 64 -4.620 -14.341 -0.608 1.00 2.09 N ATOM 0 H ASN A 64 -6.325 -9.563 0.121 1.00 0.78 H new ATOM 0 HA ASN A 64 -4.823 -11.467 1.889 1.00 1.06 H new ATOM 0 HB2 ASN A 64 -6.297 -12.189 -0.228 1.00 1.37 H new ATOM 0 HB3 ASN A 64 -4.898 -11.639 -1.129 1.00 1.37 H new ATOM 0 HD21 ASN A 64 -4.139 -15.213 -0.389 1.00 2.09 H new ATOM 0 HD22 ASN A 64 -5.200 -14.275 -1.444 1.00 2.09 H new ATOM 707 N LEU A 65 -3.404 -9.104 1.221 1.00 0.82 N ATOM 708 CA LEU A 65 -2.153 -8.356 0.929 1.00 0.85 C ATOM 709 C LEU A 65 -1.332 -8.092 2.213 1.00 0.91 C ATOM 710 O LEU A 65 -0.835 -6.997 2.384 1.00 1.32 O ATOM 711 CB LEU A 65 -2.519 -7.018 0.286 1.00 0.85 C ATOM 712 CG LEU A 65 -3.311 -6.167 1.280 1.00 0.71 C ATOM 713 CD1 LEU A 65 -2.628 -4.809 1.443 1.00 0.62 C ATOM 714 CD2 LEU A 65 -4.735 -5.958 0.757 1.00 0.76 C ATOM 0 H LEU A 65 -4.016 -8.680 1.918 1.00 0.82 H new ATOM 0 HA LEU A 65 -1.542 -8.958 0.256 1.00 0.85 H new ATOM 0 HB2 LEU A 65 -1.615 -6.491 -0.019 1.00 0.85 H new ATOM 0 HB3 LEU A 65 -3.109 -7.186 -0.615 1.00 0.85 H new ATOM 0 HG LEU A 65 -3.349 -6.677 2.243 1.00 0.71 H new ATOM 0 HD11 LEU A 65 -3.191 -4.201 2.151 1.00 0.62 H new ATOM 0 HD12 LEU A 65 -1.614 -4.954 1.815 1.00 0.62 H new ATOM 0 HD13 LEU A 65 -2.591 -4.302 0.479 1.00 0.62 H new ATOM 0 HD21 LEU A 65 -5.298 -5.351 1.467 1.00 0.76 H new ATOM 0 HD22 LEU A 65 -4.698 -5.449 -0.206 1.00 0.76 H new ATOM 0 HD23 LEU A 65 -5.224 -6.925 0.638 1.00 0.76 H new ATOM 726 N PRO A 66 -1.183 -9.083 3.079 1.00 1.52 N ATOM 727 CA PRO A 66 -0.394 -8.914 4.316 1.00 1.68 C ATOM 728 C PRO A 66 1.101 -9.011 3.996 1.00 1.24 C ATOM 729 O PRO A 66 1.495 -9.653 3.043 1.00 2.04 O ATOM 730 CB PRO A 66 -0.822 -10.094 5.189 1.00 2.99 C ATOM 731 CG PRO A 66 -1.362 -11.171 4.222 1.00 3.54 C ATOM 732 CD PRO A 66 -1.767 -10.438 2.930 1.00 2.60 C ATOM 0 HA PRO A 66 -0.558 -7.950 4.798 1.00 1.68 H new ATOM 0 HB2 PRO A 66 0.019 -10.476 5.767 1.00 2.99 H new ATOM 0 HB3 PRO A 66 -1.588 -9.792 5.903 1.00 2.99 H new ATOM 0 HG2 PRO A 66 -0.602 -11.925 4.018 1.00 3.54 H new ATOM 0 HG3 PRO A 66 -2.216 -11.690 4.657 1.00 3.54 H new ATOM 0 HD2 PRO A 66 -1.377 -10.944 2.047 1.00 2.60 H new ATOM 0 HD3 PRO A 66 -2.851 -10.394 2.820 1.00 2.60 H new ATOM 740 N LYS A 67 1.939 -8.392 4.783 1.00 0.90 N ATOM 741 CA LYS A 67 3.403 -8.469 4.511 1.00 1.63 C ATOM 742 C LYS A 67 4.163 -7.578 5.496 1.00 1.28 C ATOM 743 O LYS A 67 4.935 -6.722 5.110 1.00 1.39 O ATOM 744 CB LYS A 67 3.683 -8.004 3.081 1.00 2.54 C ATOM 745 CG LYS A 67 4.617 -9.003 2.392 1.00 3.42 C ATOM 746 CD LYS A 67 3.792 -10.003 1.579 1.00 4.25 C ATOM 747 CE LYS A 67 3.564 -11.270 2.408 1.00 5.03 C ATOM 748 NZ LYS A 67 2.414 -12.035 1.846 1.00 5.78 N ATOM 0 H LYS A 67 1.675 -7.839 5.598 1.00 0.90 H new ATOM 0 HA LYS A 67 3.735 -9.500 4.631 1.00 1.63 H new ATOM 0 HB2 LYS A 67 2.749 -7.920 2.525 1.00 2.54 H new ATOM 0 HB3 LYS A 67 4.137 -7.013 3.092 1.00 2.54 H new ATOM 0 HG2 LYS A 67 5.313 -8.475 1.740 1.00 3.42 H new ATOM 0 HG3 LYS A 67 5.215 -9.530 3.136 1.00 3.42 H new ATOM 0 HD2 LYS A 67 2.835 -9.561 1.301 1.00 4.25 H new ATOM 0 HD3 LYS A 67 4.310 -10.250 0.652 1.00 4.25 H new ATOM 0 HE2 LYS A 67 4.462 -11.887 2.402 1.00 5.03 H new ATOM 0 HE3 LYS A 67 3.366 -11.006 3.447 1.00 5.03 H new ATOM 0 HZ1 LYS A 67 2.375 -12.977 2.286 1.00 5.78 H new ATOM 0 HZ2 LYS A 67 1.529 -11.525 2.042 1.00 5.78 H new ATOM 0 HZ3 LYS A 67 2.534 -12.138 0.818 1.00 5.78 H new ATOM 762 N MET A 68 3.957 -7.778 6.767 1.00 1.31 N ATOM 763 CA MET A 68 4.673 -6.948 7.778 1.00 1.02 C ATOM 764 C MET A 68 4.361 -7.468 9.182 1.00 1.17 C ATOM 765 O MET A 68 3.241 -7.822 9.491 1.00 1.47 O ATOM 766 CB MET A 68 4.222 -5.491 7.660 1.00 1.03 C ATOM 767 CG MET A 68 5.451 -4.584 7.562 1.00 0.90 C ATOM 768 SD MET A 68 4.925 -2.887 7.223 1.00 1.43 S ATOM 769 CE MET A 68 6.543 -2.244 6.731 1.00 0.73 C ATOM 0 H MET A 68 3.324 -8.480 7.151 1.00 1.31 H new ATOM 0 HA MET A 68 5.747 -7.009 7.599 1.00 1.02 H new ATOM 0 HB2 MET A 68 3.592 -5.364 6.780 1.00 1.03 H new ATOM 0 HB3 MET A 68 3.620 -5.214 8.526 1.00 1.03 H new ATOM 0 HG2 MET A 68 6.018 -4.621 8.492 1.00 0.90 H new ATOM 0 HG3 MET A 68 6.113 -4.935 6.771 1.00 0.90 H new ATOM 0 HE1 MET A 68 6.425 -1.247 6.306 1.00 0.73 H new ATOM 0 HE2 MET A 68 7.194 -2.191 7.603 1.00 0.73 H new ATOM 0 HE3 MET A 68 6.986 -2.905 5.987 1.00 0.73 H new ATOM 779 N ALA A 69 5.348 -7.519 10.036 1.00 1.17 N ATOM 780 CA ALA A 69 5.112 -8.017 11.419 1.00 1.48 C ATOM 781 C ALA A 69 6.411 -7.925 12.223 1.00 1.42 C ATOM 782 O ALA A 69 7.337 -7.235 11.847 1.00 1.88 O ATOM 783 CB ALA A 69 4.649 -9.474 11.361 1.00 1.94 C ATOM 0 H ALA A 69 6.307 -7.237 9.834 1.00 1.17 H new ATOM 0 HA ALA A 69 4.345 -7.410 11.900 1.00 1.48 H new ATOM 0 HB1 ALA A 69 4.475 -9.841 12.373 1.00 1.94 H new ATOM 0 HB2 ALA A 69 3.724 -9.539 10.788 1.00 1.94 H new ATOM 0 HB3 ALA A 69 5.417 -10.081 10.881 1.00 1.94 H new ATOM 789 N GLU A 70 6.484 -8.616 13.327 1.00 1.37 N ATOM 790 CA GLU A 70 7.721 -8.567 14.156 1.00 1.42 C ATOM 791 C GLU A 70 8.767 -9.521 13.572 1.00 1.43 C ATOM 792 O GLU A 70 9.952 -9.361 13.784 1.00 1.51 O ATOM 793 CB GLU A 70 7.390 -8.990 15.589 1.00 1.73 C ATOM 794 CG GLU A 70 6.164 -8.217 16.079 1.00 2.45 C ATOM 795 CD GLU A 70 5.998 -8.423 17.586 1.00 2.96 C ATOM 796 OE1 GLU A 70 6.510 -9.411 18.088 1.00 3.05 O ATOM 797 OE2 GLU A 70 5.364 -7.591 18.211 1.00 3.69 O ATOM 0 H GLU A 70 5.741 -9.212 13.691 1.00 1.37 H new ATOM 0 HA GLU A 70 8.117 -7.551 14.157 1.00 1.42 H new ATOM 0 HB2 GLU A 70 7.197 -10.062 15.628 1.00 1.73 H new ATOM 0 HB3 GLU A 70 8.241 -8.796 16.242 1.00 1.73 H new ATOM 0 HG2 GLU A 70 6.277 -7.156 15.857 1.00 2.45 H new ATOM 0 HG3 GLU A 70 5.272 -8.559 15.554 1.00 2.45 H new ATOM 804 N LYS A 71 8.337 -10.512 12.840 1.00 1.52 N ATOM 805 CA LYS A 71 9.307 -11.475 12.245 1.00 1.74 C ATOM 806 C LYS A 71 10.010 -10.821 11.055 1.00 1.47 C ATOM 807 O LYS A 71 11.181 -11.040 10.816 1.00 1.57 O ATOM 808 CB LYS A 71 8.561 -12.724 11.771 1.00 2.17 C ATOM 809 CG LYS A 71 8.889 -13.895 12.699 1.00 2.47 C ATOM 810 CD LYS A 71 8.617 -15.215 11.975 1.00 2.80 C ATOM 811 CE LYS A 71 7.157 -15.622 12.185 1.00 3.16 C ATOM 812 NZ LYS A 71 6.922 -16.962 11.577 1.00 3.85 N ATOM 0 H LYS A 71 7.356 -10.697 12.628 1.00 1.52 H new ATOM 0 HA LYS A 71 10.046 -11.755 12.995 1.00 1.74 H new ATOM 0 HB2 LYS A 71 7.487 -12.539 11.766 1.00 2.17 H new ATOM 0 HB3 LYS A 71 8.848 -12.966 10.747 1.00 2.17 H new ATOM 0 HG2 LYS A 71 9.933 -13.846 13.008 1.00 2.47 H new ATOM 0 HG3 LYS A 71 8.286 -13.834 13.605 1.00 2.47 H new ATOM 0 HD2 LYS A 71 8.826 -15.108 10.911 1.00 2.80 H new ATOM 0 HD3 LYS A 71 9.280 -15.993 12.353 1.00 2.80 H new ATOM 0 HE2 LYS A 71 6.925 -15.648 13.250 1.00 3.16 H new ATOM 0 HE3 LYS A 71 6.494 -14.884 11.733 1.00 3.16 H new ATOM 0 HZ1 LYS A 71 5.930 -17.239 11.720 1.00 3.85 H new ATOM 0 HZ2 LYS A 71 7.127 -16.922 10.558 1.00 3.85 H new ATOM 0 HZ3 LYS A 71 7.545 -17.662 12.028 1.00 3.85 H new ATOM 826 N ASP A 72 9.304 -10.020 10.306 1.00 1.26 N ATOM 827 CA ASP A 72 9.931 -9.353 9.130 1.00 1.22 C ATOM 828 C ASP A 72 11.180 -8.590 9.578 1.00 1.20 C ATOM 829 O ASP A 72 12.221 -8.665 8.954 1.00 1.78 O ATOM 830 CB ASP A 72 8.932 -8.375 8.507 1.00 1.76 C ATOM 831 CG ASP A 72 8.208 -9.057 7.345 1.00 2.56 C ATOM 832 OD1 ASP A 72 8.820 -9.892 6.700 1.00 2.87 O ATOM 833 OD2 ASP A 72 7.053 -8.733 7.120 1.00 3.29 O ATOM 0 H ASP A 72 8.320 -9.798 10.457 1.00 1.26 H new ATOM 0 HA ASP A 72 10.212 -10.106 8.394 1.00 1.22 H new ATOM 0 HB2 ASP A 72 8.211 -8.048 9.257 1.00 1.76 H new ATOM 0 HB3 ASP A 72 9.451 -7.484 8.153 1.00 1.76 H new ATOM 838 N GLY A 73 11.087 -7.857 10.653 1.00 1.12 N ATOM 839 CA GLY A 73 12.271 -7.092 11.137 1.00 1.85 C ATOM 840 C GLY A 73 12.034 -5.596 10.928 1.00 1.51 C ATOM 841 O GLY A 73 12.963 -4.818 10.831 1.00 1.96 O ATOM 0 H GLY A 73 10.243 -7.755 11.217 1.00 1.12 H new ATOM 0 HA2 GLY A 73 12.444 -7.299 12.193 1.00 1.85 H new ATOM 0 HA3 GLY A 73 13.165 -7.408 10.600 1.00 1.85 H new ATOM 845 N CYS A 74 10.797 -5.185 10.856 1.00 0.95 N ATOM 846 CA CYS A 74 10.503 -3.739 10.653 1.00 0.75 C ATOM 847 C CYS A 74 10.142 -3.096 11.995 1.00 0.90 C ATOM 848 O CYS A 74 9.423 -2.118 12.052 1.00 1.32 O ATOM 849 CB CYS A 74 9.328 -3.590 9.683 1.00 0.78 C ATOM 850 SG CYS A 74 9.823 -4.172 8.042 1.00 1.20 S ATOM 0 H CYS A 74 9.978 -5.789 10.929 1.00 0.95 H new ATOM 0 HA CYS A 74 11.382 -3.244 10.240 1.00 0.75 H new ATOM 0 HB2 CYS A 74 8.472 -4.163 10.041 1.00 0.78 H new ATOM 0 HB3 CYS A 74 9.015 -2.547 9.632 1.00 0.78 H new ATOM 855 N PHE A 75 10.636 -3.637 13.075 1.00 0.88 N ATOM 856 CA PHE A 75 10.321 -3.056 14.411 1.00 1.08 C ATOM 857 C PHE A 75 11.524 -3.227 15.340 1.00 1.30 C ATOM 858 O PHE A 75 12.526 -3.809 14.973 1.00 1.67 O ATOM 859 CB PHE A 75 9.111 -3.777 15.009 1.00 1.19 C ATOM 860 CG PHE A 75 7.883 -3.467 14.188 1.00 1.42 C ATOM 861 CD1 PHE A 75 7.359 -2.169 14.175 1.00 1.85 C ATOM 862 CD2 PHE A 75 7.267 -4.478 13.441 1.00 1.99 C ATOM 863 CE1 PHE A 75 6.219 -1.882 13.414 1.00 2.17 C ATOM 864 CE2 PHE A 75 6.127 -4.191 12.681 1.00 2.33 C ATOM 865 CZ PHE A 75 5.603 -2.893 12.667 1.00 2.17 C ATOM 0 H PHE A 75 11.244 -4.456 13.090 1.00 0.88 H new ATOM 0 HA PHE A 75 10.095 -1.995 14.300 1.00 1.08 H new ATOM 0 HB2 PHE A 75 9.287 -4.852 15.027 1.00 1.19 H new ATOM 0 HB3 PHE A 75 8.960 -3.462 16.041 1.00 1.19 H new ATOM 0 HD1 PHE A 75 7.834 -1.389 14.752 1.00 1.85 H new ATOM 0 HD2 PHE A 75 7.671 -5.479 13.451 1.00 1.99 H new ATOM 0 HE1 PHE A 75 5.815 -0.880 13.403 1.00 2.17 H new ATOM 0 HE2 PHE A 75 5.652 -4.971 12.105 1.00 2.33 H new ATOM 0 HZ PHE A 75 4.724 -2.672 12.080 1.00 2.17 H new ATOM 875 N GLN A 76 11.434 -2.724 16.541 1.00 1.64 N ATOM 876 CA GLN A 76 12.573 -2.859 17.494 1.00 1.93 C ATOM 877 C GLN A 76 12.946 -4.335 17.636 1.00 1.67 C ATOM 878 O GLN A 76 14.102 -4.703 17.568 1.00 1.79 O ATOM 879 CB GLN A 76 12.166 -2.302 18.860 1.00 2.52 C ATOM 880 CG GLN A 76 13.403 -1.767 19.584 1.00 3.02 C ATOM 881 CD GLN A 76 12.976 -0.724 20.619 1.00 3.72 C ATOM 882 OE1 GLN A 76 12.029 0.007 20.407 1.00 4.15 O ATOM 883 NE2 GLN A 76 13.640 -0.623 21.739 1.00 4.29 N ATOM 0 H GLN A 76 10.621 -2.225 16.904 1.00 1.64 H new ATOM 0 HA GLN A 76 13.430 -2.302 17.116 1.00 1.93 H new ATOM 0 HB2 GLN A 76 11.432 -1.506 18.736 1.00 2.52 H new ATOM 0 HB3 GLN A 76 11.692 -3.082 19.456 1.00 2.52 H new ATOM 0 HG2 GLN A 76 13.933 -2.584 20.073 1.00 3.02 H new ATOM 0 HG3 GLN A 76 14.093 -1.322 18.867 1.00 3.02 H new ATOM 0 HE21 GLN A 76 14.435 -1.236 21.918 1.00 4.29 H new ATOM 0 HE22 GLN A 76 13.363 0.069 22.435 1.00 4.29 H new ATOM 892 N SER A 77 11.975 -5.186 17.829 1.00 1.54 N ATOM 893 CA SER A 77 12.275 -6.639 17.972 1.00 1.62 C ATOM 894 C SER A 77 13.059 -7.116 16.748 1.00 1.67 C ATOM 895 O SER A 77 12.510 -7.295 15.679 1.00 2.16 O ATOM 896 CB SER A 77 10.965 -7.422 18.075 1.00 1.93 C ATOM 897 OG SER A 77 10.807 -7.898 19.405 1.00 2.59 O ATOM 0 H SER A 77 10.988 -4.938 17.894 1.00 1.54 H new ATOM 0 HA SER A 77 12.867 -6.803 18.872 1.00 1.62 H new ATOM 0 HB2 SER A 77 10.124 -6.784 17.802 1.00 1.93 H new ATOM 0 HB3 SER A 77 10.971 -8.258 17.375 1.00 1.93 H new ATOM 0 HG SER A 77 9.968 -8.399 19.476 1.00 2.59 H new ATOM 903 N GLY A 78 14.339 -7.318 16.893 1.00 1.63 N ATOM 904 CA GLY A 78 15.154 -7.778 15.733 1.00 1.71 C ATOM 905 C GLY A 78 15.002 -6.782 14.583 1.00 1.51 C ATOM 906 O GLY A 78 14.697 -7.150 13.466 1.00 1.67 O ATOM 0 H GLY A 78 14.856 -7.185 17.762 1.00 1.63 H new ATOM 0 HA2 GLY A 78 16.202 -7.862 16.021 1.00 1.71 H new ATOM 0 HA3 GLY A 78 14.830 -8.769 15.416 1.00 1.71 H new ATOM 910 N PHE A 79 15.209 -5.521 14.848 1.00 1.25 N ATOM 911 CA PHE A 79 15.073 -4.500 13.771 1.00 1.12 C ATOM 912 C PHE A 79 16.129 -4.750 12.692 1.00 1.02 C ATOM 913 O PHE A 79 17.268 -4.350 12.822 1.00 1.16 O ATOM 914 CB PHE A 79 15.270 -3.102 14.363 1.00 1.05 C ATOM 915 CG PHE A 79 15.141 -2.067 13.271 1.00 0.99 C ATOM 916 CD1 PHE A 79 13.920 -1.900 12.605 1.00 1.41 C ATOM 917 CD2 PHE A 79 16.241 -1.274 12.924 1.00 1.10 C ATOM 918 CE1 PHE A 79 13.801 -0.940 11.593 1.00 1.47 C ATOM 919 CE2 PHE A 79 16.122 -0.314 11.912 1.00 1.11 C ATOM 920 CZ PHE A 79 14.902 -0.147 11.246 1.00 1.09 C ATOM 0 H PHE A 79 15.466 -5.154 15.764 1.00 1.25 H new ATOM 0 HA PHE A 79 14.079 -4.571 13.329 1.00 1.12 H new ATOM 0 HB2 PHE A 79 14.530 -2.918 15.142 1.00 1.05 H new ATOM 0 HB3 PHE A 79 16.251 -3.030 14.832 1.00 1.05 H new ATOM 0 HD1 PHE A 79 13.071 -2.512 12.872 1.00 1.41 H new ATOM 0 HD2 PHE A 79 17.182 -1.403 13.437 1.00 1.10 H new ATOM 0 HE1 PHE A 79 12.860 -0.811 11.080 1.00 1.47 H new ATOM 0 HE2 PHE A 79 16.971 0.298 11.645 1.00 1.11 H new ATOM 0 HZ PHE A 79 14.810 0.593 10.465 1.00 1.09 H new ATOM 930 N ASN A 80 15.758 -5.405 11.627 1.00 1.16 N ATOM 931 CA ASN A 80 16.740 -5.674 10.541 1.00 1.18 C ATOM 932 C ASN A 80 16.884 -4.424 9.671 1.00 1.14 C ATOM 933 O ASN A 80 16.507 -3.337 10.062 1.00 1.97 O ATOM 934 CB ASN A 80 16.247 -6.840 9.683 1.00 1.44 C ATOM 935 CG ASN A 80 17.239 -8.000 9.780 1.00 1.72 C ATOM 936 OD1 ASN A 80 18.426 -7.788 9.935 1.00 2.21 O ATOM 937 ND2 ASN A 80 16.801 -9.226 9.695 1.00 2.13 N ATOM 0 H ASN A 80 14.818 -5.765 11.462 1.00 1.16 H new ATOM 0 HA ASN A 80 17.706 -5.930 10.976 1.00 1.18 H new ATOM 0 HB2 ASN A 80 15.261 -7.161 10.019 1.00 1.44 H new ATOM 0 HB3 ASN A 80 16.142 -6.523 8.645 1.00 1.44 H new ATOM 0 HD21 ASN A 80 17.454 -10.007 9.759 1.00 2.13 H new ATOM 0 HD22 ASN A 80 15.805 -9.404 9.565 1.00 2.13 H new ATOM 944 N GLU A 81 17.428 -4.567 8.494 1.00 0.74 N ATOM 945 CA GLU A 81 17.594 -3.385 7.603 1.00 0.64 C ATOM 946 C GLU A 81 17.311 -3.793 6.157 1.00 0.63 C ATOM 947 O GLU A 81 16.472 -3.219 5.491 1.00 0.70 O ATOM 948 CB GLU A 81 19.028 -2.864 7.711 1.00 0.72 C ATOM 949 CG GLU A 81 19.189 -2.079 9.013 1.00 0.82 C ATOM 950 CD GLU A 81 20.586 -1.459 9.065 1.00 1.20 C ATOM 951 OE1 GLU A 81 21.179 -1.295 8.011 1.00 1.44 O ATOM 952 OE2 GLU A 81 21.040 -1.158 10.157 1.00 1.80 O ATOM 0 H GLU A 81 17.764 -5.451 8.111 1.00 0.74 H new ATOM 0 HA GLU A 81 16.897 -2.603 7.904 1.00 0.64 H new ATOM 0 HB2 GLU A 81 19.731 -3.696 7.686 1.00 0.72 H new ATOM 0 HB3 GLU A 81 19.259 -2.226 6.858 1.00 0.72 H new ATOM 0 HG2 GLU A 81 18.431 -1.299 9.076 1.00 0.82 H new ATOM 0 HG3 GLU A 81 19.040 -2.738 9.868 1.00 0.82 H new ATOM 959 N GLU A 82 18.009 -4.778 5.665 1.00 0.66 N ATOM 960 CA GLU A 82 17.787 -5.222 4.261 1.00 0.70 C ATOM 961 C GLU A 82 16.561 -6.135 4.195 1.00 0.67 C ATOM 962 O GLU A 82 15.963 -6.307 3.152 1.00 0.67 O ATOM 963 CB GLU A 82 19.018 -5.990 3.773 1.00 0.82 C ATOM 964 CG GLU A 82 18.870 -6.300 2.282 1.00 1.26 C ATOM 965 CD GLU A 82 19.171 -7.780 2.036 1.00 1.72 C ATOM 966 OE1 GLU A 82 18.616 -8.603 2.745 1.00 2.15 O ATOM 967 OE2 GLU A 82 19.951 -8.065 1.142 1.00 2.19 O ATOM 0 H GLU A 82 18.725 -5.295 6.175 1.00 0.66 H new ATOM 0 HA GLU A 82 17.621 -4.350 3.628 1.00 0.70 H new ATOM 0 HB2 GLU A 82 19.919 -5.401 3.945 1.00 0.82 H new ATOM 0 HB3 GLU A 82 19.130 -6.915 4.338 1.00 0.82 H new ATOM 0 HG2 GLU A 82 17.859 -6.063 1.949 1.00 1.26 H new ATOM 0 HG3 GLU A 82 19.551 -5.678 1.701 1.00 1.26 H new ATOM 974 N THR A 83 16.175 -6.721 5.296 1.00 0.68 N ATOM 975 CA THR A 83 14.989 -7.618 5.279 1.00 0.71 C ATOM 976 C THR A 83 13.723 -6.770 5.326 1.00 0.61 C ATOM 977 O THR A 83 12.721 -7.096 4.721 1.00 0.59 O ATOM 978 CB THR A 83 15.029 -8.547 6.494 1.00 0.81 C ATOM 979 OG1 THR A 83 16.311 -9.155 6.582 1.00 0.94 O ATOM 980 CG2 THR A 83 13.958 -9.628 6.345 1.00 0.92 C ATOM 0 H THR A 83 16.630 -6.617 6.203 1.00 0.68 H new ATOM 0 HA THR A 83 14.996 -8.219 4.369 1.00 0.71 H new ATOM 0 HB THR A 83 14.838 -7.971 7.400 1.00 0.81 H new ATOM 0 HG1 THR A 83 16.291 -9.864 7.258 1.00 0.94 H new ATOM 0 HG21 THR A 83 13.986 -10.290 7.210 1.00 0.92 H new ATOM 0 HG22 THR A 83 12.976 -9.160 6.278 1.00 0.92 H new ATOM 0 HG23 THR A 83 14.147 -10.206 5.440 1.00 0.92 H new ATOM 988 N CYS A 84 13.761 -5.677 6.036 1.00 0.59 N ATOM 989 CA CYS A 84 12.560 -4.807 6.115 1.00 0.55 C ATOM 990 C CYS A 84 12.403 -4.052 4.794 1.00 0.48 C ATOM 991 O CYS A 84 11.372 -4.107 4.150 1.00 0.51 O ATOM 992 CB CYS A 84 12.724 -3.808 7.263 1.00 0.59 C ATOM 993 SG CYS A 84 11.208 -2.833 7.436 1.00 1.16 S ATOM 0 H CYS A 84 14.571 -5.351 6.563 1.00 0.59 H new ATOM 0 HA CYS A 84 11.675 -5.417 6.297 1.00 0.55 H new ATOM 0 HB2 CYS A 84 12.937 -4.337 8.192 1.00 0.59 H new ATOM 0 HB3 CYS A 84 13.572 -3.151 7.069 1.00 0.59 H new ATOM 998 N LEU A 85 13.425 -3.354 4.381 1.00 0.48 N ATOM 999 CA LEU A 85 13.345 -2.601 3.099 1.00 0.47 C ATOM 1000 C LEU A 85 12.941 -3.560 1.976 1.00 0.47 C ATOM 1001 O LEU A 85 12.188 -3.210 1.090 1.00 0.44 O ATOM 1002 CB LEU A 85 14.713 -1.989 2.788 1.00 0.53 C ATOM 1003 CG LEU A 85 14.611 -1.095 1.552 1.00 0.59 C ATOM 1004 CD1 LEU A 85 13.814 0.164 1.897 1.00 0.64 C ATOM 1005 CD2 LEU A 85 16.017 -0.699 1.096 1.00 0.74 C ATOM 0 H LEU A 85 14.313 -3.273 4.877 1.00 0.48 H new ATOM 0 HA LEU A 85 12.603 -1.807 3.181 1.00 0.47 H new ATOM 0 HB2 LEU A 85 15.064 -1.408 3.641 1.00 0.53 H new ATOM 0 HB3 LEU A 85 15.445 -2.779 2.618 1.00 0.53 H new ATOM 0 HG LEU A 85 14.106 -1.636 0.752 1.00 0.59 H new ATOM 0 HD11 LEU A 85 13.741 0.801 1.016 1.00 0.64 H new ATOM 0 HD12 LEU A 85 12.813 -0.117 2.225 1.00 0.64 H new ATOM 0 HD13 LEU A 85 14.319 0.706 2.696 1.00 0.64 H new ATOM 0 HD21 LEU A 85 15.948 -0.061 0.215 1.00 0.74 H new ATOM 0 HD22 LEU A 85 16.520 -0.157 1.897 1.00 0.74 H new ATOM 0 HD23 LEU A 85 16.586 -1.596 0.851 1.00 0.74 H new ATOM 1017 N VAL A 86 13.427 -4.772 2.010 1.00 0.53 N ATOM 1018 CA VAL A 86 13.054 -5.744 0.946 1.00 0.56 C ATOM 1019 C VAL A 86 11.529 -5.932 0.971 1.00 0.47 C ATOM 1020 O VAL A 86 10.857 -5.772 -0.029 1.00 0.46 O ATOM 1021 CB VAL A 86 13.787 -7.080 1.198 1.00 0.70 C ATOM 1022 CG1 VAL A 86 13.097 -8.241 0.466 1.00 0.84 C ATOM 1023 CG2 VAL A 86 15.225 -6.961 0.684 1.00 0.79 C ATOM 0 H VAL A 86 14.062 -5.128 2.724 1.00 0.53 H new ATOM 0 HA VAL A 86 13.348 -5.376 -0.037 1.00 0.56 H new ATOM 0 HB VAL A 86 13.770 -7.285 2.268 1.00 0.70 H new ATOM 0 HG11 VAL A 86 13.637 -9.167 0.663 1.00 0.84 H new ATOM 0 HG12 VAL A 86 12.071 -8.336 0.821 1.00 0.84 H new ATOM 0 HG13 VAL A 86 13.093 -8.044 -0.606 1.00 0.84 H new ATOM 0 HG21 VAL A 86 15.752 -7.899 0.857 1.00 0.79 H new ATOM 0 HG22 VAL A 86 15.213 -6.743 -0.384 1.00 0.79 H new ATOM 0 HG23 VAL A 86 15.735 -6.156 1.213 1.00 0.79 H new ATOM 1033 N LYS A 87 10.980 -6.263 2.107 1.00 0.48 N ATOM 1034 CA LYS A 87 9.504 -6.455 2.191 1.00 0.48 C ATOM 1035 C LYS A 87 8.793 -5.201 1.670 1.00 0.39 C ATOM 1036 O LYS A 87 7.649 -5.250 1.265 1.00 0.45 O ATOM 1037 CB LYS A 87 9.103 -6.701 3.647 1.00 0.57 C ATOM 1038 CG LYS A 87 9.358 -8.166 4.008 1.00 1.08 C ATOM 1039 CD LYS A 87 8.498 -9.069 3.119 1.00 0.92 C ATOM 1040 CE LYS A 87 8.202 -10.379 3.853 1.00 1.16 C ATOM 1041 NZ LYS A 87 7.887 -11.445 2.859 1.00 1.75 N ATOM 0 H LYS A 87 11.488 -6.409 2.979 1.00 0.48 H new ATOM 0 HA LYS A 87 9.216 -7.314 1.585 1.00 0.48 H new ATOM 0 HB2 LYS A 87 9.674 -6.048 4.307 1.00 0.57 H new ATOM 0 HB3 LYS A 87 8.050 -6.458 3.791 1.00 0.57 H new ATOM 0 HG2 LYS A 87 10.413 -8.406 3.875 1.00 1.08 H new ATOM 0 HG3 LYS A 87 9.121 -8.339 5.058 1.00 1.08 H new ATOM 0 HD2 LYS A 87 7.566 -8.564 2.864 1.00 0.92 H new ATOM 0 HD3 LYS A 87 9.016 -9.274 2.182 1.00 0.92 H new ATOM 0 HE2 LYS A 87 9.061 -10.672 4.457 1.00 1.16 H new ATOM 0 HE3 LYS A 87 7.363 -10.244 4.536 1.00 1.16 H new ATOM 0 HZ1 LYS A 87 7.686 -12.336 3.357 1.00 1.75 H new ATOM 0 HZ2 LYS A 87 7.055 -11.165 2.301 1.00 1.75 H new ATOM 0 HZ3 LYS A 87 8.700 -11.579 2.225 1.00 1.75 H new ATOM 1055 N ILE A 88 9.460 -4.078 1.682 1.00 0.38 N ATOM 1056 CA ILE A 88 8.819 -2.821 1.192 1.00 0.46 C ATOM 1057 C ILE A 88 8.788 -2.810 -0.342 1.00 0.38 C ATOM 1058 O ILE A 88 7.838 -2.353 -0.945 1.00 0.38 O ATOM 1059 CB ILE A 88 9.622 -1.615 1.691 1.00 0.65 C ATOM 1060 CG1 ILE A 88 9.598 -1.581 3.224 1.00 0.90 C ATOM 1061 CG2 ILE A 88 9.017 -0.321 1.139 1.00 0.97 C ATOM 1062 CD1 ILE A 88 8.166 -1.355 3.716 1.00 0.56 C ATOM 0 H ILE A 88 10.421 -3.976 2.010 1.00 0.38 H new ATOM 0 HA ILE A 88 7.798 -2.769 1.571 1.00 0.46 H new ATOM 0 HB ILE A 88 10.652 -1.703 1.345 1.00 0.65 H new ATOM 0 HG12 ILE A 88 9.986 -2.518 3.624 1.00 0.90 H new ATOM 0 HG13 ILE A 88 10.247 -0.786 3.589 1.00 0.90 H new ATOM 0 HG21 ILE A 88 9.593 0.532 1.498 1.00 0.97 H new ATOM 0 HG22 ILE A 88 9.042 -0.343 0.050 1.00 0.97 H new ATOM 0 HG23 ILE A 88 7.985 -0.229 1.476 1.00 0.97 H new ATOM 0 HD11 ILE A 88 8.155 -1.332 4.806 1.00 0.56 H new ATOM 0 HD12 ILE A 88 7.794 -0.406 3.329 1.00 0.56 H new ATOM 0 HD13 ILE A 88 7.528 -2.166 3.364 1.00 0.56 H new ATOM 1074 N ILE A 89 9.820 -3.295 -0.978 1.00 0.39 N ATOM 1075 CA ILE A 89 9.845 -3.295 -2.472 1.00 0.43 C ATOM 1076 C ILE A 89 8.774 -4.250 -3.011 1.00 0.36 C ATOM 1077 O ILE A 89 7.948 -3.877 -3.823 1.00 0.37 O ATOM 1078 CB ILE A 89 11.228 -3.742 -2.954 1.00 0.56 C ATOM 1079 CG1 ILE A 89 12.292 -2.818 -2.357 1.00 0.67 C ATOM 1080 CG2 ILE A 89 11.299 -3.675 -4.484 1.00 0.61 C ATOM 1081 CD1 ILE A 89 13.682 -3.296 -2.780 1.00 1.00 C ATOM 0 H ILE A 89 10.646 -3.691 -0.530 1.00 0.39 H new ATOM 0 HA ILE A 89 9.639 -2.289 -2.838 1.00 0.43 H new ATOM 0 HB ILE A 89 11.405 -4.769 -2.634 1.00 0.56 H new ATOM 0 HG12 ILE A 89 12.130 -1.794 -2.695 1.00 0.67 H new ATOM 0 HG13 ILE A 89 12.214 -2.811 -1.270 1.00 0.67 H new ATOM 0 HG21 ILE A 89 12.286 -3.995 -4.817 1.00 0.61 H new ATOM 0 HG22 ILE A 89 10.541 -4.331 -4.912 1.00 0.61 H new ATOM 0 HG23 ILE A 89 11.120 -2.651 -4.812 1.00 0.61 H new ATOM 0 HD11 ILE A 89 14.439 -2.637 -2.354 1.00 1.00 H new ATOM 0 HD12 ILE A 89 13.842 -4.312 -2.421 1.00 1.00 H new ATOM 0 HD13 ILE A 89 13.757 -3.280 -3.867 1.00 1.00 H new ATOM 1093 N THR A 90 8.768 -5.476 -2.561 1.00 0.43 N ATOM 1094 CA THR A 90 7.735 -6.432 -3.053 1.00 0.54 C ATOM 1095 C THR A 90 6.395 -6.077 -2.412 1.00 0.48 C ATOM 1096 O THR A 90 5.342 -6.374 -2.942 1.00 0.60 O ATOM 1097 CB THR A 90 8.128 -7.868 -2.692 1.00 0.75 C ATOM 1098 OG1 THR A 90 7.025 -8.732 -2.930 1.00 1.82 O ATOM 1099 CG2 THR A 90 8.527 -7.943 -1.222 1.00 1.03 C ATOM 0 H THR A 90 9.427 -5.854 -1.880 1.00 0.43 H new ATOM 0 HA THR A 90 7.656 -6.362 -4.138 1.00 0.54 H new ATOM 0 HB THR A 90 8.974 -8.175 -3.307 1.00 0.75 H new ATOM 0 HG1 THR A 90 7.275 -9.652 -2.701 1.00 1.82 H new ATOM 0 HG21 THR A 90 8.805 -8.967 -0.972 1.00 1.03 H new ATOM 0 HG22 THR A 90 9.375 -7.282 -1.041 1.00 1.03 H new ATOM 0 HG23 THR A 90 7.687 -7.634 -0.601 1.00 1.03 H new ATOM 1107 N GLY A 91 6.426 -5.420 -1.284 1.00 0.45 N ATOM 1108 CA GLY A 91 5.157 -5.020 -0.621 1.00 0.50 C ATOM 1109 C GLY A 91 4.534 -3.868 -1.412 1.00 0.44 C ATOM 1110 O GLY A 91 3.337 -3.655 -1.385 1.00 0.52 O ATOM 0 H GLY A 91 7.277 -5.144 -0.795 1.00 0.45 H new ATOM 0 HA2 GLY A 91 4.470 -5.865 -0.579 1.00 0.50 H new ATOM 0 HA3 GLY A 91 5.348 -4.713 0.407 1.00 0.50 H new ATOM 1114 N LEU A 92 5.343 -3.127 -2.124 1.00 0.36 N ATOM 1115 CA LEU A 92 4.809 -1.992 -2.924 1.00 0.36 C ATOM 1116 C LEU A 92 4.326 -2.514 -4.279 1.00 0.35 C ATOM 1117 O LEU A 92 3.428 -1.959 -4.876 1.00 0.35 O ATOM 1118 CB LEU A 92 5.912 -0.952 -3.140 1.00 0.39 C ATOM 1119 CG LEU A 92 5.979 -0.018 -1.930 1.00 0.46 C ATOM 1120 CD1 LEU A 92 7.321 0.717 -1.923 1.00 0.55 C ATOM 1121 CD2 LEU A 92 4.842 1.003 -2.012 1.00 0.73 C ATOM 0 H LEU A 92 6.352 -3.262 -2.184 1.00 0.36 H new ATOM 0 HA LEU A 92 3.978 -1.529 -2.392 1.00 0.36 H new ATOM 0 HB2 LEU A 92 6.872 -1.449 -3.282 1.00 0.39 H new ATOM 0 HB3 LEU A 92 5.713 -0.378 -4.045 1.00 0.39 H new ATOM 0 HG LEU A 92 5.881 -0.603 -1.015 1.00 0.46 H new ATOM 0 HD11 LEU A 92 7.367 1.382 -1.061 1.00 0.55 H new ATOM 0 HD12 LEU A 92 8.133 -0.008 -1.866 1.00 0.55 H new ATOM 0 HD13 LEU A 92 7.420 1.302 -2.838 1.00 0.55 H new ATOM 0 HD21 LEU A 92 4.888 1.669 -1.151 1.00 0.73 H new ATOM 0 HD22 LEU A 92 4.942 1.586 -2.927 1.00 0.73 H new ATOM 0 HD23 LEU A 92 3.885 0.482 -2.016 1.00 0.73 H new ATOM 1133 N LEU A 93 4.909 -3.580 -4.771 1.00 0.38 N ATOM 1134 CA LEU A 93 4.458 -4.134 -6.084 1.00 0.42 C ATOM 1135 C LEU A 93 3.038 -4.685 -5.915 1.00 0.38 C ATOM 1136 O LEU A 93 2.127 -4.360 -6.666 1.00 0.36 O ATOM 1137 CB LEU A 93 5.403 -5.256 -6.528 1.00 0.51 C ATOM 1138 CG LEU A 93 6.798 -4.680 -6.787 1.00 0.65 C ATOM 1139 CD1 LEU A 93 7.861 -5.733 -6.459 1.00 0.75 C ATOM 1140 CD2 LEU A 93 6.914 -4.281 -8.259 1.00 0.78 C ATOM 0 H LEU A 93 5.672 -4.087 -4.323 1.00 0.38 H new ATOM 0 HA LEU A 93 4.467 -3.351 -6.843 1.00 0.42 H new ATOM 0 HB2 LEU A 93 5.454 -6.028 -5.760 1.00 0.51 H new ATOM 0 HB3 LEU A 93 5.021 -5.731 -7.432 1.00 0.51 H new ATOM 0 HG LEU A 93 6.952 -3.805 -6.156 1.00 0.65 H new ATOM 0 HD11 LEU A 93 8.852 -5.319 -6.645 1.00 0.75 H new ATOM 0 HD12 LEU A 93 7.778 -6.020 -5.411 1.00 0.75 H new ATOM 0 HD13 LEU A 93 7.710 -6.610 -7.088 1.00 0.75 H new ATOM 0 HD21 LEU A 93 7.906 -3.870 -8.448 1.00 0.78 H new ATOM 0 HD22 LEU A 93 6.759 -5.158 -8.887 1.00 0.78 H new ATOM 0 HD23 LEU A 93 6.160 -3.530 -8.493 1.00 0.78 H new ATOM 1152 N GLU A 94 2.831 -5.494 -4.911 1.00 0.39 N ATOM 1153 CA GLU A 94 1.468 -6.031 -4.669 1.00 0.39 C ATOM 1154 C GLU A 94 0.561 -4.840 -4.377 1.00 0.35 C ATOM 1155 O GLU A 94 -0.533 -4.725 -4.890 1.00 0.38 O ATOM 1156 CB GLU A 94 1.492 -6.979 -3.467 1.00 0.42 C ATOM 1157 CG GLU A 94 1.603 -8.423 -3.958 1.00 1.03 C ATOM 1158 CD GLU A 94 0.553 -9.284 -3.254 1.00 1.54 C ATOM 1159 OE1 GLU A 94 0.243 -8.990 -2.112 1.00 2.07 O ATOM 1160 OE2 GLU A 94 0.076 -10.224 -3.870 1.00 2.07 O ATOM 0 H GLU A 94 3.546 -5.803 -4.252 1.00 0.39 H new ATOM 0 HA GLU A 94 1.108 -6.588 -5.534 1.00 0.39 H new ATOM 0 HB2 GLU A 94 2.334 -6.739 -2.818 1.00 0.42 H new ATOM 0 HB3 GLU A 94 0.586 -6.854 -2.874 1.00 0.42 H new ATOM 0 HG2 GLU A 94 1.457 -8.463 -5.037 1.00 1.03 H new ATOM 0 HG3 GLU A 94 2.601 -8.811 -3.756 1.00 1.03 H new ATOM 1167 N PHE A 95 1.039 -3.927 -3.577 1.00 0.33 N ATOM 1168 CA PHE A 95 0.246 -2.710 -3.265 1.00 0.32 C ATOM 1169 C PHE A 95 -0.110 -2.013 -4.575 1.00 0.31 C ATOM 1170 O PHE A 95 -1.110 -1.338 -4.680 1.00 0.33 O ATOM 1171 CB PHE A 95 1.106 -1.762 -2.428 1.00 0.35 C ATOM 1172 CG PHE A 95 0.861 -1.975 -0.953 1.00 0.40 C ATOM 1173 CD1 PHE A 95 0.546 -3.247 -0.459 1.00 0.86 C ATOM 1174 CD2 PHE A 95 0.959 -0.890 -0.079 1.00 0.87 C ATOM 1175 CE1 PHE A 95 0.330 -3.430 0.909 1.00 0.89 C ATOM 1176 CE2 PHE A 95 0.743 -1.071 1.289 1.00 0.92 C ATOM 1177 CZ PHE A 95 0.427 -2.342 1.786 1.00 0.56 C ATOM 0 H PHE A 95 1.952 -3.974 -3.124 1.00 0.33 H new ATOM 0 HA PHE A 95 -0.658 -2.980 -2.719 1.00 0.32 H new ATOM 0 HB2 PHE A 95 2.160 -1.926 -2.653 1.00 0.35 H new ATOM 0 HB3 PHE A 95 0.880 -0.729 -2.693 1.00 0.35 H new ATOM 0 HD1 PHE A 95 0.470 -4.086 -1.135 1.00 0.86 H new ATOM 0 HD2 PHE A 95 1.202 0.090 -0.461 1.00 0.87 H new ATOM 0 HE1 PHE A 95 0.088 -4.411 1.291 1.00 0.89 H new ATOM 0 HE2 PHE A 95 0.820 -0.231 1.964 1.00 0.92 H new ATOM 0 HZ PHE A 95 0.258 -2.483 2.843 1.00 0.56 H new ATOM 1187 N GLU A 96 0.720 -2.171 -5.568 1.00 0.30 N ATOM 1188 CA GLU A 96 0.466 -1.522 -6.881 1.00 0.32 C ATOM 1189 C GLU A 96 -0.801 -2.100 -7.503 1.00 0.30 C ATOM 1190 O GLU A 96 -1.633 -1.372 -8.003 1.00 0.31 O ATOM 1191 CB GLU A 96 1.653 -1.770 -7.810 1.00 0.37 C ATOM 1192 CG GLU A 96 1.811 -0.584 -8.764 1.00 0.97 C ATOM 1193 CD GLU A 96 0.627 -0.547 -9.732 1.00 1.72 C ATOM 1194 OE1 GLU A 96 0.096 -1.604 -10.028 1.00 2.03 O ATOM 1195 OE2 GLU A 96 0.273 0.539 -10.161 1.00 2.56 O ATOM 0 H GLU A 96 1.573 -2.729 -5.523 1.00 0.30 H new ATOM 0 HA GLU A 96 0.337 -0.449 -6.735 1.00 0.32 H new ATOM 0 HB2 GLU A 96 2.564 -1.904 -7.226 1.00 0.37 H new ATOM 0 HB3 GLU A 96 1.499 -2.688 -8.377 1.00 0.37 H new ATOM 0 HG2 GLU A 96 1.862 0.347 -8.199 1.00 0.97 H new ATOM 0 HG3 GLU A 96 2.745 -0.672 -9.319 1.00 0.97 H new ATOM 1202 N VAL A 97 -0.967 -3.399 -7.484 1.00 0.31 N ATOM 1203 CA VAL A 97 -2.212 -3.971 -8.085 1.00 0.32 C ATOM 1204 C VAL A 97 -3.423 -3.442 -7.298 1.00 0.29 C ATOM 1205 O VAL A 97 -4.467 -3.147 -7.857 1.00 0.30 O ATOM 1206 CB VAL A 97 -2.165 -5.516 -8.073 1.00 0.37 C ATOM 1207 CG1 VAL A 97 -2.462 -6.077 -6.677 1.00 0.55 C ATOM 1208 CG2 VAL A 97 -3.207 -6.053 -9.056 1.00 0.43 C ATOM 0 H VAL A 97 -0.313 -4.074 -7.089 1.00 0.31 H new ATOM 0 HA VAL A 97 -2.297 -3.662 -9.127 1.00 0.32 H new ATOM 0 HB VAL A 97 -1.162 -5.829 -8.361 1.00 0.37 H new ATOM 0 HG11 VAL A 97 -2.420 -7.166 -6.706 1.00 0.55 H new ATOM 0 HG12 VAL A 97 -1.721 -5.704 -5.970 1.00 0.55 H new ATOM 0 HG13 VAL A 97 -3.456 -5.760 -6.361 1.00 0.55 H new ATOM 0 HG21 VAL A 97 -3.181 -7.143 -9.054 1.00 0.43 H new ATOM 0 HG22 VAL A 97 -4.199 -5.713 -8.757 1.00 0.43 H new ATOM 0 HG23 VAL A 97 -2.985 -5.686 -10.058 1.00 0.43 H new ATOM 1218 N TYR A 98 -3.282 -3.280 -6.008 1.00 0.30 N ATOM 1219 CA TYR A 98 -4.410 -2.736 -5.203 1.00 0.28 C ATOM 1220 C TYR A 98 -4.569 -1.255 -5.548 1.00 0.26 C ATOM 1221 O TYR A 98 -5.639 -0.686 -5.440 1.00 0.25 O ATOM 1222 CB TYR A 98 -4.105 -2.899 -3.715 1.00 0.30 C ATOM 1223 CG TYR A 98 -4.136 -4.366 -3.372 1.00 0.35 C ATOM 1224 CD1 TYR A 98 -5.363 -5.029 -3.247 1.00 0.57 C ATOM 1225 CD2 TYR A 98 -2.940 -5.068 -3.190 1.00 0.46 C ATOM 1226 CE1 TYR A 98 -5.393 -6.393 -2.941 1.00 0.73 C ATOM 1227 CE2 TYR A 98 -2.969 -6.432 -2.882 1.00 0.60 C ATOM 1228 CZ TYR A 98 -4.196 -7.095 -2.758 1.00 0.69 C ATOM 1229 OH TYR A 98 -4.225 -8.441 -2.456 1.00 0.90 O ATOM 0 H TYR A 98 -2.437 -3.501 -5.481 1.00 0.30 H new ATOM 0 HA TYR A 98 -5.332 -3.272 -5.427 1.00 0.28 H new ATOM 0 HB2 TYR A 98 -3.127 -2.477 -3.481 1.00 0.30 H new ATOM 0 HB3 TYR A 98 -4.837 -2.356 -3.118 1.00 0.30 H new ATOM 0 HD1 TYR A 98 -6.286 -4.487 -3.387 1.00 0.57 H new ATOM 0 HD2 TYR A 98 -1.994 -4.557 -3.287 1.00 0.46 H new ATOM 0 HE1 TYR A 98 -6.339 -6.905 -2.846 1.00 0.73 H new ATOM 0 HE2 TYR A 98 -2.045 -6.974 -2.740 1.00 0.60 H new ATOM 0 HH TYR A 98 -3.308 -8.775 -2.363 1.00 0.90 H new ATOM 1239 N LEU A 99 -3.510 -0.639 -6.006 1.00 0.28 N ATOM 1240 CA LEU A 99 -3.590 0.786 -6.406 1.00 0.30 C ATOM 1241 C LEU A 99 -4.369 0.832 -7.710 1.00 0.30 C ATOM 1242 O LEU A 99 -5.084 1.773 -7.994 1.00 0.31 O ATOM 1243 CB LEU A 99 -2.184 1.348 -6.607 1.00 0.37 C ATOM 1244 CG LEU A 99 -1.519 1.525 -5.243 1.00 0.41 C ATOM 1245 CD1 LEU A 99 0.000 1.548 -5.408 1.00 0.55 C ATOM 1246 CD2 LEU A 99 -1.982 2.841 -4.624 1.00 0.45 C ATOM 0 H LEU A 99 -2.592 -1.069 -6.118 1.00 0.28 H new ATOM 0 HA LEU A 99 -4.082 1.385 -5.640 1.00 0.30 H new ATOM 0 HB2 LEU A 99 -1.595 0.674 -7.229 1.00 0.37 H new ATOM 0 HB3 LEU A 99 -2.232 2.303 -7.129 1.00 0.37 H new ATOM 0 HG LEU A 99 -1.797 0.695 -4.594 1.00 0.41 H new ATOM 0 HD11 LEU A 99 0.470 1.674 -4.433 1.00 0.55 H new ATOM 0 HD12 LEU A 99 0.332 0.609 -5.852 1.00 0.55 H new ATOM 0 HD13 LEU A 99 0.283 2.377 -6.057 1.00 0.55 H new ATOM 0 HD21 LEU A 99 -1.510 2.971 -3.650 1.00 0.45 H new ATOM 0 HD22 LEU A 99 -1.702 3.668 -5.276 1.00 0.45 H new ATOM 0 HD23 LEU A 99 -3.065 2.825 -4.503 1.00 0.45 H new ATOM 1258 N GLU A 100 -4.282 -0.223 -8.479 1.00 0.31 N ATOM 1259 CA GLU A 100 -5.063 -0.298 -9.730 1.00 0.35 C ATOM 1260 C GLU A 100 -6.522 -0.263 -9.304 1.00 0.33 C ATOM 1261 O GLU A 100 -7.372 0.319 -9.948 1.00 0.37 O ATOM 1262 CB GLU A 100 -4.754 -1.619 -10.437 1.00 0.38 C ATOM 1263 CG GLU A 100 -4.794 -1.421 -11.952 1.00 0.55 C ATOM 1264 CD GLU A 100 -6.169 -0.895 -12.366 1.00 1.27 C ATOM 1265 OE1 GLU A 100 -7.156 -1.446 -11.906 1.00 2.12 O ATOM 1266 OE2 GLU A 100 -6.213 0.051 -13.136 1.00 1.58 O ATOM 0 H GLU A 100 -3.697 -1.036 -8.285 1.00 0.31 H new ATOM 0 HA GLU A 100 -4.827 0.516 -10.416 1.00 0.35 H new ATOM 0 HB2 GLU A 100 -3.772 -1.982 -10.135 1.00 0.38 H new ATOM 0 HB3 GLU A 100 -5.479 -2.378 -10.142 1.00 0.38 H new ATOM 0 HG2 GLU A 100 -4.018 -0.719 -12.257 1.00 0.55 H new ATOM 0 HG3 GLU A 100 -4.587 -2.364 -12.458 1.00 0.55 H new ATOM 1273 N TYR A 101 -6.794 -0.871 -8.179 1.00 0.30 N ATOM 1274 CA TYR A 101 -8.170 -0.873 -7.635 1.00 0.31 C ATOM 1275 C TYR A 101 -8.618 0.564 -7.420 1.00 0.32 C ATOM 1276 O TYR A 101 -9.691 0.964 -7.824 1.00 0.38 O ATOM 1277 CB TYR A 101 -8.177 -1.609 -6.293 1.00 0.30 C ATOM 1278 CG TYR A 101 -9.354 -2.544 -6.246 1.00 0.29 C ATOM 1279 CD1 TYR A 101 -9.587 -3.413 -7.313 1.00 0.41 C ATOM 1280 CD2 TYR A 101 -10.212 -2.539 -5.142 1.00 0.33 C ATOM 1281 CE1 TYR A 101 -10.681 -4.282 -7.284 1.00 0.47 C ATOM 1282 CE2 TYR A 101 -11.307 -3.409 -5.110 1.00 0.37 C ATOM 1283 CZ TYR A 101 -11.543 -4.280 -6.181 1.00 0.40 C ATOM 1284 OH TYR A 101 -12.627 -5.132 -6.150 1.00 0.49 O ATOM 0 H TYR A 101 -6.108 -1.370 -7.613 1.00 0.30 H new ATOM 0 HA TYR A 101 -8.845 -1.371 -8.331 1.00 0.31 H new ATOM 0 HB2 TYR A 101 -7.249 -2.167 -6.166 1.00 0.30 H new ATOM 0 HB3 TYR A 101 -8.233 -0.893 -5.473 1.00 0.30 H new ATOM 0 HD1 TYR A 101 -8.920 -3.414 -8.163 1.00 0.41 H new ATOM 0 HD2 TYR A 101 -10.030 -1.866 -4.317 1.00 0.33 H new ATOM 0 HE1 TYR A 101 -10.861 -4.953 -8.111 1.00 0.47 H new ATOM 0 HE2 TYR A 101 -11.971 -3.409 -4.258 1.00 0.37 H new ATOM 0 HH TYR A 101 -12.743 -5.481 -5.242 1.00 0.49 H new ATOM 1294 N LEU A 102 -7.804 1.335 -6.768 1.00 0.29 N ATOM 1295 CA LEU A 102 -8.167 2.750 -6.494 1.00 0.32 C ATOM 1296 C LEU A 102 -7.653 3.656 -7.614 1.00 0.38 C ATOM 1297 O LEU A 102 -7.711 4.865 -7.515 1.00 0.48 O ATOM 1298 CB LEU A 102 -7.543 3.173 -5.166 1.00 0.31 C ATOM 1299 CG LEU A 102 -7.761 2.072 -4.123 1.00 0.27 C ATOM 1300 CD1 LEU A 102 -6.467 1.838 -3.351 1.00 0.27 C ATOM 1301 CD2 LEU A 102 -8.867 2.499 -3.165 1.00 0.30 C ATOM 0 H LEU A 102 -6.894 1.046 -6.409 1.00 0.29 H new ATOM 0 HA LEU A 102 -9.252 2.841 -6.442 1.00 0.32 H new ATOM 0 HB2 LEU A 102 -6.477 3.359 -5.296 1.00 0.31 H new ATOM 0 HB3 LEU A 102 -7.990 4.106 -4.823 1.00 0.31 H new ATOM 0 HG LEU A 102 -8.051 1.146 -4.620 1.00 0.27 H new ATOM 0 HD11 LEU A 102 -6.622 1.055 -2.609 1.00 0.27 H new ATOM 0 HD12 LEU A 102 -5.681 1.533 -4.042 1.00 0.27 H new ATOM 0 HD13 LEU A 102 -6.171 2.759 -2.849 1.00 0.27 H new ATOM 0 HD21 LEU A 102 -9.025 1.718 -2.421 1.00 0.30 H new ATOM 0 HD22 LEU A 102 -8.578 3.424 -2.665 1.00 0.30 H new ATOM 0 HD23 LEU A 102 -9.789 2.661 -3.723 1.00 0.30 H new ATOM 1313 N GLN A 103 -7.148 3.093 -8.677 1.00 0.36 N ATOM 1314 CA GLN A 103 -6.634 3.941 -9.785 1.00 0.44 C ATOM 1315 C GLN A 103 -7.800 4.376 -10.678 1.00 0.49 C ATOM 1316 O GLN A 103 -7.766 5.424 -11.291 1.00 0.77 O ATOM 1317 CB GLN A 103 -5.629 3.142 -10.617 1.00 0.52 C ATOM 1318 CG GLN A 103 -5.030 4.043 -11.699 1.00 0.59 C ATOM 1319 CD GLN A 103 -4.469 3.179 -12.830 1.00 0.78 C ATOM 1320 OE1 GLN A 103 -4.338 1.980 -12.687 1.00 1.43 O ATOM 1321 NE2 GLN A 103 -4.129 3.742 -13.957 1.00 1.41 N ATOM 0 H GLN A 103 -7.070 2.087 -8.825 1.00 0.36 H new ATOM 0 HA GLN A 103 -6.144 4.821 -9.369 1.00 0.44 H new ATOM 0 HB2 GLN A 103 -4.839 2.752 -9.976 1.00 0.52 H new ATOM 0 HB3 GLN A 103 -6.121 2.284 -11.075 1.00 0.52 H new ATOM 0 HG2 GLN A 103 -5.792 4.719 -12.087 1.00 0.59 H new ATOM 0 HG3 GLN A 103 -4.240 4.663 -11.275 1.00 0.59 H new ATOM 0 HE21 GLN A 103 -4.239 4.749 -14.078 1.00 1.41 H new ATOM 0 HE22 GLN A 103 -3.753 3.175 -14.717 1.00 1.41 H new ATOM 1330 N ASN A 104 -8.828 3.573 -10.764 1.00 0.58 N ATOM 1331 CA ASN A 104 -9.989 3.940 -11.628 1.00 0.61 C ATOM 1332 C ASN A 104 -11.287 3.941 -10.810 1.00 0.59 C ATOM 1333 O ASN A 104 -12.239 4.615 -11.150 1.00 0.65 O ATOM 1334 CB ASN A 104 -10.112 2.925 -12.767 1.00 0.70 C ATOM 1335 CG ASN A 104 -10.578 3.635 -14.039 1.00 1.11 C ATOM 1336 OD1 ASN A 104 -10.824 4.825 -14.030 1.00 1.65 O ATOM 1337 ND2 ASN A 104 -10.712 2.950 -15.142 1.00 1.76 N ATOM 0 H ASN A 104 -8.914 2.682 -10.275 1.00 0.58 H new ATOM 0 HA ASN A 104 -9.825 4.939 -12.032 1.00 0.61 H new ATOM 0 HB2 ASN A 104 -9.152 2.440 -12.940 1.00 0.70 H new ATOM 0 HB3 ASN A 104 -10.820 2.142 -12.495 1.00 0.70 H new ATOM 0 HD21 ASN A 104 -11.023 3.414 -15.996 1.00 1.76 H new ATOM 0 HD22 ASN A 104 -10.506 1.951 -15.150 1.00 1.76 H new ATOM 1344 N ARG A 105 -11.342 3.193 -9.741 1.00 0.54 N ATOM 1345 CA ARG A 105 -12.588 3.160 -8.923 1.00 0.58 C ATOM 1346 C ARG A 105 -12.951 4.579 -8.488 1.00 0.54 C ATOM 1347 O ARG A 105 -14.109 4.919 -8.345 1.00 0.60 O ATOM 1348 CB ARG A 105 -12.367 2.292 -7.682 1.00 0.59 C ATOM 1349 CG ARG A 105 -12.751 0.844 -7.994 1.00 1.15 C ATOM 1350 CD ARG A 105 -13.873 0.399 -7.054 1.00 1.56 C ATOM 1351 NE ARG A 105 -15.192 0.722 -7.666 1.00 2.30 N ATOM 1352 CZ ARG A 105 -16.295 0.389 -7.052 1.00 2.98 C ATOM 1353 NH1 ARG A 105 -16.644 1.007 -5.957 1.00 3.44 N ATOM 1354 NH2 ARG A 105 -17.049 -0.562 -7.534 1.00 3.68 N ATOM 0 H ARG A 105 -10.581 2.606 -9.400 1.00 0.54 H new ATOM 0 HA ARG A 105 -13.398 2.741 -9.520 1.00 0.58 H new ATOM 0 HB2 ARG A 105 -11.324 2.343 -7.371 1.00 0.59 H new ATOM 0 HB3 ARG A 105 -12.966 2.667 -6.852 1.00 0.59 H new ATOM 0 HG2 ARG A 105 -13.076 0.758 -9.031 1.00 1.15 H new ATOM 0 HG3 ARG A 105 -11.884 0.193 -7.876 1.00 1.15 H new ATOM 0 HD2 ARG A 105 -13.800 -0.672 -6.865 1.00 1.56 H new ATOM 0 HD3 ARG A 105 -13.775 0.900 -6.091 1.00 1.56 H new ATOM 0 HE ARG A 105 -15.233 1.203 -8.564 1.00 2.30 H new ATOM 0 HH11 ARG A 105 -16.055 1.750 -5.581 1.00 3.44 H new ATOM 0 HH12 ARG A 105 -17.506 0.747 -5.477 1.00 3.44 H new ATOM 0 HH21 ARG A 105 -16.776 -1.045 -8.390 1.00 3.68 H new ATOM 0 HH22 ARG A 105 -17.911 -0.822 -7.054 1.00 3.68 H new ATOM 1368 N PHE A 106 -11.970 5.410 -8.273 1.00 0.51 N ATOM 1369 CA PHE A 106 -12.259 6.806 -7.844 1.00 0.52 C ATOM 1370 C PHE A 106 -12.647 7.646 -9.063 1.00 0.55 C ATOM 1371 O PHE A 106 -11.806 8.203 -9.739 1.00 0.65 O ATOM 1372 CB PHE A 106 -11.016 7.404 -7.181 1.00 0.51 C ATOM 1373 CG PHE A 106 -11.091 7.191 -5.687 1.00 0.55 C ATOM 1374 CD1 PHE A 106 -12.070 7.850 -4.935 1.00 1.40 C ATOM 1375 CD2 PHE A 106 -10.182 6.334 -5.055 1.00 0.92 C ATOM 1376 CE1 PHE A 106 -12.140 7.653 -3.550 1.00 1.57 C ATOM 1377 CE2 PHE A 106 -10.252 6.137 -3.670 1.00 0.89 C ATOM 1378 CZ PHE A 106 -11.231 6.797 -2.918 1.00 0.87 C ATOM 0 H PHE A 106 -10.981 5.183 -8.376 1.00 0.51 H new ATOM 0 HA PHE A 106 -13.083 6.804 -7.131 1.00 0.52 H new ATOM 0 HB2 PHE A 106 -10.116 6.936 -7.581 1.00 0.51 H new ATOM 0 HB3 PHE A 106 -10.948 8.469 -7.404 1.00 0.51 H new ATOM 0 HD1 PHE A 106 -12.772 8.511 -5.423 1.00 1.40 H new ATOM 0 HD2 PHE A 106 -9.427 5.825 -5.635 1.00 0.92 H new ATOM 0 HE1 PHE A 106 -12.896 8.162 -2.970 1.00 1.57 H new ATOM 0 HE2 PHE A 106 -9.551 5.476 -3.182 1.00 0.89 H new ATOM 0 HZ PHE A 106 -11.285 6.646 -1.850 1.00 0.87 H new ATOM 1388 N GLU A 107 -13.917 7.738 -9.350 1.00 0.66 N ATOM 1389 CA GLU A 107 -14.363 8.539 -10.526 1.00 0.73 C ATOM 1390 C GLU A 107 -14.673 9.972 -10.086 1.00 0.75 C ATOM 1391 O GLU A 107 -14.672 10.889 -10.882 1.00 0.80 O ATOM 1392 CB GLU A 107 -15.622 7.910 -11.121 1.00 0.84 C ATOM 1393 CG GLU A 107 -16.690 7.776 -10.034 1.00 1.47 C ATOM 1394 CD GLU A 107 -18.052 7.527 -10.684 1.00 1.88 C ATOM 1395 OE1 GLU A 107 -18.103 6.760 -11.632 1.00 2.14 O ATOM 1396 OE2 GLU A 107 -19.022 8.106 -10.222 1.00 2.51 O ATOM 0 H GLU A 107 -14.666 7.292 -8.820 1.00 0.66 H new ATOM 0 HA GLU A 107 -13.570 8.553 -11.274 1.00 0.73 H new ATOM 0 HB2 GLU A 107 -15.996 8.525 -11.939 1.00 0.84 H new ATOM 0 HB3 GLU A 107 -15.389 6.931 -11.539 1.00 0.84 H new ATOM 0 HG2 GLU A 107 -16.440 6.954 -9.363 1.00 1.47 H new ATOM 0 HG3 GLU A 107 -16.724 8.682 -9.429 1.00 1.47 H new ATOM 1403 N SER A 108 -14.929 10.173 -8.822 1.00 0.75 N ATOM 1404 CA SER A 108 -15.229 11.548 -8.332 1.00 0.81 C ATOM 1405 C SER A 108 -13.919 12.207 -7.912 1.00 0.74 C ATOM 1406 O SER A 108 -13.631 13.334 -8.262 1.00 0.81 O ATOM 1407 CB SER A 108 -16.174 11.472 -7.132 1.00 0.89 C ATOM 1408 OG SER A 108 -17.482 11.148 -7.585 1.00 1.53 O ATOM 0 H SER A 108 -14.943 9.445 -8.108 1.00 0.75 H new ATOM 0 HA SER A 108 -15.706 12.131 -9.120 1.00 0.81 H new ATOM 0 HB2 SER A 108 -15.824 10.719 -6.426 1.00 0.89 H new ATOM 0 HB3 SER A 108 -16.185 12.425 -6.602 1.00 0.89 H new ATOM 0 HG SER A 108 -18.090 11.097 -6.818 1.00 1.53 H new ATOM 1414 N SER A 109 -13.115 11.493 -7.179 1.00 0.65 N ATOM 1415 CA SER A 109 -11.805 12.044 -6.743 1.00 0.62 C ATOM 1416 C SER A 109 -10.706 11.307 -7.503 1.00 0.54 C ATOM 1417 O SER A 109 -9.636 11.053 -6.986 1.00 0.52 O ATOM 1418 CB SER A 109 -11.629 11.824 -5.240 1.00 0.65 C ATOM 1419 OG SER A 109 -10.911 12.919 -4.686 1.00 0.83 O ATOM 0 H SER A 109 -13.311 10.544 -6.861 1.00 0.65 H new ATOM 0 HA SER A 109 -11.756 13.113 -6.948 1.00 0.62 H new ATOM 0 HB2 SER A 109 -12.602 11.731 -4.758 1.00 0.65 H new ATOM 0 HB3 SER A 109 -11.093 10.893 -5.057 1.00 0.65 H new ATOM 0 HG SER A 109 -10.935 12.865 -3.708 1.00 0.83 H new ATOM 1425 N GLU A 110 -10.979 10.947 -8.731 1.00 0.55 N ATOM 1426 CA GLU A 110 -9.982 10.208 -9.551 1.00 0.52 C ATOM 1427 C GLU A 110 -8.602 10.865 -9.439 1.00 0.50 C ATOM 1428 O GLU A 110 -7.588 10.199 -9.411 1.00 0.52 O ATOM 1429 CB GLU A 110 -10.430 10.219 -11.013 1.00 0.58 C ATOM 1430 CG GLU A 110 -9.552 9.264 -11.818 1.00 0.70 C ATOM 1431 CD GLU A 110 -10.154 9.063 -13.210 1.00 1.20 C ATOM 1432 OE1 GLU A 110 -10.846 9.957 -13.669 1.00 1.78 O ATOM 1433 OE2 GLU A 110 -9.913 8.019 -13.793 1.00 1.59 O ATOM 0 H GLU A 110 -11.863 11.138 -9.203 1.00 0.55 H new ATOM 0 HA GLU A 110 -9.913 9.183 -9.186 1.00 0.52 H new ATOM 0 HB2 GLU A 110 -11.475 9.920 -11.087 1.00 0.58 H new ATOM 0 HB3 GLU A 110 -10.358 11.228 -11.420 1.00 0.58 H new ATOM 0 HG2 GLU A 110 -8.542 9.666 -11.902 1.00 0.70 H new ATOM 0 HG3 GLU A 110 -9.472 8.306 -11.304 1.00 0.70 H new ATOM 1440 N GLU A 111 -8.558 12.168 -9.380 1.00 0.57 N ATOM 1441 CA GLU A 111 -7.246 12.867 -9.276 1.00 0.60 C ATOM 1442 C GLU A 111 -6.526 12.426 -7.999 1.00 0.52 C ATOM 1443 O GLU A 111 -5.355 12.103 -8.016 1.00 0.53 O ATOM 1444 CB GLU A 111 -7.476 14.379 -9.234 1.00 0.73 C ATOM 1445 CG GLU A 111 -6.891 15.020 -10.493 1.00 1.45 C ATOM 1446 CD GLU A 111 -7.310 16.490 -10.560 1.00 1.93 C ATOM 1447 OE1 GLU A 111 -8.333 16.820 -9.983 1.00 2.18 O ATOM 1448 OE2 GLU A 111 -6.602 17.259 -11.189 1.00 2.66 O ATOM 0 H GLU A 111 -9.375 12.779 -9.399 1.00 0.57 H new ATOM 0 HA GLU A 111 -6.633 12.614 -10.141 1.00 0.60 H new ATOM 0 HB2 GLU A 111 -8.543 14.593 -9.166 1.00 0.73 H new ATOM 0 HB3 GLU A 111 -7.008 14.804 -8.346 1.00 0.73 H new ATOM 0 HG2 GLU A 111 -5.804 14.941 -10.482 1.00 1.45 H new ATOM 0 HG3 GLU A 111 -7.241 14.491 -11.379 1.00 1.45 H new ATOM 1455 N GLN A 112 -7.215 12.410 -6.890 1.00 0.53 N ATOM 1456 CA GLN A 112 -6.564 11.990 -5.616 1.00 0.52 C ATOM 1457 C GLN A 112 -6.073 10.547 -5.748 1.00 0.40 C ATOM 1458 O GLN A 112 -5.004 10.201 -5.286 1.00 0.44 O ATOM 1459 CB GLN A 112 -7.575 12.084 -4.471 1.00 0.61 C ATOM 1460 CG GLN A 112 -7.981 13.545 -4.266 1.00 0.74 C ATOM 1461 CD GLN A 112 -7.001 14.219 -3.303 1.00 1.25 C ATOM 1462 OE1 GLN A 112 -5.992 13.644 -2.945 1.00 1.92 O ATOM 1463 NE2 GLN A 112 -7.256 15.422 -2.866 1.00 1.75 N ATOM 0 H GLN A 112 -8.198 12.669 -6.811 1.00 0.53 H new ATOM 0 HA GLN A 112 -5.718 12.644 -5.406 1.00 0.52 H new ATOM 0 HB2 GLN A 112 -8.454 11.480 -4.697 1.00 0.61 H new ATOM 0 HB3 GLN A 112 -7.141 11.684 -3.555 1.00 0.61 H new ATOM 0 HG2 GLN A 112 -7.986 14.069 -5.222 1.00 0.74 H new ATOM 0 HG3 GLN A 112 -8.994 13.599 -3.867 1.00 0.74 H new ATOM 0 HE21 GLN A 112 -8.103 15.905 -3.166 1.00 1.75 H new ATOM 0 HE22 GLN A 112 -6.608 15.879 -2.224 1.00 1.75 H new ATOM 1472 N ALA A 113 -6.845 9.704 -6.377 1.00 0.37 N ATOM 1473 CA ALA A 113 -6.423 8.284 -6.542 1.00 0.34 C ATOM 1474 C ALA A 113 -5.126 8.233 -7.351 1.00 0.34 C ATOM 1475 O ALA A 113 -4.271 7.398 -7.124 1.00 0.32 O ATOM 1476 CB ALA A 113 -7.517 7.515 -7.283 1.00 0.44 C ATOM 0 H ALA A 113 -7.751 9.937 -6.784 1.00 0.37 H new ATOM 0 HA ALA A 113 -6.260 7.833 -5.563 1.00 0.34 H new ATOM 0 HB1 ALA A 113 -7.212 6.476 -7.406 1.00 0.44 H new ATOM 0 HB2 ALA A 113 -8.443 7.556 -6.709 1.00 0.44 H new ATOM 0 HB3 ALA A 113 -7.677 7.964 -8.263 1.00 0.44 H new ATOM 1482 N ARG A 114 -4.971 9.122 -8.293 1.00 0.53 N ATOM 1483 CA ARG A 114 -3.730 9.132 -9.117 1.00 0.61 C ATOM 1484 C ARG A 114 -2.585 9.745 -8.307 1.00 0.61 C ATOM 1485 O ARG A 114 -1.425 9.536 -8.600 1.00 0.66 O ATOM 1486 CB ARG A 114 -3.964 9.966 -10.379 1.00 0.75 C ATOM 1487 CG ARG A 114 -3.376 9.240 -11.591 1.00 0.67 C ATOM 1488 CD ARG A 114 -4.009 9.791 -12.870 1.00 0.74 C ATOM 1489 NE ARG A 114 -3.066 9.608 -14.010 1.00 1.22 N ATOM 1490 CZ ARG A 114 -3.513 9.620 -15.236 1.00 1.63 C ATOM 1491 NH1 ARG A 114 -4.500 10.409 -15.563 1.00 2.16 N ATOM 1492 NH2 ARG A 114 -2.973 8.843 -16.135 1.00 2.20 N ATOM 0 H ARG A 114 -5.652 9.844 -8.528 1.00 0.53 H new ATOM 0 HA ARG A 114 -3.471 8.111 -9.397 1.00 0.61 H new ATOM 0 HB2 ARG A 114 -5.031 10.132 -10.525 1.00 0.75 H new ATOM 0 HB3 ARG A 114 -3.501 10.947 -10.270 1.00 0.75 H new ATOM 0 HG2 ARG A 114 -2.295 9.375 -11.620 1.00 0.67 H new ATOM 0 HG3 ARG A 114 -3.562 8.169 -11.512 1.00 0.67 H new ATOM 0 HD2 ARG A 114 -4.948 9.277 -13.075 1.00 0.74 H new ATOM 0 HD3 ARG A 114 -4.245 10.848 -12.746 1.00 0.74 H new ATOM 0 HE ARG A 114 -2.071 9.473 -13.832 1.00 1.22 H new ATOM 0 HH11 ARG A 114 -4.922 11.016 -14.860 1.00 2.16 H new ATOM 0 HH12 ARG A 114 -4.849 10.418 -16.521 1.00 2.16 H new ATOM 0 HH21 ARG A 114 -2.202 8.226 -15.879 1.00 2.20 H new ATOM 0 HH22 ARG A 114 -3.322 8.852 -17.093 1.00 2.20 H new ATOM 1506 N ALA A 115 -2.901 10.504 -7.293 1.00 0.63 N ATOM 1507 CA ALA A 115 -1.830 11.131 -6.469 1.00 0.68 C ATOM 1508 C ALA A 115 -1.213 10.081 -5.543 1.00 0.61 C ATOM 1509 O ALA A 115 -0.071 10.191 -5.142 1.00 0.75 O ATOM 1510 CB ALA A 115 -2.429 12.261 -5.629 1.00 0.75 C ATOM 0 H ALA A 115 -3.855 10.717 -7.000 1.00 0.63 H new ATOM 0 HA ALA A 115 -1.058 11.533 -7.125 1.00 0.68 H new ATOM 0 HB1 ALA A 115 -1.646 12.720 -5.026 1.00 0.75 H new ATOM 0 HB2 ALA A 115 -2.867 13.011 -6.288 1.00 0.75 H new ATOM 0 HB3 ALA A 115 -3.202 11.858 -4.974 1.00 0.75 H new ATOM 1516 N VAL A 116 -1.957 9.066 -5.194 1.00 0.45 N ATOM 1517 CA VAL A 116 -1.401 8.020 -4.290 1.00 0.42 C ATOM 1518 C VAL A 116 -0.736 6.916 -5.124 1.00 0.40 C ATOM 1519 O VAL A 116 0.226 6.304 -4.707 1.00 0.49 O ATOM 1520 CB VAL A 116 -2.530 7.428 -3.425 1.00 0.43 C ATOM 1521 CG1 VAL A 116 -3.443 6.529 -4.268 1.00 0.80 C ATOM 1522 CG2 VAL A 116 -1.915 6.605 -2.291 1.00 1.14 C ATOM 0 H VAL A 116 -2.920 8.917 -5.494 1.00 0.45 H new ATOM 0 HA VAL A 116 -0.653 8.467 -3.635 1.00 0.42 H new ATOM 0 HB VAL A 116 -3.125 8.244 -3.017 1.00 0.43 H new ATOM 0 HG11 VAL A 116 -4.234 6.121 -3.638 1.00 0.80 H new ATOM 0 HG12 VAL A 116 -3.886 7.114 -5.074 1.00 0.80 H new ATOM 0 HG13 VAL A 116 -2.859 5.712 -4.692 1.00 0.80 H new ATOM 0 HG21 VAL A 116 -2.709 6.183 -1.675 1.00 1.14 H new ATOM 0 HG22 VAL A 116 -1.315 5.798 -2.711 1.00 1.14 H new ATOM 0 HG23 VAL A 116 -1.282 7.246 -1.678 1.00 1.14 H new ATOM 1532 N GLN A 117 -1.254 6.652 -6.295 1.00 0.40 N ATOM 1533 CA GLN A 117 -0.669 5.586 -7.153 1.00 0.42 C ATOM 1534 C GLN A 117 0.630 6.080 -7.794 1.00 0.41 C ATOM 1535 O GLN A 117 1.660 5.445 -7.699 1.00 0.47 O ATOM 1536 CB GLN A 117 -1.670 5.226 -8.251 1.00 0.49 C ATOM 1537 CG GLN A 117 -1.139 4.039 -9.050 1.00 0.93 C ATOM 1538 CD GLN A 117 -1.352 4.290 -10.544 1.00 1.08 C ATOM 1539 OE1 GLN A 117 -2.103 5.166 -10.924 1.00 1.66 O ATOM 1540 NE2 GLN A 117 -0.718 3.552 -11.414 1.00 1.58 N ATOM 0 H GLN A 117 -2.061 7.132 -6.693 1.00 0.40 H new ATOM 0 HA GLN A 117 -0.452 4.710 -6.542 1.00 0.42 H new ATOM 0 HB2 GLN A 117 -2.636 4.980 -7.811 1.00 0.49 H new ATOM 0 HB3 GLN A 117 -1.828 6.080 -8.909 1.00 0.49 H new ATOM 0 HG2 GLN A 117 -0.079 3.893 -8.843 1.00 0.93 H new ATOM 0 HG3 GLN A 117 -1.651 3.126 -8.748 1.00 0.93 H new ATOM 0 HE21 GLN A 117 -0.087 2.816 -11.095 1.00 1.58 H new ATOM 0 HE22 GLN A 117 -0.853 3.711 -12.412 1.00 1.58 H new ATOM 1549 N MET A 118 0.587 7.205 -8.455 1.00 0.52 N ATOM 1550 CA MET A 118 1.818 7.738 -9.112 1.00 0.59 C ATOM 1551 C MET A 118 2.976 7.764 -8.110 1.00 0.48 C ATOM 1552 O MET A 118 4.083 7.368 -8.416 1.00 0.45 O ATOM 1553 CB MET A 118 1.552 9.157 -9.618 1.00 0.74 C ATOM 1554 CG MET A 118 0.410 9.131 -10.635 1.00 0.83 C ATOM 1555 SD MET A 118 1.083 9.322 -12.305 1.00 1.47 S ATOM 1556 CE MET A 118 0.951 11.125 -12.398 1.00 2.17 C ATOM 0 H MET A 118 -0.248 7.780 -8.569 1.00 0.52 H new ATOM 0 HA MET A 118 2.083 7.093 -9.950 1.00 0.59 H new ATOM 0 HB2 MET A 118 1.295 9.810 -8.784 1.00 0.74 H new ATOM 0 HB3 MET A 118 2.452 9.566 -10.077 1.00 0.74 H new ATOM 0 HG2 MET A 118 -0.138 8.192 -10.558 1.00 0.83 H new ATOM 0 HG3 MET A 118 -0.298 9.932 -10.423 1.00 0.83 H new ATOM 0 HE1 MET A 118 1.319 11.467 -13.365 1.00 2.17 H new ATOM 0 HE2 MET A 118 -0.092 11.420 -12.281 1.00 2.17 H new ATOM 0 HE3 MET A 118 1.546 11.575 -11.603 1.00 2.17 H new ATOM 1566 N SER A 119 2.730 8.228 -6.917 1.00 0.53 N ATOM 1567 CA SER A 119 3.817 8.280 -5.899 1.00 0.52 C ATOM 1568 C SER A 119 4.222 6.856 -5.507 1.00 0.42 C ATOM 1569 O SER A 119 5.390 6.521 -5.468 1.00 0.39 O ATOM 1570 CB SER A 119 3.320 9.027 -4.661 1.00 0.69 C ATOM 1571 OG SER A 119 4.058 10.232 -4.512 1.00 1.28 O ATOM 0 H SER A 119 1.823 8.574 -6.602 1.00 0.53 H new ATOM 0 HA SER A 119 4.679 8.800 -6.317 1.00 0.52 H new ATOM 0 HB2 SER A 119 2.257 9.248 -4.758 1.00 0.69 H new ATOM 0 HB3 SER A 119 3.437 8.404 -3.775 1.00 0.69 H new ATOM 0 HG SER A 119 3.455 10.952 -4.231 1.00 1.28 H new ATOM 1577 N THR A 120 3.267 6.017 -5.213 1.00 0.45 N ATOM 1578 CA THR A 120 3.598 4.619 -4.819 1.00 0.47 C ATOM 1579 C THR A 120 4.450 3.965 -5.908 1.00 0.43 C ATOM 1580 O THR A 120 5.184 3.029 -5.656 1.00 0.45 O ATOM 1581 CB THR A 120 2.306 3.822 -4.632 1.00 0.63 C ATOM 1582 OG1 THR A 120 1.498 3.954 -5.793 1.00 1.72 O ATOM 1583 CG2 THR A 120 1.547 4.356 -3.416 1.00 0.94 C ATOM 0 H THR A 120 2.272 6.239 -5.229 1.00 0.45 H new ATOM 0 HA THR A 120 4.157 4.630 -3.883 1.00 0.47 H new ATOM 0 HB THR A 120 2.546 2.771 -4.474 1.00 0.63 H new ATOM 0 HG1 THR A 120 1.948 4.536 -6.440 1.00 1.72 H new ATOM 0 HG21 THR A 120 0.626 3.788 -3.283 1.00 0.94 H new ATOM 0 HG22 THR A 120 2.168 4.254 -2.526 1.00 0.94 H new ATOM 0 HG23 THR A 120 1.305 5.407 -3.571 1.00 0.94 H new ATOM 1591 N LYS A 121 4.376 4.459 -7.113 1.00 0.43 N ATOM 1592 CA LYS A 121 5.199 3.875 -8.206 1.00 0.45 C ATOM 1593 C LYS A 121 6.571 4.533 -8.157 1.00 0.40 C ATOM 1594 O LYS A 121 7.582 3.922 -8.433 1.00 0.42 O ATOM 1595 CB LYS A 121 4.539 4.154 -9.558 1.00 0.55 C ATOM 1596 CG LYS A 121 3.473 3.093 -9.835 1.00 1.12 C ATOM 1597 CD LYS A 121 4.076 1.972 -10.684 1.00 1.29 C ATOM 1598 CE LYS A 121 4.496 2.530 -12.046 1.00 1.68 C ATOM 1599 NZ LYS A 121 3.588 1.998 -13.102 1.00 2.23 N ATOM 0 H LYS A 121 3.781 5.241 -7.387 1.00 0.43 H new ATOM 0 HA LYS A 121 5.288 2.796 -8.081 1.00 0.45 H new ATOM 0 HB2 LYS A 121 4.088 5.146 -9.556 1.00 0.55 H new ATOM 0 HB3 LYS A 121 5.289 4.146 -10.349 1.00 0.55 H new ATOM 0 HG2 LYS A 121 3.095 2.689 -8.896 1.00 1.12 H new ATOM 0 HG3 LYS A 121 2.625 3.541 -10.354 1.00 1.12 H new ATOM 0 HD2 LYS A 121 4.938 1.540 -10.175 1.00 1.29 H new ATOM 0 HD3 LYS A 121 3.349 1.171 -10.816 1.00 1.29 H new ATOM 0 HE2 LYS A 121 4.457 3.619 -12.033 1.00 1.68 H new ATOM 0 HE3 LYS A 121 5.527 2.251 -12.263 1.00 1.68 H new ATOM 0 HZ1 LYS A 121 3.873 2.377 -14.028 1.00 2.23 H new ATOM 0 HZ2 LYS A 121 3.647 0.960 -13.120 1.00 2.23 H new ATOM 0 HZ3 LYS A 121 2.610 2.286 -12.896 1.00 2.23 H new ATOM 1613 N VAL A 122 6.603 5.781 -7.789 1.00 0.39 N ATOM 1614 CA VAL A 122 7.893 6.505 -7.693 1.00 0.39 C ATOM 1615 C VAL A 122 8.791 5.794 -6.679 1.00 0.34 C ATOM 1616 O VAL A 122 9.998 5.864 -6.760 1.00 0.34 O ATOM 1617 CB VAL A 122 7.626 7.942 -7.239 1.00 0.48 C ATOM 1618 CG1 VAL A 122 8.950 8.667 -6.993 1.00 0.56 C ATOM 1619 CG2 VAL A 122 6.847 8.674 -8.330 1.00 0.58 C ATOM 0 H VAL A 122 5.780 6.334 -7.549 1.00 0.39 H new ATOM 0 HA VAL A 122 8.389 6.520 -8.663 1.00 0.39 H new ATOM 0 HB VAL A 122 7.049 7.926 -6.314 1.00 0.48 H new ATOM 0 HG11 VAL A 122 8.751 9.689 -6.670 1.00 0.56 H new ATOM 0 HG12 VAL A 122 9.512 8.145 -6.219 1.00 0.56 H new ATOM 0 HG13 VAL A 122 9.532 8.684 -7.914 1.00 0.56 H new ATOM 0 HG21 VAL A 122 6.653 9.699 -8.013 1.00 0.58 H new ATOM 0 HG22 VAL A 122 7.431 8.683 -9.250 1.00 0.58 H new ATOM 0 HG23 VAL A 122 5.900 8.163 -8.506 1.00 0.58 H new ATOM 1629 N LEU A 123 8.214 5.108 -5.727 1.00 0.35 N ATOM 1630 CA LEU A 123 9.053 4.391 -4.721 1.00 0.38 C ATOM 1631 C LEU A 123 9.477 3.038 -5.294 1.00 0.38 C ATOM 1632 O LEU A 123 10.549 2.542 -5.017 1.00 0.43 O ATOM 1633 CB LEU A 123 8.251 4.148 -3.433 1.00 0.52 C ATOM 1634 CG LEU A 123 8.057 5.452 -2.648 1.00 0.61 C ATOM 1635 CD1 LEU A 123 9.388 6.193 -2.496 1.00 1.04 C ATOM 1636 CD2 LEU A 123 7.050 6.338 -3.377 1.00 1.14 C ATOM 0 H LEU A 123 7.206 5.013 -5.603 1.00 0.35 H new ATOM 0 HA LEU A 123 9.927 5.001 -4.493 1.00 0.38 H new ATOM 0 HB2 LEU A 123 7.279 3.721 -3.681 1.00 0.52 H new ATOM 0 HB3 LEU A 123 8.769 3.419 -2.810 1.00 0.52 H new ATOM 0 HG LEU A 123 7.681 5.212 -1.653 1.00 0.61 H new ATOM 0 HD11 LEU A 123 9.229 7.115 -1.937 1.00 1.04 H new ATOM 0 HD12 LEU A 123 10.097 5.561 -1.961 1.00 1.04 H new ATOM 0 HD13 LEU A 123 9.787 6.431 -3.482 1.00 1.04 H new ATOM 0 HD21 LEU A 123 6.911 7.265 -2.820 1.00 1.14 H new ATOM 0 HD22 LEU A 123 7.422 6.567 -4.376 1.00 1.14 H new ATOM 0 HD23 LEU A 123 6.096 5.816 -3.456 1.00 1.14 H new ATOM 1648 N ILE A 124 8.634 2.439 -6.084 1.00 0.43 N ATOM 1649 CA ILE A 124 8.969 1.114 -6.677 1.00 0.53 C ATOM 1650 C ILE A 124 10.177 1.257 -7.604 1.00 0.50 C ATOM 1651 O ILE A 124 11.048 0.410 -7.641 1.00 0.53 O ATOM 1652 CB ILE A 124 7.766 0.601 -7.470 1.00 0.65 C ATOM 1653 CG1 ILE A 124 6.578 0.412 -6.524 1.00 0.85 C ATOM 1654 CG2 ILE A 124 8.112 -0.738 -8.123 1.00 0.87 C ATOM 1655 CD1 ILE A 124 5.295 0.243 -7.340 1.00 1.34 C ATOM 0 H ILE A 124 7.721 2.811 -6.347 1.00 0.43 H new ATOM 0 HA ILE A 124 9.211 0.407 -5.884 1.00 0.53 H new ATOM 0 HB ILE A 124 7.508 1.324 -8.244 1.00 0.65 H new ATOM 0 HG12 ILE A 124 6.738 -0.462 -5.893 1.00 0.85 H new ATOM 0 HG13 ILE A 124 6.488 1.272 -5.860 1.00 0.85 H new ATOM 0 HG21 ILE A 124 7.253 -1.101 -8.687 1.00 0.87 H new ATOM 0 HG22 ILE A 124 8.959 -0.606 -8.797 1.00 0.87 H new ATOM 0 HG23 ILE A 124 8.371 -1.463 -7.351 1.00 0.87 H new ATOM 0 HD11 ILE A 124 4.450 0.108 -6.665 1.00 1.34 H new ATOM 0 HD12 ILE A 124 5.133 1.131 -7.952 1.00 1.34 H new ATOM 0 HD13 ILE A 124 5.387 -0.631 -7.985 1.00 1.34 H new ATOM 1667 N GLN A 125 10.237 2.321 -8.353 1.00 0.48 N ATOM 1668 CA GLN A 125 11.381 2.516 -9.275 1.00 0.50 C ATOM 1669 C GLN A 125 12.543 3.154 -8.514 1.00 0.44 C ATOM 1670 O GLN A 125 13.690 2.801 -8.701 1.00 0.51 O ATOM 1671 CB GLN A 125 10.941 3.431 -10.413 1.00 0.55 C ATOM 1672 CG GLN A 125 10.585 2.582 -11.633 1.00 0.71 C ATOM 1673 CD GLN A 125 10.805 3.398 -12.907 1.00 0.90 C ATOM 1674 OE1 GLN A 125 10.775 4.612 -12.878 1.00 1.38 O ATOM 1675 NE2 GLN A 125 11.027 2.778 -14.034 1.00 1.37 N ATOM 0 H GLN A 125 9.539 3.065 -8.364 1.00 0.48 H new ATOM 0 HA GLN A 125 11.706 1.557 -9.679 1.00 0.50 H new ATOM 0 HB2 GLN A 125 10.081 4.025 -10.105 1.00 0.55 H new ATOM 0 HB3 GLN A 125 11.739 4.130 -10.662 1.00 0.55 H new ATOM 0 HG2 GLN A 125 11.200 1.682 -11.655 1.00 0.71 H new ATOM 0 HG3 GLN A 125 9.546 2.257 -11.572 1.00 0.71 H new ATOM 0 HE21 GLN A 125 11.052 1.759 -14.059 1.00 1.37 H new ATOM 0 HE22 GLN A 125 11.175 3.313 -14.890 1.00 1.37 H new ATOM 1684 N PHE A 126 12.254 4.090 -7.653 1.00 0.39 N ATOM 1685 CA PHE A 126 13.342 4.747 -6.877 1.00 0.39 C ATOM 1686 C PHE A 126 14.046 3.705 -6.006 1.00 0.47 C ATOM 1687 O PHE A 126 15.175 3.884 -5.609 1.00 0.74 O ATOM 1688 CB PHE A 126 12.752 5.836 -5.978 1.00 0.40 C ATOM 1689 CG PHE A 126 12.594 7.115 -6.765 1.00 0.43 C ATOM 1690 CD1 PHE A 126 12.032 7.086 -8.047 1.00 0.43 C ATOM 1691 CD2 PHE A 126 13.010 8.332 -6.211 1.00 0.57 C ATOM 1692 CE1 PHE A 126 11.887 8.274 -8.775 1.00 0.52 C ATOM 1693 CE2 PHE A 126 12.864 9.519 -6.938 1.00 0.67 C ATOM 1694 CZ PHE A 126 12.303 9.490 -8.220 1.00 0.63 C ATOM 0 H PHE A 126 11.312 4.428 -7.454 1.00 0.39 H new ATOM 0 HA PHE A 126 14.056 5.194 -7.569 1.00 0.39 H new ATOM 0 HB2 PHE A 126 11.786 5.516 -5.589 1.00 0.40 H new ATOM 0 HB3 PHE A 126 13.402 6.004 -5.119 1.00 0.40 H new ATOM 0 HD1 PHE A 126 11.710 6.148 -8.475 1.00 0.43 H new ATOM 0 HD2 PHE A 126 13.444 8.355 -5.222 1.00 0.57 H new ATOM 0 HE1 PHE A 126 11.454 8.252 -9.764 1.00 0.52 H new ATOM 0 HE2 PHE A 126 13.184 10.457 -6.510 1.00 0.67 H new ATOM 0 HZ PHE A 126 12.191 10.406 -8.781 1.00 0.63 H new ATOM 1704 N LEU A 127 13.386 2.620 -5.703 1.00 0.40 N ATOM 1705 CA LEU A 127 14.023 1.573 -4.853 1.00 0.50 C ATOM 1706 C LEU A 127 14.818 0.611 -5.736 1.00 0.48 C ATOM 1707 O LEU A 127 15.991 0.381 -5.523 1.00 0.68 O ATOM 1708 CB LEU A 127 12.941 0.792 -4.103 1.00 0.58 C ATOM 1709 CG LEU A 127 12.478 1.593 -2.885 1.00 1.07 C ATOM 1710 CD1 LEU A 127 11.391 0.814 -2.142 1.00 2.05 C ATOM 1711 CD2 LEU A 127 13.665 1.827 -1.948 1.00 0.99 C ATOM 0 H LEU A 127 12.434 2.413 -6.007 1.00 0.40 H new ATOM 0 HA LEU A 127 14.692 2.050 -4.137 1.00 0.50 H new ATOM 0 HB2 LEU A 127 12.097 0.596 -4.764 1.00 0.58 H new ATOM 0 HB3 LEU A 127 13.330 -0.176 -3.787 1.00 0.58 H new ATOM 0 HG LEU A 127 12.077 2.552 -3.214 1.00 1.07 H new ATOM 0 HD11 LEU A 127 11.062 1.386 -1.274 1.00 2.05 H new ATOM 0 HD12 LEU A 127 10.545 0.646 -2.808 1.00 2.05 H new ATOM 0 HD13 LEU A 127 11.791 -0.145 -1.814 1.00 2.05 H new ATOM 0 HD21 LEU A 127 13.336 2.398 -1.080 1.00 0.99 H new ATOM 0 HD22 LEU A 127 14.065 0.867 -1.621 1.00 0.99 H new ATOM 0 HD23 LEU A 127 14.440 2.383 -2.475 1.00 0.99 H new ATOM 1723 N GLN A 128 14.185 0.044 -6.725 1.00 0.42 N ATOM 1724 CA GLN A 128 14.897 -0.907 -7.623 1.00 0.48 C ATOM 1725 C GLN A 128 16.142 -0.227 -8.196 1.00 0.57 C ATOM 1726 O GLN A 128 17.101 -0.875 -8.568 1.00 0.69 O ATOM 1727 CB GLN A 128 13.970 -1.319 -8.768 1.00 0.56 C ATOM 1728 CG GLN A 128 13.175 -2.560 -8.360 1.00 1.01 C ATOM 1729 CD GLN A 128 12.391 -3.084 -9.564 1.00 1.30 C ATOM 1730 OE1 GLN A 128 12.737 -2.807 -10.696 1.00 1.93 O ATOM 1731 NE2 GLN A 128 11.341 -3.833 -9.368 1.00 1.79 N ATOM 0 H GLN A 128 13.202 0.199 -6.950 1.00 0.42 H new ATOM 0 HA GLN A 128 15.191 -1.791 -7.058 1.00 0.48 H new ATOM 0 HB2 GLN A 128 13.290 -0.502 -9.011 1.00 0.56 H new ATOM 0 HB3 GLN A 128 14.553 -1.526 -9.665 1.00 0.56 H new ATOM 0 HG2 GLN A 128 13.850 -3.331 -7.989 1.00 1.01 H new ATOM 0 HG3 GLN A 128 12.492 -2.316 -7.546 1.00 1.01 H new ATOM 0 HE21 GLN A 128 11.051 -4.066 -8.418 1.00 1.79 H new ATOM 0 HE22 GLN A 128 10.811 -4.186 -10.164 1.00 1.79 H new ATOM 1740 N LYS A 129 16.134 1.076 -8.270 1.00 0.64 N ATOM 1741 CA LYS A 129 17.313 1.801 -8.819 1.00 0.81 C ATOM 1742 C LYS A 129 18.293 2.114 -7.687 1.00 0.85 C ATOM 1743 O LYS A 129 19.466 1.810 -7.769 1.00 0.97 O ATOM 1744 CB LYS A 129 16.851 3.105 -9.472 1.00 0.92 C ATOM 1745 CG LYS A 129 16.038 2.783 -10.727 1.00 1.31 C ATOM 1746 CD LYS A 129 15.450 4.073 -11.300 1.00 1.68 C ATOM 1747 CE LYS A 129 16.024 4.319 -12.696 1.00 2.34 C ATOM 1748 NZ LYS A 129 15.460 5.583 -13.249 1.00 3.02 N ATOM 0 H LYS A 129 15.360 1.670 -7.973 1.00 0.64 H new ATOM 0 HA LYS A 129 17.808 1.178 -9.564 1.00 0.81 H new ATOM 0 HB2 LYS A 129 16.247 3.681 -8.772 1.00 0.92 H new ATOM 0 HB3 LYS A 129 17.713 3.720 -9.731 1.00 0.92 H new ATOM 0 HG2 LYS A 129 16.672 2.299 -11.470 1.00 1.31 H new ATOM 0 HG3 LYS A 129 15.239 2.083 -10.485 1.00 1.31 H new ATOM 0 HD2 LYS A 129 14.364 3.999 -11.350 1.00 1.68 H new ATOM 0 HD3 LYS A 129 15.683 4.913 -10.646 1.00 1.68 H new ATOM 0 HE2 LYS A 129 17.111 4.384 -12.648 1.00 2.34 H new ATOM 0 HE3 LYS A 129 15.783 3.483 -13.352 1.00 2.34 H new ATOM 0 HZ1 LYS A 129 15.850 5.751 -14.198 1.00 3.02 H new ATOM 0 HZ2 LYS A 129 14.425 5.504 -13.309 1.00 3.02 H new ATOM 0 HZ3 LYS A 129 15.711 6.377 -12.626 1.00 3.02 H new ATOM 1762 N LYS A 130 17.823 2.717 -6.627 1.00 0.89 N ATOM 1763 CA LYS A 130 18.736 3.042 -5.494 1.00 1.04 C ATOM 1764 C LYS A 130 18.755 1.886 -4.492 1.00 0.93 C ATOM 1765 O LYS A 130 19.054 2.075 -3.329 1.00 1.06 O ATOM 1766 CB LYS A 130 18.289 4.352 -4.813 1.00 1.33 C ATOM 1767 CG LYS A 130 17.129 4.103 -3.839 1.00 1.58 C ATOM 1768 CD LYS A 130 17.647 4.170 -2.400 1.00 1.82 C ATOM 1769 CE LYS A 130 17.049 3.021 -1.586 1.00 2.31 C ATOM 1770 NZ LYS A 130 17.914 2.747 -0.404 1.00 2.82 N ATOM 0 H LYS A 130 16.851 2.997 -6.498 1.00 0.89 H new ATOM 0 HA LYS A 130 19.747 3.183 -5.876 1.00 1.04 H new ATOM 0 HB2 LYS A 130 19.130 4.791 -4.277 1.00 1.33 H new ATOM 0 HB3 LYS A 130 17.983 5.073 -5.571 1.00 1.33 H new ATOM 0 HG2 LYS A 130 16.347 4.847 -3.990 1.00 1.58 H new ATOM 0 HG3 LYS A 130 16.682 3.128 -4.031 1.00 1.58 H new ATOM 0 HD2 LYS A 130 18.735 4.108 -2.391 1.00 1.82 H new ATOM 0 HD3 LYS A 130 17.379 5.126 -1.950 1.00 1.82 H new ATOM 0 HE2 LYS A 130 16.041 3.278 -1.261 1.00 2.31 H new ATOM 0 HE3 LYS A 130 16.966 2.127 -2.205 1.00 2.31 H new ATOM 0 HZ1 LYS A 130 17.508 1.966 0.150 1.00 2.82 H new ATOM 0 HZ2 LYS A 130 18.868 2.485 -0.725 1.00 2.82 H new ATOM 0 HZ3 LYS A 130 17.971 3.599 0.190 1.00 2.82 H new ATOM 1784 N ALA A 131 18.452 0.692 -4.927 1.00 0.79 N ATOM 1785 CA ALA A 131 18.483 -0.456 -3.986 1.00 0.82 C ATOM 1786 C ALA A 131 19.905 -1.024 -3.949 1.00 0.99 C ATOM 1787 O ALA A 131 20.114 -2.211 -4.098 1.00 1.38 O ATOM 1788 CB ALA A 131 17.501 -1.544 -4.439 1.00 0.79 C ATOM 0 H ALA A 131 18.187 0.467 -5.886 1.00 0.79 H new ATOM 0 HA ALA A 131 18.189 -0.119 -2.992 1.00 0.82 H new ATOM 0 HB1 ALA A 131 17.535 -2.379 -3.739 1.00 0.79 H new ATOM 0 HB2 ALA A 131 16.491 -1.134 -4.466 1.00 0.79 H new ATOM 0 HB3 ALA A 131 17.778 -1.893 -5.434 1.00 0.79 H new ATOM 1794 N LYS A 132 20.891 -0.187 -3.754 1.00 0.94 N ATOM 1795 CA LYS A 132 22.289 -0.694 -3.696 1.00 1.21 C ATOM 1796 C LYS A 132 22.392 -1.683 -2.535 1.00 1.27 C ATOM 1797 O LYS A 132 21.735 -1.532 -1.524 1.00 1.26 O ATOM 1798 CB LYS A 132 23.252 0.474 -3.466 1.00 1.47 C ATOM 1799 CG LYS A 132 22.735 1.346 -2.320 1.00 1.75 C ATOM 1800 CD LYS A 132 23.910 1.797 -1.449 1.00 2.41 C ATOM 1801 CE LYS A 132 23.443 1.947 0.001 1.00 2.77 C ATOM 1802 NZ LYS A 132 24.017 3.194 0.587 1.00 3.32 N ATOM 0 H LYS A 132 20.787 0.820 -3.633 1.00 0.94 H new ATOM 0 HA LYS A 132 22.551 -1.185 -4.633 1.00 1.21 H new ATOM 0 HB2 LYS A 132 24.247 0.097 -3.230 1.00 1.47 H new ATOM 0 HB3 LYS A 132 23.344 1.068 -4.376 1.00 1.47 H new ATOM 0 HG2 LYS A 132 22.210 2.214 -2.718 1.00 1.75 H new ATOM 0 HG3 LYS A 132 22.017 0.787 -1.719 1.00 1.75 H new ATOM 0 HD2 LYS A 132 24.720 1.070 -1.508 1.00 2.41 H new ATOM 0 HD3 LYS A 132 24.305 2.745 -1.815 1.00 2.41 H new ATOM 0 HE2 LYS A 132 22.354 1.982 0.041 1.00 2.77 H new ATOM 0 HE3 LYS A 132 23.755 1.082 0.585 1.00 2.77 H new ATOM 0 HZ1 LYS A 132 23.698 3.293 1.572 1.00 3.32 H new ATOM 0 HZ2 LYS A 132 25.055 3.143 0.563 1.00 3.32 H new ATOM 0 HZ3 LYS A 132 23.698 4.016 0.035 1.00 3.32 H new ATOM 1816 N ASN A 133 23.195 -2.701 -2.668 1.00 1.41 N ATOM 1817 CA ASN A 133 23.309 -3.697 -1.565 1.00 1.55 C ATOM 1818 C ASN A 133 21.926 -4.282 -1.289 1.00 1.39 C ATOM 1819 O ASN A 133 21.527 -4.476 -0.158 1.00 1.48 O ATOM 1820 CB ASN A 133 23.845 -3.016 -0.304 1.00 1.75 C ATOM 1821 CG ASN A 133 25.029 -3.816 0.243 1.00 2.18 C ATOM 1822 OD1 ASN A 133 25.126 -5.007 0.023 1.00 2.58 O ATOM 1823 ND2 ASN A 133 25.940 -3.207 0.952 1.00 2.72 N ATOM 0 H ASN A 133 23.774 -2.887 -3.487 1.00 1.41 H new ATOM 0 HA ASN A 133 23.997 -4.492 -1.853 1.00 1.55 H new ATOM 0 HB2 ASN A 133 24.156 -1.996 -0.532 1.00 1.75 H new ATOM 0 HB3 ASN A 133 23.059 -2.949 0.448 1.00 1.75 H new ATOM 0 HD21 ASN A 133 26.733 -3.731 1.321 1.00 2.72 H new ATOM 0 HD22 ASN A 133 25.859 -2.207 1.137 1.00 2.72 H new ATOM 1830 N LEU A 134 21.199 -4.564 -2.329 1.00 1.23 N ATOM 1831 CA LEU A 134 19.838 -5.140 -2.177 1.00 1.15 C ATOM 1832 C LEU A 134 19.676 -6.274 -3.183 1.00 1.28 C ATOM 1833 O LEU A 134 20.635 -6.936 -3.531 1.00 1.62 O ATOM 1834 CB LEU A 134 18.793 -4.051 -2.415 1.00 1.00 C ATOM 1835 CG LEU A 134 17.729 -4.118 -1.319 1.00 1.28 C ATOM 1836 CD1 LEU A 134 18.306 -3.557 -0.017 1.00 1.49 C ATOM 1837 CD2 LEU A 134 16.517 -3.282 -1.734 1.00 1.86 C ATOM 0 H LEU A 134 21.495 -4.417 -3.294 1.00 1.23 H new ATOM 0 HA LEU A 134 19.700 -5.532 -1.169 1.00 1.15 H new ATOM 0 HB2 LEU A 134 19.268 -3.070 -2.416 1.00 1.00 H new ATOM 0 HB3 LEU A 134 18.331 -4.183 -3.394 1.00 1.00 H new ATOM 0 HG LEU A 134 17.425 -5.154 -1.170 1.00 1.28 H new ATOM 0 HD11 LEU A 134 17.549 -3.604 0.766 1.00 1.49 H new ATOM 0 HD12 LEU A 134 19.173 -4.147 0.281 1.00 1.49 H new ATOM 0 HD13 LEU A 134 18.607 -2.521 -0.169 1.00 1.49 H new ATOM 0 HD21 LEU A 134 15.758 -3.329 -0.953 1.00 1.86 H new ATOM 0 HD22 LEU A 134 16.823 -2.246 -1.881 1.00 1.86 H new ATOM 0 HD23 LEU A 134 16.106 -3.674 -2.664 1.00 1.86 H new ATOM 1849 N ASP A 135 18.485 -6.531 -3.637 1.00 1.28 N ATOM 1850 CA ASP A 135 18.315 -7.663 -4.602 1.00 1.72 C ATOM 1851 C ASP A 135 17.191 -7.414 -5.610 1.00 1.37 C ATOM 1852 O ASP A 135 16.849 -8.295 -6.374 1.00 1.93 O ATOM 1853 CB ASP A 135 18.008 -8.942 -3.819 1.00 2.67 C ATOM 1854 CG ASP A 135 19.021 -10.028 -4.188 1.00 3.30 C ATOM 1855 OD1 ASP A 135 19.332 -10.146 -5.362 1.00 3.58 O ATOM 1856 OD2 ASP A 135 19.466 -10.724 -3.291 1.00 3.93 O ATOM 0 H ASP A 135 17.635 -6.023 -3.393 1.00 1.28 H new ATOM 0 HA ASP A 135 19.244 -7.757 -5.164 1.00 1.72 H new ATOM 0 HB2 ASP A 135 18.048 -8.743 -2.748 1.00 2.67 H new ATOM 0 HB3 ASP A 135 16.997 -9.283 -4.042 1.00 2.67 H new ATOM 1861 N ALA A 136 16.587 -6.252 -5.597 1.00 1.48 N ATOM 1862 CA ALA A 136 15.450 -5.956 -6.530 1.00 1.79 C ATOM 1863 C ALA A 136 14.162 -6.486 -5.918 1.00 1.34 C ATOM 1864 O ALA A 136 13.078 -6.038 -6.233 1.00 2.03 O ATOM 1865 CB ALA A 136 15.669 -6.571 -7.918 1.00 2.54 C ATOM 0 H ALA A 136 16.835 -5.485 -4.972 1.00 1.48 H new ATOM 0 HA ALA A 136 15.388 -4.876 -6.666 1.00 1.79 H new ATOM 0 HB1 ALA A 136 14.821 -6.331 -8.560 1.00 2.54 H new ATOM 0 HB2 ALA A 136 16.582 -6.166 -8.356 1.00 2.54 H new ATOM 0 HB3 ALA A 136 15.760 -7.653 -7.826 1.00 2.54 H new ATOM 1871 N ILE A 137 14.281 -7.393 -4.995 1.00 0.94 N ATOM 1872 CA ILE A 137 13.106 -7.910 -4.294 1.00 1.11 C ATOM 1873 C ILE A 137 12.120 -8.545 -5.281 1.00 1.16 C ATOM 1874 O ILE A 137 10.974 -8.797 -4.964 1.00 1.63 O ATOM 1875 CB ILE A 137 12.494 -6.740 -3.521 1.00 1.56 C ATOM 1876 CG1 ILE A 137 13.425 -6.341 -2.357 1.00 1.91 C ATOM 1877 CG2 ILE A 137 11.146 -7.145 -2.940 1.00 2.05 C ATOM 1878 CD1 ILE A 137 14.839 -5.997 -2.851 1.00 1.28 C ATOM 0 H ILE A 137 15.168 -7.799 -4.699 1.00 0.94 H new ATOM 0 HA ILE A 137 13.376 -8.704 -3.597 1.00 1.11 H new ATOM 0 HB ILE A 137 12.366 -5.902 -4.206 1.00 1.56 H new ATOM 0 HG12 ILE A 137 13.004 -5.483 -1.832 1.00 1.91 H new ATOM 0 HG13 ILE A 137 13.480 -7.159 -1.638 1.00 1.91 H new ATOM 0 HG21 ILE A 137 10.719 -6.305 -2.392 1.00 2.05 H new ATOM 0 HG22 ILE A 137 10.473 -7.431 -3.748 1.00 2.05 H new ATOM 0 HG23 ILE A 137 11.280 -7.989 -2.264 1.00 2.05 H new ATOM 0 HD11 ILE A 137 15.464 -5.721 -2.002 1.00 1.28 H new ATOM 0 HD12 ILE A 137 15.270 -6.863 -3.353 1.00 1.28 H new ATOM 0 HD13 ILE A 137 14.787 -5.162 -3.550 1.00 1.28 H new ATOM 1890 N THR A 138 12.565 -8.851 -6.467 1.00 1.45 N ATOM 1891 CA THR A 138 11.662 -9.508 -7.451 1.00 1.77 C ATOM 1892 C THR A 138 10.327 -8.755 -7.540 1.00 1.42 C ATOM 1893 O THR A 138 10.245 -7.577 -7.254 1.00 1.29 O ATOM 1894 CB THR A 138 11.407 -10.946 -6.989 1.00 2.26 C ATOM 1895 OG1 THR A 138 12.493 -11.377 -6.180 1.00 2.50 O ATOM 1896 CG2 THR A 138 11.279 -11.865 -8.205 1.00 2.87 C ATOM 0 H THR A 138 13.514 -8.675 -6.797 1.00 1.45 H new ATOM 0 HA THR A 138 12.129 -9.500 -8.436 1.00 1.77 H new ATOM 0 HB THR A 138 10.482 -10.984 -6.413 1.00 2.26 H new ATOM 0 HG1 THR A 138 12.333 -12.296 -5.881 1.00 2.50 H new ATOM 0 HG21 THR A 138 11.098 -12.887 -7.871 1.00 2.87 H new ATOM 0 HG22 THR A 138 10.447 -11.533 -8.826 1.00 2.87 H new ATOM 0 HG23 THR A 138 12.201 -11.831 -8.785 1.00 2.87 H new ATOM 1904 N THR A 139 9.285 -9.433 -7.936 1.00 1.41 N ATOM 1905 CA THR A 139 7.958 -8.779 -8.050 1.00 1.18 C ATOM 1906 C THR A 139 6.910 -9.864 -8.357 1.00 1.20 C ATOM 1907 O THR A 139 7.233 -10.858 -8.976 1.00 1.34 O ATOM 1908 CB THR A 139 8.026 -7.742 -9.180 1.00 1.33 C ATOM 1909 OG1 THR A 139 6.882 -6.904 -9.138 1.00 1.58 O ATOM 1910 CG2 THR A 139 8.100 -8.440 -10.541 1.00 1.44 C ATOM 0 H THR A 139 9.300 -10.422 -8.187 1.00 1.41 H new ATOM 0 HA THR A 139 7.680 -8.273 -7.125 1.00 1.18 H new ATOM 0 HB THR A 139 8.923 -7.138 -9.042 1.00 1.33 H new ATOM 0 HG1 THR A 139 6.573 -6.727 -10.051 1.00 1.58 H new ATOM 0 HG21 THR A 139 8.148 -7.691 -11.332 1.00 1.44 H new ATOM 0 HG22 THR A 139 8.991 -9.067 -10.581 1.00 1.44 H new ATOM 0 HG23 THR A 139 7.214 -9.059 -10.681 1.00 1.44 H new ATOM 1918 N PRO A 140 5.689 -9.658 -7.919 1.00 1.52 N ATOM 1919 CA PRO A 140 4.610 -10.633 -8.152 1.00 1.85 C ATOM 1920 C PRO A 140 4.175 -10.606 -9.616 1.00 1.92 C ATOM 1921 O PRO A 140 3.766 -9.588 -10.139 1.00 2.33 O ATOM 1922 CB PRO A 140 3.490 -10.172 -7.213 1.00 2.58 C ATOM 1923 CG PRO A 140 3.761 -8.682 -6.911 1.00 2.65 C ATOM 1924 CD PRO A 140 5.261 -8.452 -7.171 1.00 1.93 C ATOM 0 HA PRO A 140 4.907 -11.663 -7.955 1.00 1.85 H new ATOM 0 HB2 PRO A 140 2.514 -10.302 -7.680 1.00 2.58 H new ATOM 0 HB3 PRO A 140 3.486 -10.760 -6.295 1.00 2.58 H new ATOM 0 HG2 PRO A 140 3.153 -8.040 -7.548 1.00 2.65 H new ATOM 0 HG3 PRO A 140 3.504 -8.442 -5.879 1.00 2.65 H new ATOM 0 HD2 PRO A 140 5.430 -7.544 -7.749 1.00 1.93 H new ATOM 0 HD3 PRO A 140 5.815 -8.344 -6.238 1.00 1.93 H new ATOM 1932 N ASP A 141 4.272 -11.730 -10.278 1.00 2.03 N ATOM 1933 CA ASP A 141 3.880 -11.816 -11.717 1.00 2.59 C ATOM 1934 C ASP A 141 2.531 -11.108 -11.937 1.00 2.06 C ATOM 1935 O ASP A 141 1.684 -11.138 -11.067 1.00 1.71 O ATOM 1936 CB ASP A 141 3.747 -13.294 -12.092 1.00 3.41 C ATOM 1937 CG ASP A 141 4.197 -13.509 -13.538 1.00 4.38 C ATOM 1938 OD1 ASP A 141 5.289 -13.078 -13.868 1.00 4.70 O ATOM 1939 OD2 ASP A 141 3.441 -14.102 -14.291 1.00 5.01 O ATOM 0 H ASP A 141 4.611 -12.604 -9.877 1.00 2.03 H new ATOM 0 HA ASP A 141 4.635 -11.333 -12.337 1.00 2.59 H new ATOM 0 HB2 ASP A 141 4.351 -13.904 -11.420 1.00 3.41 H new ATOM 0 HB3 ASP A 141 2.713 -13.616 -11.973 1.00 3.41 H new ATOM 1944 N PRO A 142 2.361 -10.487 -13.088 1.00 2.15 N ATOM 1945 CA PRO A 142 1.113 -9.774 -13.409 1.00 1.89 C ATOM 1946 C PRO A 142 0.013 -10.776 -13.766 1.00 1.60 C ATOM 1947 O PRO A 142 -1.162 -10.492 -13.643 1.00 1.61 O ATOM 1948 CB PRO A 142 1.488 -8.902 -14.610 1.00 2.41 C ATOM 1949 CG PRO A 142 2.730 -9.557 -15.254 1.00 2.81 C ATOM 1950 CD PRO A 142 3.376 -10.437 -14.168 1.00 2.70 C ATOM 0 HA PRO A 142 0.725 -9.183 -12.579 1.00 1.89 H new ATOM 0 HB2 PRO A 142 0.665 -8.847 -15.322 1.00 2.41 H new ATOM 0 HB3 PRO A 142 1.706 -7.881 -14.296 1.00 2.41 H new ATOM 0 HG2 PRO A 142 2.447 -10.155 -16.120 1.00 2.81 H new ATOM 0 HG3 PRO A 142 3.430 -8.799 -15.605 1.00 2.81 H new ATOM 0 HD2 PRO A 142 3.604 -11.433 -14.547 1.00 2.70 H new ATOM 0 HD3 PRO A 142 4.313 -10.008 -13.814 1.00 2.70 H new ATOM 1958 N THR A 143 0.383 -11.952 -14.194 1.00 1.42 N ATOM 1959 CA THR A 143 -0.645 -12.971 -14.539 1.00 1.24 C ATOM 1960 C THR A 143 -1.314 -13.445 -13.250 1.00 1.11 C ATOM 1961 O THR A 143 -2.520 -13.571 -13.173 1.00 1.06 O ATOM 1962 CB THR A 143 0.018 -14.155 -15.246 1.00 1.26 C ATOM 1963 OG1 THR A 143 0.864 -14.838 -14.331 1.00 1.54 O ATOM 1964 CG2 THR A 143 0.846 -13.647 -16.427 1.00 1.81 C ATOM 0 H THR A 143 1.351 -12.250 -14.319 1.00 1.42 H new ATOM 0 HA THR A 143 -1.390 -12.537 -15.206 1.00 1.24 H new ATOM 0 HB THR A 143 -0.750 -14.838 -15.610 1.00 1.26 H new ATOM 0 HG1 THR A 143 1.743 -14.405 -14.313 1.00 1.54 H new ATOM 0 HG21 THR A 143 1.318 -14.491 -16.930 1.00 1.81 H new ATOM 0 HG22 THR A 143 0.196 -13.123 -17.128 1.00 1.81 H new ATOM 0 HG23 THR A 143 1.615 -12.964 -16.065 1.00 1.81 H new ATOM 1972 N THR A 144 -0.539 -13.694 -12.228 1.00 1.15 N ATOM 1973 CA THR A 144 -1.133 -14.139 -10.938 1.00 1.11 C ATOM 1974 C THR A 144 -1.837 -12.947 -10.292 1.00 0.99 C ATOM 1975 O THR A 144 -2.898 -13.075 -9.710 1.00 0.94 O ATOM 1976 CB THR A 144 -0.029 -14.651 -10.009 1.00 1.29 C ATOM 1977 OG1 THR A 144 0.836 -15.514 -10.734 1.00 1.49 O ATOM 1978 CG2 THR A 144 -0.657 -15.416 -8.843 1.00 1.39 C ATOM 0 H THR A 144 0.477 -13.608 -12.232 1.00 1.15 H new ATOM 0 HA THR A 144 -1.846 -14.944 -11.114 1.00 1.11 H new ATOM 0 HB THR A 144 0.542 -13.807 -9.622 1.00 1.29 H new ATOM 0 HG1 THR A 144 1.544 -15.841 -10.141 1.00 1.49 H new ATOM 0 HG21 THR A 144 0.129 -15.781 -8.182 1.00 1.39 H new ATOM 0 HG22 THR A 144 -1.320 -14.753 -8.288 1.00 1.39 H new ATOM 0 HG23 THR A 144 -1.228 -16.261 -9.228 1.00 1.39 H new ATOM 1986 N ASN A 145 -1.261 -11.781 -10.406 1.00 0.98 N ATOM 1987 CA ASN A 145 -1.905 -10.578 -9.818 1.00 0.89 C ATOM 1988 C ASN A 145 -3.185 -10.273 -10.598 1.00 0.79 C ATOM 1989 O ASN A 145 -4.042 -9.549 -10.139 1.00 0.71 O ATOM 1990 CB ASN A 145 -0.952 -9.384 -9.895 1.00 0.98 C ATOM 1991 CG ASN A 145 -0.528 -8.989 -8.479 1.00 1.23 C ATOM 1992 OD1 ASN A 145 0.629 -8.710 -8.234 1.00 1.52 O ATOM 1993 ND2 ASN A 145 -1.423 -8.953 -7.527 1.00 1.18 N ATOM 0 H ASN A 145 -0.374 -11.612 -10.880 1.00 0.98 H new ATOM 0 HA ASN A 145 -2.145 -10.764 -8.771 1.00 0.89 H new ATOM 0 HB2 ASN A 145 -0.077 -9.640 -10.492 1.00 0.98 H new ATOM 0 HB3 ASN A 145 -1.441 -8.544 -10.389 1.00 0.98 H new ATOM 0 HD21 ASN A 145 -1.150 -8.691 -6.580 1.00 1.18 H new ATOM 0 HD22 ASN A 145 -2.395 -9.187 -7.731 1.00 1.18 H new ATOM 2000 N ALA A 146 -3.330 -10.835 -11.771 1.00 0.86 N ATOM 2001 CA ALA A 146 -4.566 -10.594 -12.561 1.00 0.86 C ATOM 2002 C ALA A 146 -5.703 -11.381 -11.916 1.00 0.83 C ATOM 2003 O ALA A 146 -6.856 -11.006 -11.993 1.00 0.88 O ATOM 2004 CB ALA A 146 -4.358 -11.070 -14.001 1.00 0.96 C ATOM 0 H ALA A 146 -2.645 -11.449 -12.212 1.00 0.86 H new ATOM 0 HA ALA A 146 -4.805 -9.531 -12.575 1.00 0.86 H new ATOM 0 HB1 ALA A 146 -5.266 -10.892 -14.578 1.00 0.96 H new ATOM 0 HB2 ALA A 146 -3.530 -10.521 -14.449 1.00 0.96 H new ATOM 0 HB3 ALA A 146 -4.130 -12.136 -14.003 1.00 0.96 H new ATOM 2010 N SER A 147 -5.380 -12.466 -11.266 1.00 0.84 N ATOM 2011 CA SER A 147 -6.432 -13.273 -10.595 1.00 0.91 C ATOM 2012 C SER A 147 -6.762 -12.627 -9.249 1.00 0.84 C ATOM 2013 O SER A 147 -7.897 -12.610 -8.823 1.00 0.86 O ATOM 2014 CB SER A 147 -5.927 -14.700 -10.375 1.00 1.02 C ATOM 2015 OG SER A 147 -7.004 -15.611 -10.547 1.00 1.38 O ATOM 0 H SER A 147 -4.431 -12.827 -11.172 1.00 0.84 H new ATOM 0 HA SER A 147 -7.326 -13.309 -11.218 1.00 0.91 H new ATOM 0 HB2 SER A 147 -5.127 -14.928 -11.080 1.00 1.02 H new ATOM 0 HB3 SER A 147 -5.508 -14.799 -9.374 1.00 1.02 H new ATOM 0 HG SER A 147 -6.683 -16.527 -10.408 1.00 1.38 H new ATOM 2021 N LEU A 148 -5.784 -12.076 -8.579 1.00 0.77 N ATOM 2022 CA LEU A 148 -6.076 -11.415 -7.276 1.00 0.72 C ATOM 2023 C LEU A 148 -7.018 -10.244 -7.549 1.00 0.64 C ATOM 2024 O LEU A 148 -8.005 -10.064 -6.876 1.00 0.68 O ATOM 2025 CB LEU A 148 -4.769 -10.902 -6.639 1.00 0.72 C ATOM 2026 CG LEU A 148 -5.064 -9.778 -5.626 1.00 0.61 C ATOM 2027 CD1 LEU A 148 -5.949 -10.303 -4.496 1.00 0.73 C ATOM 2028 CD2 LEU A 148 -3.760 -9.263 -5.040 1.00 0.77 C ATOM 0 H LEU A 148 -4.808 -12.055 -8.874 1.00 0.77 H new ATOM 0 HA LEU A 148 -6.536 -12.122 -6.586 1.00 0.72 H new ATOM 0 HB2 LEU A 148 -4.255 -11.723 -6.140 1.00 0.72 H new ATOM 0 HB3 LEU A 148 -4.100 -10.532 -7.416 1.00 0.72 H new ATOM 0 HG LEU A 148 -5.582 -8.970 -6.142 1.00 0.61 H new ATOM 0 HD11 LEU A 148 -6.150 -9.499 -3.788 1.00 0.73 H new ATOM 0 HD12 LEU A 148 -6.890 -10.666 -4.909 1.00 0.73 H new ATOM 0 HD13 LEU A 148 -5.439 -11.119 -3.984 1.00 0.73 H new ATOM 0 HD21 LEU A 148 -3.971 -8.469 -4.324 1.00 0.77 H new ATOM 0 HD22 LEU A 148 -3.241 -10.078 -4.535 1.00 0.77 H new ATOM 0 HD23 LEU A 148 -3.131 -8.873 -5.840 1.00 0.77 H new ATOM 2040 N LEU A 149 -6.698 -9.445 -8.526 1.00 0.62 N ATOM 2041 CA LEU A 149 -7.554 -8.275 -8.855 1.00 0.59 C ATOM 2042 C LEU A 149 -8.916 -8.779 -9.322 1.00 0.64 C ATOM 2043 O LEU A 149 -9.943 -8.246 -8.958 1.00 0.64 O ATOM 2044 CB LEU A 149 -6.881 -7.467 -9.969 1.00 0.62 C ATOM 2045 CG LEU A 149 -7.789 -6.318 -10.409 1.00 0.57 C ATOM 2046 CD1 LEU A 149 -8.119 -5.436 -9.206 1.00 0.62 C ATOM 2047 CD2 LEU A 149 -7.064 -5.481 -11.467 1.00 0.60 C ATOM 0 H LEU A 149 -5.873 -9.554 -9.116 1.00 0.62 H new ATOM 0 HA LEU A 149 -7.686 -7.639 -7.980 1.00 0.59 H new ATOM 0 HB2 LEU A 149 -5.928 -7.073 -9.617 1.00 0.62 H new ATOM 0 HB3 LEU A 149 -6.664 -8.115 -10.818 1.00 0.62 H new ATOM 0 HG LEU A 149 -8.712 -6.722 -10.826 1.00 0.57 H new ATOM 0 HD11 LEU A 149 -8.766 -4.618 -9.521 1.00 0.62 H new ATOM 0 HD12 LEU A 149 -8.629 -6.030 -8.448 1.00 0.62 H new ATOM 0 HD13 LEU A 149 -7.197 -5.030 -8.789 1.00 0.62 H new ATOM 0 HD21 LEU A 149 -7.707 -4.660 -11.785 1.00 0.60 H new ATOM 0 HD22 LEU A 149 -6.143 -5.079 -11.044 1.00 0.60 H new ATOM 0 HD23 LEU A 149 -6.825 -6.108 -12.326 1.00 0.60 H new ATOM 2059 N THR A 150 -8.934 -9.819 -10.109 1.00 0.72 N ATOM 2060 CA THR A 150 -10.235 -10.367 -10.571 1.00 0.79 C ATOM 2061 C THR A 150 -10.995 -10.895 -9.341 1.00 0.77 C ATOM 2062 O THR A 150 -12.201 -11.045 -9.356 1.00 0.81 O ATOM 2063 CB THR A 150 -9.980 -11.477 -11.625 1.00 0.89 C ATOM 2064 OG1 THR A 150 -11.003 -11.426 -12.608 1.00 1.24 O ATOM 2065 CG2 THR A 150 -9.957 -12.883 -11.002 1.00 1.15 C ATOM 0 H THR A 150 -8.107 -10.310 -10.450 1.00 0.72 H new ATOM 0 HA THR A 150 -10.843 -9.600 -11.050 1.00 0.79 H new ATOM 0 HB THR A 150 -9.000 -11.294 -12.066 1.00 0.89 H new ATOM 0 HG1 THR A 150 -10.847 -12.124 -13.278 1.00 1.24 H new ATOM 0 HG21 THR A 150 -9.775 -13.623 -11.781 1.00 1.15 H new ATOM 0 HG22 THR A 150 -9.163 -12.938 -10.257 1.00 1.15 H new ATOM 0 HG23 THR A 150 -10.916 -13.086 -10.526 1.00 1.15 H new ATOM 2073 N LYS A 151 -10.282 -11.173 -8.278 1.00 0.75 N ATOM 2074 CA LYS A 151 -10.932 -11.686 -7.042 1.00 0.75 C ATOM 2075 C LYS A 151 -11.480 -10.514 -6.224 1.00 0.66 C ATOM 2076 O LYS A 151 -12.543 -10.604 -5.648 1.00 0.66 O ATOM 2077 CB LYS A 151 -9.904 -12.454 -6.209 1.00 0.79 C ATOM 2078 CG LYS A 151 -10.610 -13.156 -5.049 1.00 0.90 C ATOM 2079 CD LYS A 151 -9.592 -13.486 -3.957 1.00 1.08 C ATOM 2080 CE LYS A 151 -9.790 -12.540 -2.772 1.00 1.34 C ATOM 2081 NZ LYS A 151 -10.237 -13.319 -1.583 1.00 1.79 N ATOM 0 H LYS A 151 -9.270 -11.064 -8.217 1.00 0.75 H new ATOM 0 HA LYS A 151 -11.752 -12.351 -7.313 1.00 0.75 H new ATOM 0 HB2 LYS A 151 -9.389 -13.186 -6.832 1.00 0.79 H new ATOM 0 HB3 LYS A 151 -9.146 -11.770 -5.827 1.00 0.79 H new ATOM 0 HG2 LYS A 151 -11.396 -12.516 -4.647 1.00 0.90 H new ATOM 0 HG3 LYS A 151 -11.091 -14.069 -5.401 1.00 0.90 H new ATOM 0 HD2 LYS A 151 -9.712 -14.520 -3.634 1.00 1.08 H new ATOM 0 HD3 LYS A 151 -8.579 -13.389 -4.348 1.00 1.08 H new ATOM 0 HE2 LYS A 151 -8.859 -12.019 -2.549 1.00 1.34 H new ATOM 0 HE3 LYS A 151 -10.530 -11.779 -3.020 1.00 1.34 H new ATOM 0 HZ1 LYS A 151 -10.372 -12.676 -0.777 1.00 1.79 H new ATOM 0 HZ2 LYS A 151 -11.135 -13.797 -1.799 1.00 1.79 H new ATOM 0 HZ3 LYS A 151 -9.516 -14.029 -1.342 1.00 1.79 H new ATOM 2095 N LEU A 152 -10.782 -9.406 -6.177 1.00 0.63 N ATOM 2096 CA LEU A 152 -11.306 -8.250 -5.406 1.00 0.59 C ATOM 2097 C LEU A 152 -12.577 -7.784 -6.099 1.00 0.55 C ATOM 2098 O LEU A 152 -13.521 -7.342 -5.475 1.00 0.54 O ATOM 2099 CB LEU A 152 -10.308 -7.080 -5.395 1.00 0.66 C ATOM 2100 CG LEU A 152 -8.857 -7.573 -5.387 1.00 0.61 C ATOM 2101 CD1 LEU A 152 -7.931 -6.376 -5.191 1.00 0.60 C ATOM 2102 CD2 LEU A 152 -8.643 -8.563 -4.243 1.00 0.77 C ATOM 0 H LEU A 152 -9.883 -9.258 -6.635 1.00 0.63 H new ATOM 0 HA LEU A 152 -11.483 -8.558 -4.375 1.00 0.59 H new ATOM 0 HB2 LEU A 152 -10.474 -6.452 -6.270 1.00 0.66 H new ATOM 0 HB3 LEU A 152 -10.486 -6.458 -4.518 1.00 0.66 H new ATOM 0 HG LEU A 152 -8.640 -8.070 -6.333 1.00 0.61 H new ATOM 0 HD11 LEU A 152 -6.895 -6.715 -5.184 1.00 0.60 H new ATOM 0 HD12 LEU A 152 -8.075 -5.667 -6.006 1.00 0.60 H new ATOM 0 HD13 LEU A 152 -8.161 -5.890 -4.243 1.00 0.60 H new ATOM 0 HD21 LEU A 152 -7.608 -8.906 -4.248 1.00 0.77 H new ATOM 0 HD22 LEU A 152 -8.859 -8.074 -3.293 1.00 0.77 H new ATOM 0 HD23 LEU A 152 -9.309 -9.416 -4.371 1.00 0.77 H new ATOM 2114 N GLN A 153 -12.594 -7.876 -7.399 1.00 0.62 N ATOM 2115 CA GLN A 153 -13.785 -7.435 -8.163 1.00 0.67 C ATOM 2116 C GLN A 153 -14.783 -8.590 -8.295 1.00 0.72 C ATOM 2117 O GLN A 153 -15.933 -8.389 -8.630 1.00 0.85 O ATOM 2118 CB GLN A 153 -13.353 -6.971 -9.556 1.00 0.78 C ATOM 2119 CG GLN A 153 -13.057 -5.470 -9.524 1.00 0.76 C ATOM 2120 CD GLN A 153 -13.814 -4.775 -10.657 1.00 1.00 C ATOM 2121 OE1 GLN A 153 -15.006 -4.960 -10.809 1.00 1.54 O ATOM 2122 NE2 GLN A 153 -13.169 -3.978 -11.463 1.00 1.47 N ATOM 0 H GLN A 153 -11.828 -8.240 -7.965 1.00 0.62 H new ATOM 0 HA GLN A 153 -14.263 -6.611 -7.634 1.00 0.67 H new ATOM 0 HB2 GLN A 153 -12.468 -7.520 -9.876 1.00 0.78 H new ATOM 0 HB3 GLN A 153 -14.139 -7.182 -10.281 1.00 0.78 H new ATOM 0 HG2 GLN A 153 -13.355 -5.051 -8.563 1.00 0.76 H new ATOM 0 HG3 GLN A 153 -11.986 -5.298 -9.629 1.00 0.76 H new ATOM 0 HE21 GLN A 153 -12.169 -3.823 -11.335 1.00 1.47 H new ATOM 0 HE22 GLN A 153 -13.665 -3.509 -12.221 1.00 1.47 H new ATOM 2131 N ALA A 154 -14.358 -9.798 -8.032 1.00 0.69 N ATOM 2132 CA ALA A 154 -15.293 -10.953 -8.144 1.00 0.77 C ATOM 2133 C ALA A 154 -16.043 -11.148 -6.821 1.00 0.72 C ATOM 2134 O ALA A 154 -16.678 -12.161 -6.604 1.00 1.02 O ATOM 2135 CB ALA A 154 -14.501 -12.220 -8.473 1.00 0.91 C ATOM 0 H ALA A 154 -13.408 -10.033 -7.746 1.00 0.69 H new ATOM 0 HA ALA A 154 -16.013 -10.755 -8.938 1.00 0.77 H new ATOM 0 HB1 ALA A 154 -15.184 -13.065 -8.555 1.00 0.91 H new ATOM 0 HB2 ALA A 154 -13.975 -12.085 -9.418 1.00 0.91 H new ATOM 0 HB3 ALA A 154 -13.778 -12.413 -7.680 1.00 0.91 H new ATOM 2141 N GLN A 155 -15.982 -10.189 -5.935 1.00 0.75 N ATOM 2142 CA GLN A 155 -16.697 -10.328 -4.638 1.00 0.73 C ATOM 2143 C GLN A 155 -18.015 -9.555 -4.710 1.00 0.72 C ATOM 2144 O GLN A 155 -18.166 -8.642 -5.497 1.00 0.87 O ATOM 2145 CB GLN A 155 -15.831 -9.755 -3.513 1.00 0.73 C ATOM 2146 CG GLN A 155 -14.384 -10.227 -3.679 1.00 0.83 C ATOM 2147 CD GLN A 155 -13.916 -10.903 -2.390 1.00 1.16 C ATOM 2148 OE1 GLN A 155 -14.439 -11.930 -2.004 1.00 1.74 O ATOM 2149 NE2 GLN A 155 -12.946 -10.367 -1.702 1.00 1.36 N ATOM 0 H GLN A 155 -15.467 -9.317 -6.056 1.00 0.75 H new ATOM 0 HA GLN A 155 -16.897 -11.381 -4.439 1.00 0.73 H new ATOM 0 HB2 GLN A 155 -15.872 -8.666 -3.529 1.00 0.73 H new ATOM 0 HB3 GLN A 155 -16.218 -10.074 -2.545 1.00 0.73 H new ATOM 0 HG2 GLN A 155 -14.311 -10.923 -4.514 1.00 0.83 H new ATOM 0 HG3 GLN A 155 -13.739 -9.380 -3.913 1.00 0.83 H new ATOM 0 HE21 GLN A 155 -12.507 -9.505 -2.026 1.00 1.36 H new ATOM 0 HE22 GLN A 155 -12.627 -10.810 -0.840 1.00 1.36 H new ATOM 2158 N ASN A 156 -18.973 -9.909 -3.897 1.00 0.69 N ATOM 2159 CA ASN A 156 -20.278 -9.187 -3.925 1.00 0.76 C ATOM 2160 C ASN A 156 -20.033 -7.687 -3.760 1.00 0.77 C ATOM 2161 O ASN A 156 -18.946 -7.261 -3.428 1.00 1.25 O ATOM 2162 CB ASN A 156 -21.165 -9.689 -2.785 1.00 0.86 C ATOM 2163 CG ASN A 156 -21.769 -11.043 -3.165 1.00 1.09 C ATOM 2164 OD1 ASN A 156 -22.335 -11.191 -4.230 1.00 1.80 O ATOM 2165 ND2 ASN A 156 -21.672 -12.044 -2.333 1.00 1.29 N ATOM 0 H ASN A 156 -18.909 -10.665 -3.216 1.00 0.69 H new ATOM 0 HA ASN A 156 -20.775 -9.371 -4.877 1.00 0.76 H new ATOM 0 HB2 ASN A 156 -20.580 -9.784 -1.870 1.00 0.86 H new ATOM 0 HB3 ASN A 156 -21.958 -8.969 -2.583 1.00 0.86 H new ATOM 0 HD21 ASN A 156 -22.071 -12.950 -2.577 1.00 1.29 H new ATOM 0 HD22 ASN A 156 -21.197 -11.920 -1.439 1.00 1.29 H new ATOM 2172 N GLN A 157 -21.033 -6.881 -3.989 1.00 0.79 N ATOM 2173 CA GLN A 157 -20.849 -5.409 -3.843 1.00 0.77 C ATOM 2174 C GLN A 157 -20.383 -5.100 -2.421 1.00 0.71 C ATOM 2175 O GLN A 157 -19.666 -4.149 -2.181 1.00 0.71 O ATOM 2176 CB GLN A 157 -22.179 -4.701 -4.107 1.00 0.92 C ATOM 2177 CG GLN A 157 -21.964 -3.187 -4.086 1.00 1.38 C ATOM 2178 CD GLN A 157 -22.835 -2.531 -5.159 1.00 1.76 C ATOM 2179 OE1 GLN A 157 -23.680 -3.175 -5.748 1.00 2.04 O ATOM 2180 NE2 GLN A 157 -22.663 -1.269 -5.439 1.00 2.47 N ATOM 0 H GLN A 157 -21.968 -7.177 -4.270 1.00 0.79 H new ATOM 0 HA GLN A 157 -20.104 -5.060 -4.558 1.00 0.77 H new ATOM 0 HB2 GLN A 157 -22.581 -5.008 -5.072 1.00 0.92 H new ATOM 0 HB3 GLN A 157 -22.911 -4.986 -3.351 1.00 0.92 H new ATOM 0 HG2 GLN A 157 -22.216 -2.787 -3.104 1.00 1.38 H new ATOM 0 HG3 GLN A 157 -20.914 -2.956 -4.264 1.00 1.38 H new ATOM 0 HE21 GLN A 157 -21.953 -0.729 -4.944 1.00 2.47 H new ATOM 0 HE22 GLN A 157 -23.238 -0.822 -6.153 1.00 2.47 H new ATOM 2189 N TRP A 158 -20.786 -5.901 -1.475 1.00 0.69 N ATOM 2190 CA TRP A 158 -20.373 -5.665 -0.065 1.00 0.70 C ATOM 2191 C TRP A 158 -18.865 -5.892 0.071 1.00 0.60 C ATOM 2192 O TRP A 158 -18.117 -4.995 0.404 1.00 0.60 O ATOM 2193 CB TRP A 158 -21.118 -6.642 0.845 1.00 0.80 C ATOM 2194 CG TRP A 158 -20.730 -6.399 2.268 1.00 0.86 C ATOM 2195 CD1 TRP A 158 -19.520 -6.683 2.801 1.00 0.94 C ATOM 2196 CD2 TRP A 158 -21.529 -5.832 3.346 1.00 1.31 C ATOM 2197 NE1 TRP A 158 -19.524 -6.325 4.137 1.00 1.06 N ATOM 2198 CE2 TRP A 158 -20.741 -5.796 4.520 1.00 1.32 C ATOM 2199 CE3 TRP A 158 -22.848 -5.350 3.418 1.00 1.91 C ATOM 2200 CZ2 TRP A 158 -21.242 -5.299 5.723 1.00 1.81 C ATOM 2201 CZ3 TRP A 158 -23.357 -4.849 4.628 1.00 2.46 C ATOM 2202 CH2 TRP A 158 -22.555 -4.824 5.778 1.00 2.38 C ATOM 0 H TRP A 158 -21.387 -6.713 -1.619 1.00 0.69 H new ATOM 0 HA TRP A 158 -20.611 -4.640 0.220 1.00 0.70 H new ATOM 0 HB2 TRP A 158 -22.194 -6.518 0.725 1.00 0.80 H new ATOM 0 HB3 TRP A 158 -20.882 -7.668 0.564 1.00 0.80 H new ATOM 0 HD1 TRP A 158 -18.686 -7.118 2.270 1.00 0.94 H new ATOM 0 HE1 TRP A 158 -18.726 -6.438 4.763 1.00 1.06 H new ATOM 0 HE3 TRP A 158 -23.474 -5.365 2.538 1.00 1.91 H new ATOM 0 HZ2 TRP A 158 -20.620 -5.281 6.606 1.00 1.81 H new ATOM 0 HZ3 TRP A 158 -24.371 -4.481 4.673 1.00 2.46 H new ATOM 0 HH2 TRP A 158 -22.952 -4.438 6.705 1.00 2.38 H new ATOM 2213 N LEU A 159 -18.418 -7.091 -0.181 1.00 0.59 N ATOM 2214 CA LEU A 159 -16.963 -7.390 -0.065 1.00 0.57 C ATOM 2215 C LEU A 159 -16.164 -6.470 -0.993 1.00 0.48 C ATOM 2216 O LEU A 159 -14.974 -6.287 -0.825 1.00 0.47 O ATOM 2217 CB LEU A 159 -16.719 -8.846 -0.460 1.00 0.65 C ATOM 2218 CG LEU A 159 -17.130 -9.761 0.694 1.00 0.98 C ATOM 2219 CD1 LEU A 159 -17.185 -11.209 0.203 1.00 1.53 C ATOM 2220 CD2 LEU A 159 -16.105 -9.645 1.824 1.00 1.30 C ATOM 0 H LEU A 159 -19.000 -7.880 -0.463 1.00 0.59 H new ATOM 0 HA LEU A 159 -16.641 -7.225 0.963 1.00 0.57 H new ATOM 0 HB2 LEU A 159 -17.290 -9.092 -1.355 1.00 0.65 H new ATOM 0 HB3 LEU A 159 -15.667 -8.997 -0.702 1.00 0.65 H new ATOM 0 HG LEU A 159 -18.113 -9.465 1.061 1.00 0.98 H new ATOM 0 HD11 LEU A 159 -17.478 -11.861 1.026 1.00 1.53 H new ATOM 0 HD12 LEU A 159 -17.914 -11.292 -0.603 1.00 1.53 H new ATOM 0 HD13 LEU A 159 -16.203 -11.506 -0.164 1.00 1.53 H new ATOM 0 HD21 LEU A 159 -16.396 -10.297 2.648 1.00 1.30 H new ATOM 0 HD22 LEU A 159 -15.123 -9.942 1.456 1.00 1.30 H new ATOM 0 HD23 LEU A 159 -16.065 -8.614 2.174 1.00 1.30 H new ATOM 2232 N GLN A 160 -16.804 -5.891 -1.972 1.00 0.52 N ATOM 2233 CA GLN A 160 -16.078 -4.987 -2.907 1.00 0.53 C ATOM 2234 C GLN A 160 -15.775 -3.667 -2.198 1.00 0.54 C ATOM 2235 O GLN A 160 -14.651 -3.206 -2.179 1.00 0.59 O ATOM 2236 CB GLN A 160 -16.951 -4.724 -4.137 1.00 0.66 C ATOM 2237 CG GLN A 160 -16.356 -5.437 -5.351 1.00 1.07 C ATOM 2238 CD GLN A 160 -16.899 -4.802 -6.633 1.00 1.39 C ATOM 2239 OE1 GLN A 160 -17.385 -5.490 -7.508 1.00 2.01 O ATOM 2240 NE2 GLN A 160 -16.836 -3.506 -6.781 1.00 1.96 N ATOM 0 H GLN A 160 -17.799 -6.005 -2.164 1.00 0.52 H new ATOM 0 HA GLN A 160 -15.144 -5.453 -3.220 1.00 0.53 H new ATOM 0 HB2 GLN A 160 -17.966 -5.077 -3.957 1.00 0.66 H new ATOM 0 HB3 GLN A 160 -17.015 -3.653 -4.327 1.00 0.66 H new ATOM 0 HG2 GLN A 160 -15.268 -5.367 -5.330 1.00 1.07 H new ATOM 0 HG3 GLN A 160 -16.608 -6.497 -5.323 1.00 1.07 H new ATOM 0 HE21 GLN A 160 -16.428 -2.928 -6.046 1.00 1.96 H new ATOM 0 HE22 GLN A 160 -17.195 -3.072 -7.631 1.00 1.96 H new ATOM 2249 N ASP A 161 -16.768 -3.059 -1.611 1.00 0.60 N ATOM 2250 CA ASP A 161 -16.533 -1.773 -0.899 1.00 0.69 C ATOM 2251 C ASP A 161 -15.548 -2.004 0.249 1.00 0.61 C ATOM 2252 O ASP A 161 -14.840 -1.107 0.663 1.00 0.68 O ATOM 2253 CB ASP A 161 -17.857 -1.249 -0.339 1.00 0.87 C ATOM 2254 CG ASP A 161 -17.653 0.164 0.211 1.00 1.08 C ATOM 2255 OD1 ASP A 161 -16.756 0.839 -0.264 1.00 1.31 O ATOM 2256 OD2 ASP A 161 -18.398 0.545 1.100 1.00 1.59 O ATOM 0 H ASP A 161 -17.730 -3.397 -1.594 1.00 0.60 H new ATOM 0 HA ASP A 161 -16.120 -1.041 -1.593 1.00 0.69 H new ATOM 0 HB2 ASP A 161 -18.617 -1.241 -1.120 1.00 0.87 H new ATOM 0 HB3 ASP A 161 -18.218 -1.909 0.450 1.00 0.87 H new ATOM 2261 N MET A 162 -15.497 -3.201 0.767 1.00 0.56 N ATOM 2262 CA MET A 162 -14.557 -3.487 1.886 1.00 0.57 C ATOM 2263 C MET A 162 -13.128 -3.569 1.326 1.00 0.45 C ATOM 2264 O MET A 162 -12.188 -3.094 1.927 1.00 0.43 O ATOM 2265 CB MET A 162 -14.996 -4.803 2.587 1.00 0.66 C ATOM 2266 CG MET A 162 -13.915 -5.899 2.524 1.00 0.90 C ATOM 2267 SD MET A 162 -12.583 -5.504 3.687 1.00 0.99 S ATOM 2268 CE MET A 162 -11.199 -5.681 2.533 1.00 0.57 C ATOM 0 H MET A 162 -16.065 -3.992 0.464 1.00 0.56 H new ATOM 0 HA MET A 162 -14.575 -2.693 2.632 1.00 0.57 H new ATOM 0 HB2 MET A 162 -15.234 -4.593 3.630 1.00 0.66 H new ATOM 0 HB3 MET A 162 -15.909 -5.172 2.120 1.00 0.66 H new ATOM 0 HG2 MET A 162 -14.350 -6.868 2.769 1.00 0.90 H new ATOM 0 HG3 MET A 162 -13.518 -5.975 1.512 1.00 0.90 H new ATOM 0 HE1 MET A 162 -10.415 -6.281 2.995 1.00 0.57 H new ATOM 0 HE2 MET A 162 -11.544 -6.173 1.624 1.00 0.57 H new ATOM 0 HE3 MET A 162 -10.804 -4.696 2.285 1.00 0.57 H new ATOM 2278 N THR A 163 -12.961 -4.173 0.179 1.00 0.43 N ATOM 2279 CA THR A 163 -11.598 -4.289 -0.414 1.00 0.38 C ATOM 2280 C THR A 163 -10.920 -2.914 -0.439 1.00 0.33 C ATOM 2281 O THR A 163 -9.789 -2.764 -0.026 1.00 0.37 O ATOM 2282 CB THR A 163 -11.710 -4.834 -1.841 1.00 0.41 C ATOM 2283 OG1 THR A 163 -12.475 -6.032 -1.828 1.00 0.55 O ATOM 2284 CG2 THR A 163 -10.312 -5.126 -2.390 1.00 0.47 C ATOM 0 H THR A 163 -13.710 -4.591 -0.372 1.00 0.43 H new ATOM 0 HA THR A 163 -10.999 -4.969 0.191 1.00 0.38 H new ATOM 0 HB THR A 163 -12.199 -4.095 -2.476 1.00 0.41 H new ATOM 0 HG1 THR A 163 -13.395 -5.830 -1.558 1.00 0.55 H new ATOM 0 HG21 THR A 163 -10.394 -5.514 -3.405 1.00 0.47 H new ATOM 0 HG22 THR A 163 -9.725 -4.207 -2.398 1.00 0.47 H new ATOM 0 HG23 THR A 163 -9.820 -5.865 -1.758 1.00 0.47 H new ATOM 2292 N THR A 164 -11.602 -1.909 -0.915 1.00 0.39 N ATOM 2293 CA THR A 164 -10.991 -0.549 -0.959 1.00 0.40 C ATOM 2294 C THR A 164 -10.643 -0.100 0.464 1.00 0.37 C ATOM 2295 O THR A 164 -9.665 0.587 0.690 1.00 0.41 O ATOM 2296 CB THR A 164 -11.989 0.436 -1.580 1.00 0.49 C ATOM 2297 OG1 THR A 164 -12.252 0.058 -2.924 1.00 1.36 O ATOM 2298 CG2 THR A 164 -11.408 1.852 -1.554 1.00 1.41 C ATOM 0 H THR A 164 -12.554 -1.970 -1.275 1.00 0.39 H new ATOM 0 HA THR A 164 -10.083 -0.575 -1.562 1.00 0.40 H new ATOM 0 HB THR A 164 -12.915 0.418 -1.006 1.00 0.49 H new ATOM 0 HG1 THR A 164 -12.891 0.686 -3.321 1.00 1.36 H new ATOM 0 HG21 THR A 164 -12.122 2.546 -1.997 1.00 1.41 H new ATOM 0 HG22 THR A 164 -11.209 2.145 -0.523 1.00 1.41 H new ATOM 0 HG23 THR A 164 -10.479 1.875 -2.124 1.00 1.41 H new ATOM 2306 N HIS A 165 -11.440 -0.480 1.422 1.00 0.37 N ATOM 2307 CA HIS A 165 -11.172 -0.076 2.831 1.00 0.39 C ATOM 2308 C HIS A 165 -9.840 -0.682 3.304 1.00 0.33 C ATOM 2309 O HIS A 165 -8.881 0.022 3.549 1.00 0.43 O ATOM 2310 CB HIS A 165 -12.341 -0.565 3.712 1.00 0.48 C ATOM 2311 CG HIS A 165 -11.947 -0.609 5.170 1.00 0.67 C ATOM 2312 ND1 HIS A 165 -11.625 -1.796 5.808 1.00 1.02 N ATOM 2313 CD2 HIS A 165 -11.822 0.373 6.119 1.00 1.05 C ATOM 2314 CE1 HIS A 165 -11.325 -1.502 7.085 1.00 1.50 C ATOM 2315 NE2 HIS A 165 -11.429 -0.192 7.330 1.00 1.54 N ATOM 0 H HIS A 165 -12.271 -1.057 1.289 1.00 0.37 H new ATOM 0 HA HIS A 165 -11.093 1.009 2.905 1.00 0.39 H new ATOM 0 HB2 HIS A 165 -13.197 0.097 3.584 1.00 0.48 H new ATOM 0 HB3 HIS A 165 -12.654 -1.557 3.387 1.00 0.48 H new ATOM 0 HD2 HIS A 165 -12.001 1.425 5.953 1.00 1.05 H new ATOM 0 HE1 HIS A 165 -11.035 -2.235 7.823 1.00 1.50 H new ATOM 0 HE2 HIS A 165 -11.258 0.290 8.213 1.00 1.54 H new ATOM 2323 N LEU A 166 -9.784 -1.976 3.458 1.00 0.29 N ATOM 2324 CA LEU A 166 -8.528 -2.620 3.944 1.00 0.31 C ATOM 2325 C LEU A 166 -7.321 -2.137 3.134 1.00 0.27 C ATOM 2326 O LEU A 166 -6.237 -2.000 3.665 1.00 0.30 O ATOM 2327 CB LEU A 166 -8.651 -4.140 3.832 1.00 0.40 C ATOM 2328 CG LEU A 166 -7.858 -4.803 4.961 1.00 0.99 C ATOM 2329 CD1 LEU A 166 -6.393 -4.373 4.882 1.00 1.27 C ATOM 2330 CD2 LEU A 166 -8.442 -4.377 6.310 1.00 2.12 C ATOM 0 H LEU A 166 -10.554 -2.617 3.268 1.00 0.29 H new ATOM 0 HA LEU A 166 -8.378 -2.342 4.987 1.00 0.31 H new ATOM 0 HB2 LEU A 166 -9.699 -4.435 3.888 1.00 0.40 H new ATOM 0 HB3 LEU A 166 -8.276 -4.475 2.865 1.00 0.40 H new ATOM 0 HG LEU A 166 -7.922 -5.886 4.860 1.00 0.99 H new ATOM 0 HD11 LEU A 166 -5.831 -4.847 5.687 1.00 1.27 H new ATOM 0 HD12 LEU A 166 -5.976 -4.676 3.921 1.00 1.27 H new ATOM 0 HD13 LEU A 166 -6.326 -3.290 4.981 1.00 1.27 H new ATOM 0 HD21 LEU A 166 -7.879 -4.848 7.115 1.00 2.12 H new ATOM 0 HD22 LEU A 166 -8.378 -3.293 6.408 1.00 2.12 H new ATOM 0 HD23 LEU A 166 -9.486 -4.686 6.368 1.00 2.12 H new ATOM 2342 N ILE A 167 -7.482 -1.871 1.863 1.00 0.24 N ATOM 2343 CA ILE A 167 -6.309 -1.395 1.071 1.00 0.25 C ATOM 2344 C ILE A 167 -5.773 -0.116 1.717 1.00 0.26 C ATOM 2345 O ILE A 167 -4.608 -0.015 2.042 1.00 0.35 O ATOM 2346 CB ILE A 167 -6.717 -1.108 -0.383 1.00 0.24 C ATOM 2347 CG1 ILE A 167 -7.029 -2.428 -1.091 1.00 0.27 C ATOM 2348 CG2 ILE A 167 -5.566 -0.400 -1.121 1.00 0.29 C ATOM 2349 CD1 ILE A 167 -7.725 -2.141 -2.422 1.00 0.33 C ATOM 0 H ILE A 167 -8.357 -1.960 1.347 1.00 0.24 H new ATOM 0 HA ILE A 167 -5.540 -2.168 1.064 1.00 0.25 H new ATOM 0 HB ILE A 167 -7.598 -0.466 -0.387 1.00 0.24 H new ATOM 0 HG12 ILE A 167 -6.109 -2.987 -1.263 1.00 0.27 H new ATOM 0 HG13 ILE A 167 -7.667 -3.049 -0.461 1.00 0.27 H new ATOM 0 HG21 ILE A 167 -5.863 -0.200 -2.151 1.00 0.29 H new ATOM 0 HG22 ILE A 167 -5.337 0.541 -0.620 1.00 0.29 H new ATOM 0 HG23 ILE A 167 -4.683 -1.039 -1.115 1.00 0.29 H new ATOM 0 HD11 ILE A 167 -7.947 -3.081 -2.927 1.00 0.33 H new ATOM 0 HD12 ILE A 167 -8.653 -1.600 -2.238 1.00 0.33 H new ATOM 0 HD13 ILE A 167 -7.071 -1.537 -3.052 1.00 0.33 H new ATOM 2361 N LEU A 168 -6.618 0.860 1.905 1.00 0.24 N ATOM 2362 CA LEU A 168 -6.160 2.131 2.530 1.00 0.29 C ATOM 2363 C LEU A 168 -5.717 1.861 3.972 1.00 0.29 C ATOM 2364 O LEU A 168 -5.015 2.651 4.572 1.00 0.35 O ATOM 2365 CB LEU A 168 -7.307 3.145 2.528 1.00 0.33 C ATOM 2366 CG LEU A 168 -7.875 3.275 1.112 1.00 0.53 C ATOM 2367 CD1 LEU A 168 -9.385 3.513 1.187 1.00 1.21 C ATOM 2368 CD2 LEU A 168 -7.210 4.456 0.402 1.00 0.83 C ATOM 0 H LEU A 168 -7.606 0.832 1.653 1.00 0.24 H new ATOM 0 HA LEU A 168 -5.321 2.533 1.962 1.00 0.29 H new ATOM 0 HB2 LEU A 168 -8.089 2.826 3.217 1.00 0.33 H new ATOM 0 HB3 LEU A 168 -6.950 4.114 2.878 1.00 0.33 H new ATOM 0 HG LEU A 168 -7.678 2.358 0.557 1.00 0.53 H new ATOM 0 HD11 LEU A 168 -9.789 3.606 0.179 1.00 1.21 H new ATOM 0 HD12 LEU A 168 -9.861 2.673 1.693 1.00 1.21 H new ATOM 0 HD13 LEU A 168 -9.582 4.430 1.742 1.00 1.21 H new ATOM 0 HD21 LEU A 168 -7.614 4.549 -0.606 1.00 0.83 H new ATOM 0 HD22 LEU A 168 -7.407 5.373 0.958 1.00 0.83 H new ATOM 0 HD23 LEU A 168 -6.134 4.289 0.348 1.00 0.83 H new ATOM 2380 N ARG A 169 -6.121 0.753 4.535 1.00 0.28 N ATOM 2381 CA ARG A 169 -5.720 0.439 5.936 1.00 0.32 C ATOM 2382 C ARG A 169 -4.253 0.007 5.964 1.00 0.29 C ATOM 2383 O ARG A 169 -3.516 0.340 6.872 1.00 0.29 O ATOM 2384 CB ARG A 169 -6.597 -0.692 6.474 1.00 0.38 C ATOM 2385 CG ARG A 169 -7.181 -0.285 7.828 1.00 0.64 C ATOM 2386 CD ARG A 169 -7.117 -1.473 8.789 1.00 1.22 C ATOM 2387 NE ARG A 169 -6.651 -1.007 10.125 1.00 1.56 N ATOM 2388 CZ ARG A 169 -6.807 -1.769 11.173 1.00 1.84 C ATOM 2389 NH1 ARG A 169 -6.791 -3.068 11.044 1.00 2.47 N ATOM 2390 NH2 ARG A 169 -6.979 -1.232 12.350 1.00 2.31 N ATOM 0 H ARG A 169 -6.711 0.053 4.085 1.00 0.28 H new ATOM 0 HA ARG A 169 -5.847 1.325 6.558 1.00 0.32 H new ATOM 0 HB2 ARG A 169 -7.400 -0.910 5.770 1.00 0.38 H new ATOM 0 HB3 ARG A 169 -6.009 -1.604 6.579 1.00 0.38 H new ATOM 0 HG2 ARG A 169 -6.624 0.558 8.237 1.00 0.64 H new ATOM 0 HG3 ARG A 169 -8.213 0.043 7.707 1.00 0.64 H new ATOM 0 HD2 ARG A 169 -8.099 -1.937 8.876 1.00 1.22 H new ATOM 0 HD3 ARG A 169 -6.439 -2.233 8.400 1.00 1.22 H new ATOM 0 HE ARG A 169 -6.210 -0.092 10.221 1.00 1.56 H new ATOM 0 HH11 ARG A 169 -6.657 -3.488 10.124 1.00 2.47 H new ATOM 0 HH12 ARG A 169 -6.913 -3.663 11.863 1.00 2.47 H new ATOM 0 HH21 ARG A 169 -6.991 -0.217 12.451 1.00 2.31 H new ATOM 0 HH22 ARG A 169 -7.101 -1.827 13.169 1.00 2.31 H new ATOM 2404 N SER A 170 -3.815 -0.720 4.970 1.00 0.31 N ATOM 2405 CA SER A 170 -2.398 -1.152 4.943 1.00 0.32 C ATOM 2406 C SER A 170 -1.550 0.044 4.541 1.00 0.29 C ATOM 2407 O SER A 170 -0.557 0.349 5.153 1.00 0.30 O ATOM 2408 CB SER A 170 -2.223 -2.278 3.924 1.00 0.36 C ATOM 2409 OG SER A 170 -1.492 -3.342 4.520 1.00 1.00 O ATOM 0 H SER A 170 -4.380 -1.030 4.180 1.00 0.31 H new ATOM 0 HA SER A 170 -2.093 -1.519 5.923 1.00 0.32 H new ATOM 0 HB2 SER A 170 -3.197 -2.634 3.588 1.00 0.36 H new ATOM 0 HB3 SER A 170 -1.697 -1.909 3.044 1.00 0.36 H new ATOM 0 HG SER A 170 -1.379 -4.066 3.869 1.00 1.00 H new ATOM 2415 N PHE A 171 -1.945 0.745 3.520 1.00 0.28 N ATOM 2416 CA PHE A 171 -1.160 1.933 3.097 1.00 0.27 C ATOM 2417 C PHE A 171 -0.934 2.846 4.302 1.00 0.27 C ATOM 2418 O PHE A 171 0.158 3.302 4.543 1.00 0.28 O ATOM 2419 CB PHE A 171 -1.919 2.682 2.006 1.00 0.28 C ATOM 2420 CG PHE A 171 -1.579 2.058 0.680 1.00 0.28 C ATOM 2421 CD1 PHE A 171 -1.989 0.750 0.399 1.00 0.84 C ATOM 2422 CD2 PHE A 171 -0.842 2.780 -0.262 1.00 0.88 C ATOM 2423 CE1 PHE A 171 -1.658 0.162 -0.826 1.00 0.81 C ATOM 2424 CE2 PHE A 171 -0.513 2.195 -1.488 1.00 0.92 C ATOM 2425 CZ PHE A 171 -0.919 0.886 -1.771 1.00 0.31 C ATOM 0 H PHE A 171 -2.775 0.548 2.961 1.00 0.28 H new ATOM 0 HA PHE A 171 -0.194 1.616 2.703 1.00 0.27 H new ATOM 0 HB2 PHE A 171 -2.993 2.629 2.186 1.00 0.28 H new ATOM 0 HB3 PHE A 171 -1.646 3.737 2.010 1.00 0.28 H new ATOM 0 HD1 PHE A 171 -2.561 0.195 1.128 1.00 0.84 H new ATOM 0 HD2 PHE A 171 -0.527 3.789 -0.043 1.00 0.88 H new ATOM 0 HE1 PHE A 171 -1.971 -0.848 -1.043 1.00 0.81 H new ATOM 0 HE2 PHE A 171 0.055 2.754 -2.217 1.00 0.92 H new ATOM 0 HZ PHE A 171 -0.663 0.434 -2.718 1.00 0.31 H new ATOM 2435 N LYS A 172 -1.952 3.100 5.071 1.00 0.30 N ATOM 2436 CA LYS A 172 -1.771 3.973 6.262 1.00 0.32 C ATOM 2437 C LYS A 172 -0.699 3.374 7.183 1.00 0.31 C ATOM 2438 O LYS A 172 0.351 3.952 7.390 1.00 0.31 O ATOM 2439 CB LYS A 172 -3.094 4.081 7.023 1.00 0.37 C ATOM 2440 CG LYS A 172 -3.165 5.435 7.732 1.00 0.93 C ATOM 2441 CD LYS A 172 -3.683 6.495 6.758 1.00 0.74 C ATOM 2442 CE LYS A 172 -4.671 7.412 7.480 1.00 1.15 C ATOM 2443 NZ LYS A 172 -4.363 8.833 7.150 1.00 1.83 N ATOM 0 H LYS A 172 -2.897 2.744 4.929 1.00 0.30 H new ATOM 0 HA LYS A 172 -1.456 4.965 5.937 1.00 0.32 H new ATOM 0 HB2 LYS A 172 -3.932 3.975 6.334 1.00 0.37 H new ATOM 0 HB3 LYS A 172 -3.175 3.273 7.750 1.00 0.37 H new ATOM 0 HG2 LYS A 172 -3.823 5.370 8.598 1.00 0.93 H new ATOM 0 HG3 LYS A 172 -2.179 5.716 8.101 1.00 0.93 H new ATOM 0 HD2 LYS A 172 -2.851 7.078 6.363 1.00 0.74 H new ATOM 0 HD3 LYS A 172 -4.169 6.016 5.908 1.00 0.74 H new ATOM 0 HE2 LYS A 172 -5.691 7.171 7.182 1.00 1.15 H new ATOM 0 HE3 LYS A 172 -4.608 7.256 8.557 1.00 1.15 H new ATOM 0 HZ1 LYS A 172 -5.035 9.457 7.641 1.00 1.83 H new ATOM 0 HZ2 LYS A 172 -3.395 9.058 7.455 1.00 1.83 H new ATOM 0 HZ3 LYS A 172 -4.444 8.976 6.123 1.00 1.83 H new ATOM 2457 N GLU A 173 -0.958 2.220 7.741 1.00 0.33 N ATOM 2458 CA GLU A 173 0.042 1.590 8.656 1.00 0.34 C ATOM 2459 C GLU A 173 1.252 1.094 7.858 1.00 0.32 C ATOM 2460 O GLU A 173 2.339 1.615 7.988 1.00 0.33 O ATOM 2461 CB GLU A 173 -0.608 0.408 9.379 1.00 0.37 C ATOM 2462 CG GLU A 173 -0.644 0.685 10.883 1.00 0.83 C ATOM 2463 CD GLU A 173 -1.006 -0.600 11.630 1.00 1.41 C ATOM 2464 OE1 GLU A 173 -0.701 -1.665 11.119 1.00 2.02 O ATOM 2465 OE2 GLU A 173 -1.582 -0.498 12.701 1.00 2.06 O ATOM 0 H GLU A 173 -1.817 1.687 7.604 1.00 0.33 H new ATOM 0 HA GLU A 173 0.376 2.331 9.382 1.00 0.34 H new ATOM 0 HB2 GLU A 173 -1.619 0.250 9.004 1.00 0.37 H new ATOM 0 HB3 GLU A 173 -0.048 -0.506 9.180 1.00 0.37 H new ATOM 0 HG2 GLU A 173 0.325 1.053 11.219 1.00 0.83 H new ATOM 0 HG3 GLU A 173 -1.374 1.464 11.103 1.00 0.83 H new ATOM 2472 N PHE A 174 1.060 0.078 7.051 1.00 0.31 N ATOM 2473 CA PHE A 174 2.174 -0.506 6.225 1.00 0.32 C ATOM 2474 C PHE A 174 3.173 0.570 5.765 1.00 0.31 C ATOM 2475 O PHE A 174 4.349 0.500 6.068 1.00 0.34 O ATOM 2476 CB PHE A 174 1.567 -1.185 4.994 1.00 0.32 C ATOM 2477 CG PHE A 174 2.456 -2.313 4.544 1.00 0.41 C ATOM 2478 CD1 PHE A 174 3.734 -2.036 4.052 1.00 1.18 C ATOM 2479 CD2 PHE A 174 2.001 -3.634 4.617 1.00 1.23 C ATOM 2480 CE1 PHE A 174 4.564 -3.081 3.633 1.00 1.24 C ATOM 2481 CE2 PHE A 174 2.830 -4.682 4.197 1.00 1.30 C ATOM 2482 CZ PHE A 174 4.113 -4.404 3.705 1.00 0.71 C ATOM 0 H PHE A 174 0.159 -0.384 6.925 1.00 0.31 H new ATOM 0 HA PHE A 174 2.716 -1.223 6.842 1.00 0.32 H new ATOM 0 HB2 PHE A 174 0.573 -1.565 5.230 1.00 0.32 H new ATOM 0 HB3 PHE A 174 1.448 -0.460 4.189 1.00 0.32 H new ATOM 0 HD1 PHE A 174 4.081 -1.015 3.995 1.00 1.18 H new ATOM 0 HD2 PHE A 174 1.012 -3.845 4.997 1.00 1.23 H new ATOM 0 HE1 PHE A 174 5.552 -2.867 3.254 1.00 1.24 H new ATOM 0 HE2 PHE A 174 2.481 -5.703 4.252 1.00 1.30 H new ATOM 0 HZ PHE A 174 4.754 -5.211 3.381 1.00 0.71 H new ATOM 2492 N LEU A 175 2.727 1.561 5.038 1.00 0.28 N ATOM 2493 CA LEU A 175 3.675 2.617 4.574 1.00 0.29 C ATOM 2494 C LEU A 175 4.296 3.316 5.788 1.00 0.30 C ATOM 2495 O LEU A 175 5.480 3.586 5.819 1.00 0.31 O ATOM 2496 CB LEU A 175 2.928 3.651 3.731 1.00 0.29 C ATOM 2497 CG LEU A 175 2.480 3.023 2.406 1.00 0.32 C ATOM 2498 CD1 LEU A 175 1.332 3.840 1.812 1.00 0.34 C ATOM 2499 CD2 LEU A 175 3.646 3.023 1.416 1.00 0.33 C ATOM 0 H LEU A 175 1.757 1.685 4.748 1.00 0.28 H new ATOM 0 HA LEU A 175 4.458 2.154 3.973 1.00 0.29 H new ATOM 0 HB2 LEU A 175 2.061 4.021 4.279 1.00 0.29 H new ATOM 0 HB3 LEU A 175 3.573 4.508 3.537 1.00 0.29 H new ATOM 0 HG LEU A 175 2.151 2.001 2.592 1.00 0.32 H new ATOM 0 HD11 LEU A 175 1.015 3.392 0.870 1.00 0.34 H new ATOM 0 HD12 LEU A 175 0.494 3.850 2.509 1.00 0.34 H new ATOM 0 HD13 LEU A 175 1.667 4.862 1.633 1.00 0.34 H new ATOM 0 HD21 LEU A 175 3.325 2.576 0.475 1.00 0.33 H new ATOM 0 HD22 LEU A 175 3.972 4.048 1.238 1.00 0.33 H new ATOM 0 HD23 LEU A 175 4.473 2.445 1.828 1.00 0.33 H new ATOM 2511 N GLN A 176 3.506 3.618 6.787 1.00 0.30 N ATOM 2512 CA GLN A 176 4.052 4.308 7.997 1.00 0.31 C ATOM 2513 C GLN A 176 5.318 3.593 8.488 1.00 0.31 C ATOM 2514 O GLN A 176 6.372 4.188 8.606 1.00 0.36 O ATOM 2515 CB GLN A 176 2.999 4.294 9.107 1.00 0.34 C ATOM 2516 CG GLN A 176 2.428 5.701 9.289 1.00 0.46 C ATOM 2517 CD GLN A 176 1.769 5.810 10.666 1.00 0.86 C ATOM 2518 OE1 GLN A 176 0.757 5.188 10.918 1.00 1.64 O ATOM 2519 NE2 GLN A 176 2.305 6.581 11.573 1.00 1.39 N ATOM 0 H GLN A 176 2.506 3.417 6.818 1.00 0.30 H new ATOM 0 HA GLN A 176 4.303 5.336 7.737 1.00 0.31 H new ATOM 0 HB2 GLN A 176 2.200 3.596 8.856 1.00 0.34 H new ATOM 0 HB3 GLN A 176 3.444 3.947 10.040 1.00 0.34 H new ATOM 0 HG2 GLN A 176 3.222 6.442 9.194 1.00 0.46 H new ATOM 0 HG3 GLN A 176 1.699 5.913 8.507 1.00 0.46 H new ATOM 0 HE21 GLN A 176 3.155 7.103 11.361 1.00 1.39 H new ATOM 0 HE22 GLN A 176 1.874 6.661 12.494 1.00 1.39 H new ATOM 2528 N SER A 177 5.223 2.324 8.777 1.00 0.38 N ATOM 2529 CA SER A 177 6.417 1.576 9.261 1.00 0.40 C ATOM 2530 C SER A 177 7.534 1.671 8.220 1.00 0.36 C ATOM 2531 O SER A 177 8.701 1.694 8.551 1.00 0.36 O ATOM 2532 CB SER A 177 6.046 0.108 9.479 1.00 0.47 C ATOM 2533 OG SER A 177 5.183 0.004 10.603 1.00 0.96 O ATOM 0 H SER A 177 4.369 1.772 8.699 1.00 0.38 H new ATOM 0 HA SER A 177 6.759 2.007 10.202 1.00 0.40 H new ATOM 0 HB2 SER A 177 5.555 -0.291 8.591 1.00 0.47 H new ATOM 0 HB3 SER A 177 6.945 -0.486 9.640 1.00 0.47 H new ATOM 0 HG SER A 177 5.541 -0.659 11.230 1.00 0.96 H new ATOM 2539 N SER A 178 7.185 1.724 6.964 1.00 0.36 N ATOM 2540 CA SER A 178 8.231 1.815 5.906 1.00 0.36 C ATOM 2541 C SER A 178 9.061 3.087 6.113 1.00 0.34 C ATOM 2542 O SER A 178 10.254 3.103 5.885 1.00 0.40 O ATOM 2543 CB SER A 178 7.564 1.859 4.530 1.00 0.44 C ATOM 2544 OG SER A 178 8.566 1.848 3.522 1.00 1.42 O ATOM 0 H SER A 178 6.223 1.708 6.625 1.00 0.36 H new ATOM 0 HA SER A 178 8.883 0.943 5.966 1.00 0.36 H new ATOM 0 HB2 SER A 178 6.899 1.004 4.408 1.00 0.44 H new ATOM 0 HB3 SER A 178 6.950 2.755 4.439 1.00 0.44 H new ATOM 0 HG SER A 178 8.142 1.875 2.639 1.00 1.42 H new ATOM 2550 N LEU A 179 8.439 4.152 6.540 1.00 0.34 N ATOM 2551 CA LEU A 179 9.191 5.421 6.757 1.00 0.35 C ATOM 2552 C LEU A 179 10.095 5.281 7.985 1.00 0.33 C ATOM 2553 O LEU A 179 11.260 5.626 7.952 1.00 0.37 O ATOM 2554 CB LEU A 179 8.202 6.566 6.983 1.00 0.42 C ATOM 2555 CG LEU A 179 7.674 7.057 5.635 1.00 0.71 C ATOM 2556 CD1 LEU A 179 6.355 6.353 5.315 1.00 1.20 C ATOM 2557 CD2 LEU A 179 7.439 8.568 5.701 1.00 1.07 C ATOM 0 H LEU A 179 7.442 4.198 6.748 1.00 0.34 H new ATOM 0 HA LEU A 179 9.802 5.633 5.880 1.00 0.35 H new ATOM 0 HB2 LEU A 179 7.375 6.229 7.608 1.00 0.42 H new ATOM 0 HB3 LEU A 179 8.690 7.383 7.514 1.00 0.42 H new ATOM 0 HG LEU A 179 8.404 6.833 4.857 1.00 0.71 H new ATOM 0 HD11 LEU A 179 5.979 6.704 4.354 1.00 1.20 H new ATOM 0 HD12 LEU A 179 6.519 5.276 5.270 1.00 1.20 H new ATOM 0 HD13 LEU A 179 5.625 6.576 6.093 1.00 1.20 H new ATOM 0 HD21 LEU A 179 7.062 8.920 4.741 1.00 1.07 H new ATOM 0 HD22 LEU A 179 6.709 8.789 6.480 1.00 1.07 H new ATOM 0 HD23 LEU A 179 8.378 9.073 5.930 1.00 1.07 H new ATOM 2569 N ARG A 180 9.567 4.784 9.070 1.00 0.37 N ATOM 2570 CA ARG A 180 10.397 4.629 10.300 1.00 0.42 C ATOM 2571 C ARG A 180 11.496 3.588 10.064 1.00 0.38 C ATOM 2572 O ARG A 180 12.473 3.531 10.786 1.00 0.47 O ATOM 2573 CB ARG A 180 9.507 4.173 11.459 1.00 0.49 C ATOM 2574 CG ARG A 180 9.129 5.382 12.317 1.00 1.03 C ATOM 2575 CD ARG A 180 8.007 4.992 13.282 1.00 1.31 C ATOM 2576 NE ARG A 180 8.219 5.672 14.590 1.00 1.89 N ATOM 2577 CZ ARG A 180 7.433 5.404 15.598 1.00 2.45 C ATOM 2578 NH1 ARG A 180 6.161 5.686 15.526 1.00 2.78 N ATOM 2579 NH2 ARG A 180 7.920 4.853 16.677 1.00 3.28 N ATOM 0 H ARG A 180 8.598 4.479 9.159 1.00 0.37 H new ATOM 0 HA ARG A 180 10.858 5.587 10.543 1.00 0.42 H new ATOM 0 HB2 ARG A 180 8.608 3.691 11.074 1.00 0.49 H new ATOM 0 HB3 ARG A 180 10.031 3.433 12.064 1.00 0.49 H new ATOM 0 HG2 ARG A 180 9.998 5.731 12.875 1.00 1.03 H new ATOM 0 HG3 ARG A 180 8.806 6.206 11.681 1.00 1.03 H new ATOM 0 HD2 ARG A 180 7.040 5.274 12.866 1.00 1.31 H new ATOM 0 HD3 ARG A 180 7.991 3.911 13.420 1.00 1.31 H new ATOM 0 HE ARG A 180 8.977 6.346 14.698 1.00 1.89 H new ATOM 0 HH11 ARG A 180 5.781 6.116 14.683 1.00 2.78 H new ATOM 0 HH12 ARG A 180 5.547 5.477 16.313 1.00 2.78 H new ATOM 0 HH21 ARG A 180 8.914 4.632 16.733 1.00 3.28 H new ATOM 0 HH22 ARG A 180 7.306 4.644 17.464 1.00 3.28 H new ATOM 2593 N ALA A 181 11.350 2.765 9.061 1.00 0.37 N ATOM 2594 CA ALA A 181 12.388 1.735 8.789 1.00 0.42 C ATOM 2595 C ALA A 181 13.500 2.357 7.949 1.00 0.45 C ATOM 2596 O ALA A 181 14.658 2.013 8.078 1.00 0.53 O ATOM 2597 CB ALA A 181 11.761 0.567 8.026 1.00 0.49 C ATOM 0 H ALA A 181 10.557 2.763 8.420 1.00 0.37 H new ATOM 0 HA ALA A 181 12.800 1.370 9.730 1.00 0.42 H new ATOM 0 HB1 ALA A 181 12.522 -0.188 7.827 1.00 0.49 H new ATOM 0 HB2 ALA A 181 10.963 0.128 8.624 1.00 0.49 H new ATOM 0 HB3 ALA A 181 11.351 0.927 7.082 1.00 0.49 H new ATOM 2603 N LEU A 182 13.157 3.275 7.090 1.00 0.46 N ATOM 2604 CA LEU A 182 14.195 3.922 6.245 1.00 0.56 C ATOM 2605 C LEU A 182 14.952 4.955 7.080 1.00 0.59 C ATOM 2606 O LEU A 182 16.092 5.276 6.808 1.00 0.72 O ATOM 2607 CB LEU A 182 13.530 4.612 5.053 1.00 0.65 C ATOM 2608 CG LEU A 182 13.706 3.748 3.805 1.00 0.92 C ATOM 2609 CD1 LEU A 182 12.460 2.884 3.599 1.00 1.69 C ATOM 2610 CD2 LEU A 182 13.908 4.650 2.586 1.00 1.04 C ATOM 0 H LEU A 182 12.204 3.604 6.937 1.00 0.46 H new ATOM 0 HA LEU A 182 14.891 3.167 5.879 1.00 0.56 H new ATOM 0 HB2 LEU A 182 12.470 4.769 5.254 1.00 0.65 H new ATOM 0 HB3 LEU A 182 13.973 5.595 4.894 1.00 0.65 H new ATOM 0 HG LEU A 182 14.576 3.104 3.930 1.00 0.92 H new ATOM 0 HD11 LEU A 182 12.587 2.268 2.708 1.00 1.69 H new ATOM 0 HD12 LEU A 182 12.316 2.241 4.467 1.00 1.69 H new ATOM 0 HD13 LEU A 182 11.588 3.526 3.474 1.00 1.69 H new ATOM 0 HD21 LEU A 182 14.034 4.035 1.695 1.00 1.04 H new ATOM 0 HD22 LEU A 182 13.038 5.295 2.462 1.00 1.04 H new ATOM 0 HD23 LEU A 182 14.797 5.264 2.731 1.00 1.04 H new ATOM 2622 N ARG A 183 14.326 5.475 8.101 1.00 0.55 N ATOM 2623 CA ARG A 183 15.007 6.483 8.959 1.00 0.63 C ATOM 2624 C ARG A 183 15.837 5.760 10.022 1.00 0.64 C ATOM 2625 O ARG A 183 16.862 6.244 10.458 1.00 0.76 O ATOM 2626 CB ARG A 183 13.959 7.366 9.640 1.00 0.66 C ATOM 2627 CG ARG A 183 14.484 8.799 9.740 1.00 1.21 C ATOM 2628 CD ARG A 183 13.429 9.684 10.406 1.00 1.60 C ATOM 2629 NE ARG A 183 13.899 11.098 10.411 1.00 1.94 N ATOM 2630 CZ ARG A 183 13.377 11.956 11.243 1.00 2.45 C ATOM 2631 NH1 ARG A 183 13.354 11.695 12.521 1.00 2.87 N ATOM 2632 NH2 ARG A 183 12.877 13.076 10.796 1.00 3.20 N ATOM 0 H ARG A 183 13.372 5.244 8.377 1.00 0.55 H new ATOM 0 HA ARG A 183 15.659 7.106 8.347 1.00 0.63 H new ATOM 0 HB2 ARG A 183 13.029 7.347 9.073 1.00 0.66 H new ATOM 0 HB3 ARG A 183 13.734 6.980 10.634 1.00 0.66 H new ATOM 0 HG2 ARG A 183 15.408 8.819 10.318 1.00 1.21 H new ATOM 0 HG3 ARG A 183 14.720 9.181 8.747 1.00 1.21 H new ATOM 0 HD2 ARG A 183 12.483 9.606 9.871 1.00 1.60 H new ATOM 0 HD3 ARG A 183 13.247 9.346 11.426 1.00 1.60 H new ATOM 0 HE ARG A 183 14.629 11.395 9.764 1.00 1.94 H new ATOM 0 HH11 ARG A 183 13.744 10.820 12.870 1.00 2.87 H new ATOM 0 HH12 ARG A 183 12.946 12.366 13.171 1.00 2.87 H new ATOM 0 HH21 ARG A 183 12.895 13.280 9.797 1.00 3.20 H new ATOM 0 HH22 ARG A 183 12.469 13.748 11.446 1.00 3.20 H new ATOM 2646 N GLN A 184 15.403 4.601 10.438 1.00 0.57 N ATOM 2647 CA GLN A 184 16.168 3.844 11.469 1.00 0.62 C ATOM 2648 C GLN A 184 17.342 3.126 10.802 1.00 0.65 C ATOM 2649 O GLN A 184 18.332 2.815 11.434 1.00 0.76 O ATOM 2650 CB GLN A 184 15.250 2.814 12.130 1.00 0.64 C ATOM 2651 CG GLN A 184 14.427 3.492 13.226 1.00 1.16 C ATOM 2652 CD GLN A 184 15.201 3.452 14.544 1.00 1.37 C ATOM 2653 OE1 GLN A 184 16.313 3.933 14.624 1.00 2.04 O ATOM 2654 NE2 GLN A 184 14.655 2.893 15.590 1.00 1.76 N ATOM 0 H GLN A 184 14.552 4.146 10.108 1.00 0.57 H new ATOM 0 HA GLN A 184 16.544 4.534 12.225 1.00 0.62 H new ATOM 0 HB2 GLN A 184 14.589 2.370 11.386 1.00 0.64 H new ATOM 0 HB3 GLN A 184 15.842 2.003 12.554 1.00 0.64 H new ATOM 0 HG2 GLN A 184 14.213 4.524 12.949 1.00 1.16 H new ATOM 0 HG3 GLN A 184 13.468 2.987 13.340 1.00 1.16 H new ATOM 0 HE21 GLN A 184 13.721 2.489 15.523 1.00 1.76 H new ATOM 0 HE22 GLN A 184 15.163 2.860 16.474 1.00 1.76 H new ATOM 2663 N MET A 185 17.240 2.860 9.528 1.00 0.62 N ATOM 2664 CA MET A 185 18.349 2.161 8.821 1.00 0.71 C ATOM 2665 C MET A 185 19.650 2.942 9.013 1.00 0.99 C ATOM 2666 O MET A 185 19.572 4.115 9.340 1.00 1.59 O ATOM 2667 CB MET A 185 18.024 2.068 7.329 1.00 1.04 C ATOM 2668 CG MET A 185 17.189 0.813 7.066 1.00 0.66 C ATOM 2669 SD MET A 185 16.378 0.954 5.454 1.00 1.19 S ATOM 2670 CE MET A 185 14.962 -0.112 5.822 1.00 0.60 C ATOM 2671 OXT MET A 185 20.703 2.354 8.829 1.00 1.59 O ATOM 0 H MET A 185 16.436 3.097 8.947 1.00 0.62 H new ATOM 0 HA MET A 185 18.465 1.158 9.230 1.00 0.71 H new ATOM 0 HB2 MET A 185 17.477 2.955 7.009 1.00 1.04 H new ATOM 0 HB3 MET A 185 18.945 2.034 6.747 1.00 1.04 H new ATOM 0 HG2 MET A 185 17.826 -0.072 7.089 1.00 0.66 H new ATOM 0 HG3 MET A 185 16.443 0.689 7.851 1.00 0.66 H new ATOM 0 HE1 MET A 185 14.131 0.148 5.167 1.00 0.60 H new ATOM 0 HE2 MET A 185 15.239 -1.154 5.661 1.00 0.60 H new ATOM 0 HE3 MET A 185 14.662 0.027 6.861 1.00 0.60 H new TER 2681 MET A 185 CONECT 425 513 CONECT 513 425 CONECT 850 993 CONECT 993 850 END