USER MOD reduce.3.24.130724 H: found=0, std=0, add=1225, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1222 hydrogens (0 hets) 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 98 THR OG1 : rot 180:sc= 0.00268 USER MOD Set 1.2: A 101 CYS SG : rot -57:sc= 1.21 USER MOD Set 2.1: A 7 THR OG1 : rot 180:sc= 0.0411 USER MOD Set 2.2: A 55 LYS NZ :NH3+ 169:sc= -0.184 (180deg=-0.473) USER MOD Set 3.1: A 35 LYS NZ :NH3+ -157:sc= -0.0233 (180deg=-0.288) USER MOD Set 3.2: A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 166:sc= 0.908 (180deg=0.405!) USER MOD Single : A 8 THR OG1 : rot -32:sc= 0.421 USER MOD Single : A 18 SER OG : rot -60:sc= 0.286 USER MOD Single : A 25 HIS :FLIP no HD1:sc= -0.163 F(o=-1.5,f=-0.16) USER MOD Single : A 27 LYS NZ :NH3+ -124:sc= -0.0641 (180deg=-0.592) USER MOD Single : A 30 LYS NZ :NH3+ -150:sc= -1.7! (180deg=-2.38!) USER MOD Single : A 33 TYR OH : rot 180:sc= -0.0492 USER MOD Single : A 34 CYS SG : rot 180:sc= -0.207 USER MOD Single : A 36 ASN :FLIP amide:sc= -6.73! C(o=-9.1!,f=-6.7!) USER MOD Single : A 44 HIS : no HD1:sc= 0.313 K(o=0.31,f=-1.9!) USER MOD Single : A 56 SER OG : rot -5:sc= 0.495 USER MOD Single : A 59 HIS : no HD1:sc=-0.000337 X(o=-0.00034,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 SER OG : rot 180:sc= -0.476 USER MOD Single : A 75 LYS NZ :NH3+ -153:sc= -0.0803 (180deg=-0.572) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN :FLIP amide:sc= -1.23 F(o=-2.3!,f=-1.2) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl 146:sc= -0.227 (180deg=-1.52!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 107:sc= 0.4 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 44:sc= 0.12 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= -2.34 K(o=-2.3,f=-4.8!) USER MOD Single : A 111 ASN :FLIP amide:sc= -1.31 F(o=-3.3!,f=-1.3) USER MOD Single : A 113 ASN :FLIP amide:sc= -0.187 F(o=-4.9!,f=-0.19) USER MOD Single : A 114 THR OG1 : rot -71:sc= 0.489 USER MOD Single : A 115 TYR OH : rot 30:sc= 0 USER MOD Single : A 117 SER OG : rot 140:sc= -0.124 USER MOD Single : A 119 LYS NZ :NH3+ 164:sc=-0.00561 (180deg=-0.3) USER MOD Single : A 120 TYR OH : rot 180:sc= -0.176 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 THR OG1 : rot 4:sc= 0.902! USER MOD Single : A 132 GLN : amide:sc= -0.175 K(o=-0.18,f=-0.97) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ -138:sc= -2.78! (180deg=-4.95!) USER MOD Single : A 137 SER OG : rot 180:sc= -1.52! USER MOD Single : A 138 LYS NZ :NH3+ 164:sc= -0.515 (180deg=-1.35!) USER MOD Single : A 139 THR OG1 : rot -79:sc= 1.25 USER MOD Single : A 143 GLN : amide:sc= -1.01 K(o=-1,f=-3.1) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 151:sc= -1.06 (180deg=-1.15) USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.844 17.214 -8.089 1.00 0.00 N ATOM 2 CA MET A 1 13.460 15.922 -7.677 1.00 0.00 C ATOM 3 C MET A 1 14.051 16.062 -6.273 1.00 0.00 C ATOM 4 O MET A 1 14.866 15.267 -5.850 1.00 0.00 O ATOM 5 CB MET A 1 14.570 15.550 -8.663 1.00 0.00 C ATOM 6 CG MET A 1 15.179 16.823 -9.251 1.00 0.00 C ATOM 7 SD MET A 1 15.652 17.942 -7.908 1.00 0.00 S ATOM 8 CE MET A 1 17.092 18.677 -8.721 1.00 0.00 C ATOM 0 H1 MET A 1 12.657 17.199 -9.112 1.00 0.00 H new ATOM 0 H2 MET A 1 11.950 17.352 -7.575 1.00 0.00 H new ATOM 0 H3 MET A 1 13.494 17.995 -7.868 1.00 0.00 H new ATOM 0 HA MET A 1 12.699 15.142 -7.674 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.339 14.966 -8.157 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.168 14.925 -9.460 1.00 0.00 H new ATOM 0 HG2 MET A 1 16.051 16.576 -9.857 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.461 17.312 -9.910 1.00 0.00 H new ATOM 0 HE1 MET A 1 17.548 19.412 -8.058 1.00 0.00 H new ATOM 0 HE2 MET A 1 17.817 17.897 -8.952 1.00 0.00 H new ATOM 0 HE3 MET A 1 16.779 19.166 -9.644 1.00 0.00 H new ATOM 20 N ALA A 2 13.648 17.069 -5.547 1.00 0.00 N ATOM 21 CA ALA A 2 14.186 17.259 -4.172 1.00 0.00 C ATOM 22 C ALA A 2 14.129 15.932 -3.413 1.00 0.00 C ATOM 23 O ALA A 2 13.107 15.277 -3.366 1.00 0.00 O ATOM 24 CB ALA A 2 13.347 18.304 -3.435 1.00 0.00 C ATOM 0 H ALA A 2 12.969 17.768 -5.848 1.00 0.00 H new ATOM 0 HA ALA A 2 15.220 17.599 -4.231 1.00 0.00 H new ATOM 0 HB1 ALA A 2 13.741 18.443 -2.428 1.00 0.00 H new ATOM 0 HB2 ALA A 2 13.388 19.250 -3.975 1.00 0.00 H new ATOM 0 HB3 ALA A 2 12.313 17.965 -3.376 1.00 0.00 H new ATOM 30 N GLU A 3 15.220 15.529 -2.820 1.00 0.00 N ATOM 31 CA GLU A 3 15.226 14.244 -2.065 1.00 0.00 C ATOM 32 C GLU A 3 14.881 14.513 -0.598 1.00 0.00 C ATOM 33 O GLU A 3 15.718 14.919 0.183 1.00 0.00 O ATOM 34 CB GLU A 3 16.616 13.609 -2.153 1.00 0.00 C ATOM 35 CG GLU A 3 17.028 13.486 -3.621 1.00 0.00 C ATOM 36 CD GLU A 3 18.290 14.315 -3.868 1.00 0.00 C ATOM 37 OE1 GLU A 3 19.229 14.172 -3.101 1.00 0.00 O ATOM 38 OE2 GLU A 3 18.296 15.079 -4.819 1.00 0.00 O ATOM 0 H GLU A 3 16.106 16.034 -2.826 1.00 0.00 H new ATOM 0 HA GLU A 3 14.488 13.566 -2.494 1.00 0.00 H new ATOM 0 HB2 GLU A 3 17.340 14.217 -1.611 1.00 0.00 H new ATOM 0 HB3 GLU A 3 16.609 12.626 -1.682 1.00 0.00 H new ATOM 0 HG2 GLU A 3 17.211 12.441 -3.872 1.00 0.00 H new ATOM 0 HG3 GLU A 3 16.221 13.832 -4.267 1.00 0.00 H new ATOM 45 N GLY A 4 13.652 14.289 -0.219 1.00 0.00 N ATOM 46 CA GLY A 4 13.254 14.532 1.197 1.00 0.00 C ATOM 47 C GLY A 4 13.717 13.362 2.066 1.00 0.00 C ATOM 48 O GLY A 4 13.811 13.474 3.272 1.00 0.00 O ATOM 0 H GLY A 4 12.907 13.949 -0.828 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.696 15.462 1.555 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.172 14.645 1.267 1.00 0.00 H new ATOM 52 N GLU A 5 14.005 12.240 1.460 1.00 0.00 N ATOM 53 CA GLU A 5 14.462 11.056 2.245 1.00 0.00 C ATOM 54 C GLU A 5 15.576 10.339 1.479 1.00 0.00 C ATOM 55 O GLU A 5 16.105 10.850 0.511 1.00 0.00 O ATOM 56 CB GLU A 5 13.290 10.094 2.452 1.00 0.00 C ATOM 57 CG GLU A 5 12.100 10.852 3.045 1.00 0.00 C ATOM 58 CD GLU A 5 12.508 11.483 4.379 1.00 0.00 C ATOM 59 OE1 GLU A 5 13.370 10.924 5.036 1.00 0.00 O ATOM 60 OE2 GLU A 5 11.951 12.513 4.719 1.00 0.00 O ATOM 0 H GLU A 5 13.943 12.093 0.453 1.00 0.00 H new ATOM 0 HA GLU A 5 14.836 11.386 3.214 1.00 0.00 H new ATOM 0 HB2 GLU A 5 13.008 9.640 1.502 1.00 0.00 H new ATOM 0 HB3 GLU A 5 13.586 9.283 3.118 1.00 0.00 H new ATOM 0 HG2 GLU A 5 11.766 11.625 2.352 1.00 0.00 H new ATOM 0 HG3 GLU A 5 11.261 10.173 3.194 1.00 0.00 H new ATOM 67 N ILE A 6 15.935 9.158 1.903 1.00 0.00 N ATOM 68 CA ILE A 6 17.014 8.410 1.199 1.00 0.00 C ATOM 69 C ILE A 6 16.481 7.884 -0.136 1.00 0.00 C ATOM 70 O ILE A 6 15.813 6.871 -0.194 1.00 0.00 O ATOM 71 CB ILE A 6 17.467 7.233 2.065 1.00 0.00 C ATOM 72 CG1 ILE A 6 16.329 6.823 3.002 1.00 0.00 C ATOM 73 CG2 ILE A 6 18.684 7.649 2.895 1.00 0.00 C ATOM 74 CD1 ILE A 6 16.616 5.435 3.577 1.00 0.00 C ATOM 0 H ILE A 6 15.528 8.679 2.706 1.00 0.00 H new ATOM 0 HA ILE A 6 17.859 9.075 1.018 1.00 0.00 H new ATOM 0 HB ILE A 6 17.733 6.392 1.425 1.00 0.00 H new ATOM 0 HG12 ILE A 6 16.229 7.549 3.809 1.00 0.00 H new ATOM 0 HG13 ILE A 6 15.383 6.815 2.461 1.00 0.00 H new ATOM 0 HG21 ILE A 6 19.007 6.811 3.512 1.00 0.00 H new ATOM 0 HG22 ILE A 6 19.495 7.943 2.229 1.00 0.00 H new ATOM 0 HG23 ILE A 6 18.417 8.490 3.536 1.00 0.00 H new ATOM 0 HD11 ILE A 6 15.805 5.143 4.245 1.00 0.00 H new ATOM 0 HD12 ILE A 6 16.694 4.713 2.764 1.00 0.00 H new ATOM 0 HD13 ILE A 6 17.553 5.458 4.133 1.00 0.00 H new ATOM 86 N THR A 7 16.773 8.566 -1.211 1.00 0.00 N ATOM 87 CA THR A 7 16.282 8.105 -2.540 1.00 0.00 C ATOM 88 C THR A 7 17.339 7.214 -3.195 1.00 0.00 C ATOM 89 O THR A 7 18.432 7.651 -3.495 1.00 0.00 O ATOM 90 CB THR A 7 16.014 9.318 -3.433 1.00 0.00 C ATOM 91 OG1 THR A 7 15.032 10.145 -2.824 1.00 0.00 O ATOM 92 CG2 THR A 7 15.510 8.848 -4.799 1.00 0.00 C ATOM 0 H THR A 7 17.329 9.421 -1.226 1.00 0.00 H new ATOM 0 HA THR A 7 15.360 7.538 -2.409 1.00 0.00 H new ATOM 0 HB THR A 7 16.937 9.883 -3.563 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.861 10.923 -3.394 1.00 0.00 H new ATOM 0 HG21 THR A 7 15.320 9.713 -5.434 1.00 0.00 H new ATOM 0 HG22 THR A 7 16.263 8.214 -5.266 1.00 0.00 H new ATOM 0 HG23 THR A 7 14.588 8.282 -4.671 1.00 0.00 H new ATOM 100 N THR A 8 17.023 5.969 -3.418 1.00 0.00 N ATOM 101 CA THR A 8 18.010 5.050 -4.054 1.00 0.00 C ATOM 102 C THR A 8 17.269 4.022 -4.910 1.00 0.00 C ATOM 103 O THR A 8 17.873 3.203 -5.574 1.00 0.00 O ATOM 104 CB THR A 8 18.813 4.331 -2.967 1.00 0.00 C ATOM 105 OG1 THR A 8 19.757 3.461 -3.576 1.00 0.00 O ATOM 106 CG2 THR A 8 17.867 3.520 -2.080 1.00 0.00 C ATOM 0 H THR A 8 16.123 5.547 -3.187 1.00 0.00 H new ATOM 0 HA THR A 8 18.689 5.624 -4.684 1.00 0.00 H new ATOM 0 HB THR A 8 19.336 5.067 -2.356 1.00 0.00 H new ATOM 0 HG1 THR A 8 19.393 3.124 -4.421 1.00 0.00 H new ATOM 0 HG21 THR A 8 18.441 3.009 -1.307 1.00 0.00 H new ATOM 0 HG22 THR A 8 17.144 4.188 -1.613 1.00 0.00 H new ATOM 0 HG23 THR A 8 17.341 2.784 -2.687 1.00 0.00 H new ATOM 114 N LEU A 9 15.965 4.057 -4.901 1.00 0.00 N ATOM 115 CA LEU A 9 15.186 3.082 -5.716 1.00 0.00 C ATOM 116 C LEU A 9 15.745 1.670 -5.509 1.00 0.00 C ATOM 117 O LEU A 9 16.325 1.103 -6.415 1.00 0.00 O ATOM 118 CB LEU A 9 15.303 3.458 -7.195 1.00 0.00 C ATOM 119 CG LEU A 9 14.982 4.942 -7.371 1.00 0.00 C ATOM 120 CD1 LEU A 9 16.248 5.693 -7.787 1.00 0.00 C ATOM 121 CD2 LEU A 9 13.915 5.107 -8.457 1.00 0.00 C ATOM 0 H LEU A 9 15.405 4.719 -4.364 1.00 0.00 H new ATOM 0 HA LEU A 9 14.141 3.105 -5.407 1.00 0.00 H new ATOM 0 HB2 LEU A 9 16.310 3.248 -7.556 1.00 0.00 H new ATOM 0 HB3 LEU A 9 14.618 2.854 -7.790 1.00 0.00 H new ATOM 0 HG LEU A 9 14.611 5.347 -6.429 1.00 0.00 H new ATOM 0 HD11 LEU A 9 16.019 6.751 -7.912 1.00 0.00 H new ATOM 0 HD12 LEU A 9 17.010 5.576 -7.017 1.00 0.00 H new ATOM 0 HD13 LEU A 9 16.618 5.288 -8.729 1.00 0.00 H new ATOM 0 HD21 LEU A 9 13.685 6.165 -8.583 1.00 0.00 H new ATOM 0 HD22 LEU A 9 14.288 4.702 -9.398 1.00 0.00 H new ATOM 0 HD23 LEU A 9 13.012 4.572 -8.164 1.00 0.00 H new ATOM 133 N PRO A 10 15.561 1.135 -4.324 1.00 0.00 N ATOM 134 CA PRO A 10 16.052 -0.215 -3.997 1.00 0.00 C ATOM 135 C PRO A 10 15.342 -1.260 -4.862 1.00 0.00 C ATOM 136 O PRO A 10 14.232 -1.665 -4.578 1.00 0.00 O ATOM 137 CB PRO A 10 15.705 -0.414 -2.516 1.00 0.00 C ATOM 138 CG PRO A 10 14.977 0.864 -2.026 1.00 0.00 C ATOM 139 CD PRO A 10 14.857 1.823 -3.222 1.00 0.00 C ATOM 0 HA PRO A 10 17.120 -0.324 -4.183 1.00 0.00 H new ATOM 0 HB2 PRO A 10 15.069 -1.290 -2.387 1.00 0.00 H new ATOM 0 HB3 PRO A 10 16.609 -0.587 -1.932 1.00 0.00 H new ATOM 0 HG2 PRO A 10 13.990 0.616 -1.635 1.00 0.00 H new ATOM 0 HG3 PRO A 10 15.533 1.333 -1.214 1.00 0.00 H new ATOM 0 HD2 PRO A 10 13.814 2.012 -3.475 1.00 0.00 H new ATOM 0 HD3 PRO A 10 15.312 2.789 -3.003 1.00 0.00 H new ATOM 147 N ALA A 11 15.973 -1.699 -5.917 1.00 0.00 N ATOM 148 CA ALA A 11 15.334 -2.717 -6.798 1.00 0.00 C ATOM 149 C ALA A 11 16.418 -3.555 -7.478 1.00 0.00 C ATOM 150 O ALA A 11 16.487 -3.628 -8.688 1.00 0.00 O ATOM 151 CB ALA A 11 14.491 -2.011 -7.862 1.00 0.00 C ATOM 0 H ALA A 11 16.903 -1.397 -6.207 1.00 0.00 H new ATOM 0 HA ALA A 11 14.695 -3.367 -6.200 1.00 0.00 H new ATOM 0 HB1 ALA A 11 14.023 -2.754 -8.507 1.00 0.00 H new ATOM 0 HB2 ALA A 11 13.719 -1.414 -7.377 1.00 0.00 H new ATOM 0 HB3 ALA A 11 15.130 -1.362 -8.461 1.00 0.00 H new ATOM 157 N LEU A 12 17.254 -4.198 -6.704 1.00 0.00 N ATOM 158 CA LEU A 12 18.330 -5.042 -7.290 1.00 0.00 C ATOM 159 C LEU A 12 19.213 -5.675 -6.186 1.00 0.00 C ATOM 160 O LEU A 12 19.637 -6.802 -6.350 1.00 0.00 O ATOM 161 CB LEU A 12 19.187 -4.207 -8.265 1.00 0.00 C ATOM 162 CG LEU A 12 20.560 -4.862 -8.491 1.00 0.00 C ATOM 163 CD1 LEU A 12 21.040 -4.537 -9.907 1.00 0.00 C ATOM 164 CD2 LEU A 12 21.588 -4.324 -7.483 1.00 0.00 C ATOM 0 H LEU A 12 17.235 -4.172 -5.685 1.00 0.00 H new ATOM 0 HA LEU A 12 17.862 -5.856 -7.843 1.00 0.00 H new ATOM 0 HB2 LEU A 12 18.667 -4.106 -9.218 1.00 0.00 H new ATOM 0 HB3 LEU A 12 19.321 -3.201 -7.867 1.00 0.00 H new ATOM 0 HG LEU A 12 20.462 -5.939 -8.357 1.00 0.00 H new ATOM 0 HD11 LEU A 12 22.013 -4.998 -10.076 1.00 0.00 H new ATOM 0 HD12 LEU A 12 20.324 -4.925 -10.632 1.00 0.00 H new ATOM 0 HD13 LEU A 12 21.125 -3.457 -10.023 1.00 0.00 H new ATOM 0 HD21 LEU A 12 22.553 -4.799 -7.659 1.00 0.00 H new ATOM 0 HD22 LEU A 12 21.687 -3.245 -7.605 1.00 0.00 H new ATOM 0 HD23 LEU A 12 21.254 -4.545 -6.469 1.00 0.00 H new ATOM 176 N PRO A 13 19.498 -4.969 -5.098 1.00 0.00 N ATOM 177 CA PRO A 13 20.352 -5.539 -4.038 1.00 0.00 C ATOM 178 C PRO A 13 19.610 -6.660 -3.304 1.00 0.00 C ATOM 179 O PRO A 13 18.505 -6.479 -2.832 1.00 0.00 O ATOM 180 CB PRO A 13 20.639 -4.370 -3.086 1.00 0.00 C ATOM 181 CG PRO A 13 19.877 -3.133 -3.620 1.00 0.00 C ATOM 182 CD PRO A 13 19.029 -3.591 -4.816 1.00 0.00 C ATOM 0 HA PRO A 13 21.268 -5.974 -4.437 1.00 0.00 H new ATOM 0 HB2 PRO A 13 20.315 -4.612 -2.074 1.00 0.00 H new ATOM 0 HB3 PRO A 13 21.709 -4.169 -3.038 1.00 0.00 H new ATOM 0 HG2 PRO A 13 19.243 -2.708 -2.842 1.00 0.00 H new ATOM 0 HG3 PRO A 13 20.576 -2.354 -3.922 1.00 0.00 H new ATOM 0 HD2 PRO A 13 17.965 -3.575 -4.578 1.00 0.00 H new ATOM 0 HD3 PRO A 13 19.173 -2.939 -5.677 1.00 0.00 H new ATOM 190 N GLU A 14 20.208 -7.815 -3.207 1.00 0.00 N ATOM 191 CA GLU A 14 19.537 -8.945 -2.506 1.00 0.00 C ATOM 192 C GLU A 14 18.126 -9.130 -3.069 1.00 0.00 C ATOM 193 O GLU A 14 17.173 -8.551 -2.586 1.00 0.00 O ATOM 194 CB GLU A 14 19.452 -8.639 -1.009 1.00 0.00 C ATOM 195 CG GLU A 14 20.582 -9.364 -0.274 1.00 0.00 C ATOM 196 CD GLU A 14 20.548 -8.992 1.208 1.00 0.00 C ATOM 197 OE1 GLU A 14 20.735 -7.825 1.511 1.00 0.00 O ATOM 198 OE2 GLU A 14 20.335 -9.881 2.017 1.00 0.00 O ATOM 0 H GLU A 14 21.133 -8.025 -3.583 1.00 0.00 H new ATOM 0 HA GLU A 14 20.112 -9.859 -2.658 1.00 0.00 H new ATOM 0 HB2 GLU A 14 19.526 -7.564 -0.842 1.00 0.00 H new ATOM 0 HB3 GLU A 14 18.486 -8.957 -0.616 1.00 0.00 H new ATOM 0 HG2 GLU A 14 20.474 -10.442 -0.392 1.00 0.00 H new ATOM 0 HG3 GLU A 14 21.545 -9.091 -0.706 1.00 0.00 H new ATOM 205 N ASP A 15 17.985 -9.933 -4.089 1.00 0.00 N ATOM 206 CA ASP A 15 16.636 -10.154 -4.681 1.00 0.00 C ATOM 207 C ASP A 15 15.746 -10.875 -3.667 1.00 0.00 C ATOM 208 O ASP A 15 14.557 -11.026 -3.868 1.00 0.00 O ATOM 209 CB ASP A 15 16.767 -11.007 -5.944 1.00 0.00 C ATOM 210 CG ASP A 15 17.369 -12.366 -5.582 1.00 0.00 C ATOM 211 OD1 ASP A 15 18.567 -12.420 -5.356 1.00 0.00 O ATOM 212 OD2 ASP A 15 16.623 -13.330 -5.538 1.00 0.00 O ATOM 0 H ASP A 15 18.745 -10.445 -4.537 1.00 0.00 H new ATOM 0 HA ASP A 15 16.189 -9.193 -4.937 1.00 0.00 H new ATOM 0 HB2 ASP A 15 15.790 -11.142 -6.407 1.00 0.00 H new ATOM 0 HB3 ASP A 15 17.398 -10.500 -6.674 1.00 0.00 H new ATOM 217 N GLY A 16 16.311 -11.321 -2.579 1.00 0.00 N ATOM 218 CA GLY A 16 15.496 -12.032 -1.553 1.00 0.00 C ATOM 219 C GLY A 16 15.423 -13.520 -1.899 1.00 0.00 C ATOM 220 O GLY A 16 16.410 -14.227 -1.853 1.00 0.00 O ATOM 0 H GLY A 16 17.302 -11.224 -2.356 1.00 0.00 H new ATOM 0 HA2 GLY A 16 15.939 -11.899 -0.566 1.00 0.00 H new ATOM 0 HA3 GLY A 16 14.493 -11.608 -1.512 1.00 0.00 H new ATOM 224 N GLY A 17 14.260 -14.002 -2.244 1.00 0.00 N ATOM 225 CA GLY A 17 14.125 -15.445 -2.591 1.00 0.00 C ATOM 226 C GLY A 17 13.036 -15.617 -3.652 1.00 0.00 C ATOM 227 O GLY A 17 12.809 -14.746 -4.467 1.00 0.00 O ATOM 0 H GLY A 17 13.398 -13.459 -2.300 1.00 0.00 H new ATOM 0 HA2 GLY A 17 15.074 -15.830 -2.964 1.00 0.00 H new ATOM 0 HA3 GLY A 17 13.874 -16.022 -1.701 1.00 0.00 H new ATOM 231 N SER A 18 12.363 -16.735 -3.649 1.00 0.00 N ATOM 232 CA SER A 18 11.291 -16.962 -4.659 1.00 0.00 C ATOM 233 C SER A 18 9.984 -16.337 -4.166 1.00 0.00 C ATOM 234 O SER A 18 8.955 -16.981 -4.119 1.00 0.00 O ATOM 235 CB SER A 18 11.093 -18.465 -4.862 1.00 0.00 C ATOM 236 OG SER A 18 10.165 -18.677 -5.918 1.00 0.00 O ATOM 0 H SER A 18 12.509 -17.501 -2.991 1.00 0.00 H new ATOM 0 HA SER A 18 11.579 -16.502 -5.604 1.00 0.00 H new ATOM 0 HB2 SER A 18 12.045 -18.941 -5.098 1.00 0.00 H new ATOM 0 HB3 SER A 18 10.727 -18.923 -3.943 1.00 0.00 H new ATOM 0 HG SER A 18 9.306 -18.267 -5.686 1.00 0.00 H new ATOM 242 N GLY A 19 10.015 -15.084 -3.800 1.00 0.00 N ATOM 243 CA GLY A 19 8.775 -14.419 -3.312 1.00 0.00 C ATOM 244 C GLY A 19 8.186 -15.219 -2.148 1.00 0.00 C ATOM 245 O GLY A 19 7.365 -16.095 -2.338 1.00 0.00 O ATOM 0 H GLY A 19 10.846 -14.493 -3.818 1.00 0.00 H new ATOM 0 HA2 GLY A 19 8.998 -13.402 -2.991 1.00 0.00 H new ATOM 0 HA3 GLY A 19 8.048 -14.345 -4.121 1.00 0.00 H new ATOM 249 N ALA A 20 8.598 -14.925 -0.945 1.00 0.00 N ATOM 250 CA ALA A 20 8.062 -15.666 0.233 1.00 0.00 C ATOM 251 C ALA A 20 7.945 -14.715 1.426 1.00 0.00 C ATOM 252 O ALA A 20 7.667 -15.126 2.535 1.00 0.00 O ATOM 253 CB ALA A 20 9.010 -16.814 0.587 1.00 0.00 C ATOM 0 H ALA A 20 9.284 -14.202 -0.726 1.00 0.00 H new ATOM 0 HA ALA A 20 7.078 -16.068 -0.008 1.00 0.00 H new ATOM 0 HB1 ALA A 20 8.619 -17.356 1.448 1.00 0.00 H new ATOM 0 HB2 ALA A 20 9.093 -17.492 -0.262 1.00 0.00 H new ATOM 0 HB3 ALA A 20 9.994 -16.412 0.828 1.00 0.00 H new ATOM 259 N PHE A 21 8.153 -13.446 1.207 1.00 0.00 N ATOM 260 CA PHE A 21 8.051 -12.467 2.328 1.00 0.00 C ATOM 261 C PHE A 21 8.809 -12.993 3.554 1.00 0.00 C ATOM 262 O PHE A 21 8.203 -13.300 4.559 1.00 0.00 O ATOM 263 CB PHE A 21 6.576 -12.278 2.692 1.00 0.00 C ATOM 264 CG PHE A 21 5.757 -12.171 1.427 1.00 0.00 C ATOM 265 CD1 PHE A 21 6.036 -11.162 0.497 1.00 0.00 C ATOM 266 CD2 PHE A 21 4.719 -13.082 1.182 1.00 0.00 C ATOM 267 CE1 PHE A 21 5.279 -11.062 -0.675 1.00 0.00 C ATOM 268 CE2 PHE A 21 3.963 -12.981 0.009 1.00 0.00 C ATOM 269 CZ PHE A 21 4.243 -11.971 -0.920 1.00 0.00 C ATOM 0 H PHE A 21 8.389 -13.044 0.300 1.00 0.00 H new ATOM 0 HA PHE A 21 8.486 -11.517 2.018 1.00 0.00 H new ATOM 0 HB2 PHE A 21 6.228 -13.118 3.294 1.00 0.00 H new ATOM 0 HB3 PHE A 21 6.451 -11.379 3.296 1.00 0.00 H new ATOM 0 HD1 PHE A 21 6.836 -10.461 0.685 1.00 0.00 H new ATOM 0 HD2 PHE A 21 4.503 -13.861 1.898 1.00 0.00 H new ATOM 0 HE1 PHE A 21 5.494 -10.283 -1.391 1.00 0.00 H new ATOM 0 HE2 PHE A 21 3.163 -13.682 -0.180 1.00 0.00 H new ATOM 0 HZ PHE A 21 3.660 -11.893 -1.826 1.00 0.00 H new ATOM 279 N PRO A 22 10.116 -13.084 3.441 1.00 0.00 N ATOM 280 CA PRO A 22 10.960 -13.576 4.549 1.00 0.00 C ATOM 281 C PRO A 22 10.875 -12.606 5.753 1.00 0.00 C ATOM 282 O PRO A 22 11.323 -11.483 5.636 1.00 0.00 O ATOM 283 CB PRO A 22 12.387 -13.573 3.981 1.00 0.00 C ATOM 284 CG PRO A 22 12.321 -13.040 2.529 1.00 0.00 C ATOM 285 CD PRO A 22 10.853 -12.710 2.218 1.00 0.00 C ATOM 0 HA PRO A 22 10.650 -14.560 4.900 1.00 0.00 H new ATOM 0 HB2 PRO A 22 13.038 -12.945 4.589 1.00 0.00 H new ATOM 0 HB3 PRO A 22 12.807 -14.579 3.999 1.00 0.00 H new ATOM 0 HG2 PRO A 22 12.944 -12.152 2.419 1.00 0.00 H new ATOM 0 HG3 PRO A 22 12.702 -13.785 1.831 1.00 0.00 H new ATOM 0 HD2 PRO A 22 10.726 -11.652 1.987 1.00 0.00 H new ATOM 0 HD3 PRO A 22 10.496 -13.270 1.354 1.00 0.00 H new ATOM 293 N PRO A 23 10.312 -13.030 6.877 1.00 0.00 N ATOM 294 CA PRO A 23 10.206 -12.141 8.051 1.00 0.00 C ATOM 295 C PRO A 23 11.604 -11.777 8.564 1.00 0.00 C ATOM 296 O PRO A 23 12.309 -12.604 9.107 1.00 0.00 O ATOM 297 CB PRO A 23 9.445 -12.955 9.105 1.00 0.00 C ATOM 298 CG PRO A 23 9.154 -14.351 8.503 1.00 0.00 C ATOM 299 CD PRO A 23 9.745 -14.383 7.086 1.00 0.00 C ATOM 0 HA PRO A 23 9.697 -11.207 7.814 1.00 0.00 H new ATOM 0 HB2 PRO A 23 10.036 -13.047 10.016 1.00 0.00 H new ATOM 0 HB3 PRO A 23 8.516 -12.455 9.377 1.00 0.00 H new ATOM 0 HG2 PRO A 23 9.597 -15.133 9.120 1.00 0.00 H new ATOM 0 HG3 PRO A 23 8.081 -14.538 8.474 1.00 0.00 H new ATOM 0 HD2 PRO A 23 10.513 -15.151 6.996 1.00 0.00 H new ATOM 0 HD3 PRO A 23 8.979 -14.609 6.344 1.00 0.00 H new ATOM 307 N GLY A 24 12.009 -10.548 8.396 1.00 0.00 N ATOM 308 CA GLY A 24 13.360 -10.138 8.874 1.00 0.00 C ATOM 309 C GLY A 24 13.525 -8.626 8.718 1.00 0.00 C ATOM 310 O GLY A 24 13.662 -7.903 9.685 1.00 0.00 O ATOM 0 H GLY A 24 11.464 -9.811 7.949 1.00 0.00 H new ATOM 0 HA2 GLY A 24 13.488 -10.422 9.919 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.131 -10.658 8.305 1.00 0.00 H new ATOM 314 N HIS A 25 13.519 -8.141 7.506 1.00 0.00 N ATOM 315 CA HIS A 25 13.680 -6.675 7.289 1.00 0.00 C ATOM 316 C HIS A 25 12.309 -5.996 7.321 1.00 0.00 C ATOM 317 O HIS A 25 12.103 -4.963 6.717 1.00 0.00 O ATOM 318 CB HIS A 25 14.338 -6.430 5.930 1.00 0.00 C ATOM 319 CG HIS A 25 13.747 -7.364 4.910 1.00 0.00 C ATOM 320 ND1 HIS A 25 12.474 -7.848 4.738 1.00 0.00 N flip ATOM 321 CD2 HIS A 25 14.504 -7.922 3.892 1.00 0.00 C flip ATOM 322 CE1 HIS A 25 12.438 -8.691 3.632 1.00 0.00 C flip ATOM 323 NE2 HIS A 25 13.688 -8.700 3.160 1.00 0.00 N flip ATOM 0 H HIS A 25 13.410 -8.696 6.657 1.00 0.00 H new ATOM 0 HA HIS A 25 14.307 -6.260 8.078 1.00 0.00 H new ATOM 0 HB2 HIS A 25 14.186 -5.395 5.622 1.00 0.00 H new ATOM 0 HB3 HIS A 25 15.414 -6.587 6.002 1.00 0.00 H new ATOM 0 HD2 HIS A 25 15.558 -7.761 3.718 1.00 0.00 H new ATOM 0 HE1 HIS A 25 11.584 -9.223 3.240 1.00 0.00 H new ATOM 0 HE2 HIS A 25 13.987 -9.233 2.343 1.00 0.00 H new ATOM 331 N PHE A 26 11.369 -6.567 8.024 1.00 0.00 N ATOM 332 CA PHE A 26 10.014 -5.950 8.095 1.00 0.00 C ATOM 333 C PHE A 26 9.980 -4.927 9.232 1.00 0.00 C ATOM 334 O PHE A 26 8.935 -4.428 9.599 1.00 0.00 O ATOM 335 CB PHE A 26 8.969 -7.038 8.355 1.00 0.00 C ATOM 336 CG PHE A 26 8.575 -7.681 7.046 1.00 0.00 C ATOM 337 CD1 PHE A 26 9.422 -8.618 6.444 1.00 0.00 C ATOM 338 CD2 PHE A 26 7.362 -7.339 6.436 1.00 0.00 C ATOM 339 CE1 PHE A 26 9.056 -9.215 5.230 1.00 0.00 C ATOM 340 CE2 PHE A 26 6.996 -7.936 5.224 1.00 0.00 C ATOM 341 CZ PHE A 26 7.843 -8.873 4.621 1.00 0.00 C ATOM 0 H PHE A 26 11.481 -7.433 8.552 1.00 0.00 H new ATOM 0 HA PHE A 26 9.791 -5.453 7.151 1.00 0.00 H new ATOM 0 HB2 PHE A 26 9.372 -7.789 9.035 1.00 0.00 H new ATOM 0 HB3 PHE A 26 8.093 -6.607 8.839 1.00 0.00 H new ATOM 0 HD1 PHE A 26 10.358 -8.881 6.915 1.00 0.00 H new ATOM 0 HD2 PHE A 26 6.709 -6.615 6.900 1.00 0.00 H new ATOM 0 HE1 PHE A 26 9.709 -9.938 4.765 1.00 0.00 H new ATOM 0 HE2 PHE A 26 6.060 -7.674 4.754 1.00 0.00 H new ATOM 0 HZ PHE A 26 7.560 -9.332 3.685 1.00 0.00 H new ATOM 351 N LYS A 27 11.116 -4.611 9.791 1.00 0.00 N ATOM 352 CA LYS A 27 11.150 -3.620 10.905 1.00 0.00 C ATOM 353 C LYS A 27 11.420 -2.224 10.339 1.00 0.00 C ATOM 354 O LYS A 27 12.075 -1.410 10.959 1.00 0.00 O ATOM 355 CB LYS A 27 12.261 -3.997 11.887 1.00 0.00 C ATOM 356 CG LYS A 27 12.292 -2.988 13.039 1.00 0.00 C ATOM 357 CD LYS A 27 12.415 -3.735 14.369 1.00 0.00 C ATOM 358 CE LYS A 27 12.671 -2.732 15.496 1.00 0.00 C ATOM 359 NZ LYS A 27 14.022 -2.127 15.326 1.00 0.00 N ATOM 0 H LYS A 27 12.022 -4.996 9.525 1.00 0.00 H new ATOM 0 HA LYS A 27 10.191 -3.621 11.423 1.00 0.00 H new ATOM 0 HB2 LYS A 27 12.092 -5.002 12.275 1.00 0.00 H new ATOM 0 HB3 LYS A 27 13.223 -4.010 11.376 1.00 0.00 H new ATOM 0 HG2 LYS A 27 13.132 -2.304 12.915 1.00 0.00 H new ATOM 0 HG3 LYS A 27 11.385 -2.384 13.032 1.00 0.00 H new ATOM 0 HD2 LYS A 27 11.503 -4.297 14.568 1.00 0.00 H new ATOM 0 HD3 LYS A 27 13.230 -4.457 14.319 1.00 0.00 H new ATOM 0 HE2 LYS A 27 11.908 -1.953 15.484 1.00 0.00 H new ATOM 0 HE3 LYS A 27 12.603 -3.230 16.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 14.580 -2.276 16.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 14.504 -2.575 14.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 13.926 -1.107 15.148 1.00 0.00 H new ATOM 373 N ASP A 28 10.919 -1.939 9.166 1.00 0.00 N ATOM 374 CA ASP A 28 11.147 -0.594 8.567 1.00 0.00 C ATOM 375 C ASP A 28 9.934 -0.220 7.692 1.00 0.00 C ATOM 376 O ASP A 28 9.283 -1.100 7.164 1.00 0.00 O ATOM 377 CB ASP A 28 12.408 -0.641 7.699 1.00 0.00 C ATOM 378 CG ASP A 28 13.646 -0.521 8.589 1.00 0.00 C ATOM 379 OD1 ASP A 28 13.949 -1.479 9.282 1.00 0.00 O ATOM 380 OD2 ASP A 28 14.273 0.526 8.562 1.00 0.00 O ATOM 0 H ASP A 28 10.363 -2.579 8.599 1.00 0.00 H new ATOM 0 HA ASP A 28 11.272 0.149 9.355 1.00 0.00 H new ATOM 0 HB2 ASP A 28 12.441 -1.574 7.137 1.00 0.00 H new ATOM 0 HB3 ASP A 28 12.391 0.170 6.970 1.00 0.00 H new ATOM 385 N PRO A 29 9.655 1.063 7.541 1.00 0.00 N ATOM 386 CA PRO A 29 8.517 1.506 6.711 1.00 0.00 C ATOM 387 C PRO A 29 8.681 1.008 5.272 1.00 0.00 C ATOM 388 O PRO A 29 9.712 0.484 4.898 1.00 0.00 O ATOM 389 CB PRO A 29 8.568 3.040 6.749 1.00 0.00 C ATOM 390 CG PRO A 29 9.798 3.449 7.594 1.00 0.00 C ATOM 391 CD PRO A 29 10.421 2.166 8.164 1.00 0.00 C ATOM 0 HA PRO A 29 7.568 1.116 7.079 1.00 0.00 H new ATOM 0 HB2 PRO A 29 8.645 3.445 5.740 1.00 0.00 H new ATOM 0 HB3 PRO A 29 7.654 3.442 7.185 1.00 0.00 H new ATOM 0 HG2 PRO A 29 10.522 3.986 6.981 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.502 4.121 8.400 1.00 0.00 H new ATOM 0 HD2 PRO A 29 11.481 2.099 7.919 1.00 0.00 H new ATOM 0 HD3 PRO A 29 10.342 2.137 9.251 1.00 0.00 H new ATOM 399 N LYS A 30 7.671 1.175 4.463 1.00 0.00 N ATOM 400 CA LYS A 30 7.759 0.723 3.046 1.00 0.00 C ATOM 401 C LYS A 30 6.980 1.698 2.162 1.00 0.00 C ATOM 402 O LYS A 30 5.825 1.985 2.408 1.00 0.00 O ATOM 403 CB LYS A 30 7.161 -0.678 2.915 1.00 0.00 C ATOM 404 CG LYS A 30 7.870 -1.630 3.880 1.00 0.00 C ATOM 405 CD LYS A 30 7.554 -3.077 3.497 1.00 0.00 C ATOM 406 CE LYS A 30 8.348 -4.027 4.396 1.00 0.00 C ATOM 407 NZ LYS A 30 7.496 -5.194 4.761 1.00 0.00 N ATOM 0 H LYS A 30 6.785 1.607 4.724 1.00 0.00 H new ATOM 0 HA LYS A 30 8.803 0.696 2.733 1.00 0.00 H new ATOM 0 HB2 LYS A 30 6.093 -0.651 3.134 1.00 0.00 H new ATOM 0 HB3 LYS A 30 7.268 -1.036 1.891 1.00 0.00 H new ATOM 0 HG2 LYS A 30 8.946 -1.461 3.848 1.00 0.00 H new ATOM 0 HG3 LYS A 30 7.547 -1.435 4.903 1.00 0.00 H new ATOM 0 HD2 LYS A 30 6.486 -3.267 3.602 1.00 0.00 H new ATOM 0 HD3 LYS A 30 7.808 -3.251 2.451 1.00 0.00 H new ATOM 0 HE2 LYS A 30 9.247 -4.366 3.881 1.00 0.00 H new ATOM 0 HE3 LYS A 30 8.674 -3.506 5.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 7.776 -5.549 5.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 6.498 -4.901 4.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 7.618 -5.947 4.054 1.00 0.00 H new ATOM 421 N ARG A 31 7.600 2.216 1.137 1.00 0.00 N ATOM 422 CA ARG A 31 6.889 3.176 0.246 1.00 0.00 C ATOM 423 C ARG A 31 6.092 2.406 -0.808 1.00 0.00 C ATOM 424 O ARG A 31 6.646 1.700 -1.625 1.00 0.00 O ATOM 425 CB ARG A 31 7.912 4.079 -0.449 1.00 0.00 C ATOM 426 CG ARG A 31 8.959 4.543 0.565 1.00 0.00 C ATOM 427 CD ARG A 31 9.808 5.655 -0.061 1.00 0.00 C ATOM 428 NE ARG A 31 11.267 5.384 0.152 1.00 0.00 N ATOM 429 CZ ARG A 31 11.730 5.037 1.326 1.00 0.00 C ATOM 430 NH1 ARG A 31 10.937 4.992 2.361 1.00 0.00 N ATOM 431 NH2 ARG A 31 12.997 4.756 1.466 1.00 0.00 N ATOM 0 H ARG A 31 8.566 2.016 0.878 1.00 0.00 H new ATOM 0 HA ARG A 31 6.208 3.785 0.841 1.00 0.00 H new ATOM 0 HB2 ARG A 31 8.394 3.539 -1.264 1.00 0.00 H new ATOM 0 HB3 ARG A 31 7.411 4.941 -0.890 1.00 0.00 H new ATOM 0 HG2 ARG A 31 8.471 4.907 1.469 1.00 0.00 H new ATOM 0 HG3 ARG A 31 9.593 3.707 0.860 1.00 0.00 H new ATOM 0 HD2 ARG A 31 9.597 5.725 -1.128 1.00 0.00 H new ATOM 0 HD3 ARG A 31 9.542 6.616 0.380 1.00 0.00 H new ATOM 0 HE ARG A 31 11.912 5.472 -0.634 1.00 0.00 H new ATOM 0 HH11 ARG A 31 9.950 5.228 2.258 1.00 0.00 H new ATOM 0 HH12 ARG A 31 11.304 4.721 3.273 1.00 0.00 H new ATOM 0 HH21 ARG A 31 13.623 4.807 0.662 1.00 0.00 H new ATOM 0 HH22 ARG A 31 13.361 4.485 2.379 1.00 0.00 H new ATOM 445 N LEU A 32 4.793 2.540 -0.797 1.00 0.00 N ATOM 446 CA LEU A 32 3.961 1.818 -1.800 1.00 0.00 C ATOM 447 C LEU A 32 3.899 2.639 -3.088 1.00 0.00 C ATOM 448 O LEU A 32 3.135 3.577 -3.203 1.00 0.00 O ATOM 449 CB LEU A 32 2.547 1.624 -1.249 1.00 0.00 C ATOM 450 CG LEU A 32 2.625 1.114 0.190 1.00 0.00 C ATOM 451 CD1 LEU A 32 1.218 0.792 0.695 1.00 0.00 C ATOM 452 CD2 LEU A 32 3.483 -0.152 0.235 1.00 0.00 C ATOM 0 H LEU A 32 4.273 3.118 -0.137 1.00 0.00 H new ATOM 0 HA LEU A 32 4.403 0.844 -2.008 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.000 2.566 -1.283 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.998 0.914 -1.868 1.00 0.00 H new ATOM 0 HG LEU A 32 3.072 1.881 0.823 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.274 0.428 1.721 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.605 1.692 0.662 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.771 0.025 0.062 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.540 -0.517 1.261 1.00 0.00 H new ATOM 0 HD22 LEU A 32 3.035 -0.918 -0.398 1.00 0.00 H new ATOM 0 HD23 LEU A 32 4.486 0.075 -0.125 1.00 0.00 H new ATOM 464 N TYR A 33 4.702 2.296 -4.057 1.00 0.00 N ATOM 465 CA TYR A 33 4.695 3.058 -5.336 1.00 0.00 C ATOM 466 C TYR A 33 3.738 2.392 -6.328 1.00 0.00 C ATOM 467 O TYR A 33 3.863 1.223 -6.637 1.00 0.00 O ATOM 468 CB TYR A 33 6.107 3.074 -5.922 1.00 0.00 C ATOM 469 CG TYR A 33 6.066 3.628 -7.327 1.00 0.00 C ATOM 470 CD1 TYR A 33 5.770 4.981 -7.534 1.00 0.00 C ATOM 471 CD2 TYR A 33 6.324 2.793 -8.421 1.00 0.00 C ATOM 472 CE1 TYR A 33 5.733 5.497 -8.834 1.00 0.00 C ATOM 473 CE2 TYR A 33 6.286 3.310 -9.720 1.00 0.00 C ATOM 474 CZ TYR A 33 5.990 4.662 -9.927 1.00 0.00 C ATOM 475 OH TYR A 33 5.953 5.173 -11.208 1.00 0.00 O ATOM 0 H TYR A 33 5.363 1.520 -4.018 1.00 0.00 H new ATOM 0 HA TYR A 33 4.364 4.080 -5.148 1.00 0.00 H new ATOM 0 HB2 TYR A 33 6.763 3.682 -5.299 1.00 0.00 H new ATOM 0 HB3 TYR A 33 6.520 2.065 -5.930 1.00 0.00 H new ATOM 0 HD1 TYR A 33 5.570 5.626 -6.691 1.00 0.00 H new ATOM 0 HD2 TYR A 33 6.552 1.750 -8.262 1.00 0.00 H new ATOM 0 HE1 TYR A 33 5.506 6.541 -8.994 1.00 0.00 H new ATOM 0 HE2 TYR A 33 6.485 2.666 -10.564 1.00 0.00 H new ATOM 0 HH TYR A 33 6.155 4.461 -11.850 1.00 0.00 H new ATOM 485 N CYS A 34 2.787 3.129 -6.833 1.00 0.00 N ATOM 486 CA CYS A 34 1.825 2.544 -7.808 1.00 0.00 C ATOM 487 C CYS A 34 2.365 2.737 -9.225 1.00 0.00 C ATOM 488 O CYS A 34 2.592 3.846 -9.666 1.00 0.00 O ATOM 489 CB CYS A 34 0.471 3.245 -7.675 1.00 0.00 C ATOM 490 SG CYS A 34 -0.785 2.307 -8.579 1.00 0.00 S ATOM 0 H CYS A 34 2.635 4.113 -6.612 1.00 0.00 H new ATOM 0 HA CYS A 34 1.700 1.480 -7.606 1.00 0.00 H new ATOM 0 HB2 CYS A 34 0.193 3.326 -6.624 1.00 0.00 H new ATOM 0 HB3 CYS A 34 0.535 4.260 -8.067 1.00 0.00 H new ATOM 0 HG CYS A 34 -1.936 2.901 -8.465 1.00 0.00 H new ATOM 496 N LYS A 35 2.579 1.665 -9.939 1.00 0.00 N ATOM 497 CA LYS A 35 3.113 1.781 -11.326 1.00 0.00 C ATOM 498 C LYS A 35 2.064 2.427 -12.235 1.00 0.00 C ATOM 499 O LYS A 35 2.363 2.860 -13.331 1.00 0.00 O ATOM 500 CB LYS A 35 3.458 0.386 -11.851 1.00 0.00 C ATOM 501 CG LYS A 35 4.011 0.493 -13.278 1.00 0.00 C ATOM 502 CD LYS A 35 2.930 0.112 -14.297 1.00 0.00 C ATOM 503 CE LYS A 35 2.882 -1.409 -14.453 1.00 0.00 C ATOM 504 NZ LYS A 35 4.062 -1.865 -15.239 1.00 0.00 N ATOM 0 H LYS A 35 2.406 0.712 -9.620 1.00 0.00 H new ATOM 0 HA LYS A 35 4.008 2.403 -11.319 1.00 0.00 H new ATOM 0 HB2 LYS A 35 4.194 -0.086 -11.200 1.00 0.00 H new ATOM 0 HB3 LYS A 35 2.570 -0.247 -11.841 1.00 0.00 H new ATOM 0 HG2 LYS A 35 4.356 1.510 -13.466 1.00 0.00 H new ATOM 0 HG3 LYS A 35 4.874 -0.163 -13.391 1.00 0.00 H new ATOM 0 HD2 LYS A 35 1.960 0.484 -13.969 1.00 0.00 H new ATOM 0 HD3 LYS A 35 3.142 0.579 -15.259 1.00 0.00 H new ATOM 0 HE2 LYS A 35 2.878 -1.886 -13.473 1.00 0.00 H new ATOM 0 HE3 LYS A 35 1.961 -1.705 -14.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 3.854 -2.786 -15.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 4.274 -1.169 -15.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 4.884 -1.959 -14.609 1.00 0.00 H new ATOM 518 N ASN A 36 0.838 2.493 -11.795 1.00 0.00 N ATOM 519 CA ASN A 36 -0.223 3.110 -12.643 1.00 0.00 C ATOM 520 C ASN A 36 -0.286 4.615 -12.374 1.00 0.00 C ATOM 521 O ASN A 36 -0.787 5.054 -11.358 1.00 0.00 O ATOM 522 CB ASN A 36 -1.574 2.475 -12.313 1.00 0.00 C ATOM 523 CG ASN A 36 -1.695 1.131 -13.032 1.00 0.00 C ATOM 524 OD1 ASN A 36 -2.880 0.647 -13.289 1.00 0.00 O flip ATOM 525 ND2 ASN A 36 -0.702 0.513 -13.361 1.00 0.00 N flip ATOM 0 H ASN A 36 0.524 2.148 -10.888 1.00 0.00 H new ATOM 0 HA ASN A 36 0.011 2.941 -13.694 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -1.668 2.333 -11.236 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -2.384 3.137 -12.619 1.00 0.00 H new ATOM 0 HD21 ASN A 36 0.224 0.891 -13.160 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -0.794 -0.384 -13.838 1.00 0.00 H new ATOM 532 N GLY A 37 0.214 5.410 -13.281 1.00 0.00 N ATOM 533 CA GLY A 37 0.180 6.887 -13.080 1.00 0.00 C ATOM 534 C GLY A 37 1.289 7.299 -12.111 1.00 0.00 C ATOM 535 O GLY A 37 1.398 8.447 -11.730 1.00 0.00 O ATOM 0 H GLY A 37 0.644 5.101 -14.152 1.00 0.00 H new ATOM 0 HA2 GLY A 37 0.309 7.397 -14.035 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -0.791 7.188 -12.687 1.00 0.00 H new ATOM 539 N GLY A 38 2.115 6.372 -11.710 1.00 0.00 N ATOM 540 CA GLY A 38 3.216 6.713 -10.766 1.00 0.00 C ATOM 541 C GLY A 38 2.656 7.516 -9.590 1.00 0.00 C ATOM 542 O GLY A 38 2.651 8.731 -9.604 1.00 0.00 O ATOM 0 H GLY A 38 2.075 5.394 -11.995 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.692 5.802 -10.403 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.984 7.291 -11.281 1.00 0.00 H new ATOM 546 N PHE A 39 2.184 6.847 -8.572 1.00 0.00 N ATOM 547 CA PHE A 39 1.625 7.575 -7.394 1.00 0.00 C ATOM 548 C PHE A 39 1.948 6.805 -6.113 1.00 0.00 C ATOM 549 O PHE A 39 1.853 5.595 -6.064 1.00 0.00 O ATOM 550 CB PHE A 39 0.108 7.698 -7.542 1.00 0.00 C ATOM 551 CG PHE A 39 -0.215 8.813 -8.505 1.00 0.00 C ATOM 552 CD1 PHE A 39 -0.243 10.140 -8.058 1.00 0.00 C ATOM 553 CD2 PHE A 39 -0.488 8.520 -9.845 1.00 0.00 C ATOM 554 CE1 PHE A 39 -0.543 11.173 -8.952 1.00 0.00 C ATOM 555 CE2 PHE A 39 -0.788 9.554 -10.741 1.00 0.00 C ATOM 556 CZ PHE A 39 -0.815 10.880 -10.294 1.00 0.00 C ATOM 0 H PHE A 39 2.161 5.829 -8.504 1.00 0.00 H new ATOM 0 HA PHE A 39 2.069 8.569 -7.342 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.310 6.759 -7.903 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.348 7.897 -6.572 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -0.033 10.366 -7.023 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -0.468 7.496 -10.189 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -0.565 12.196 -8.607 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -0.998 9.328 -11.776 1.00 0.00 H new ATOM 0 HZ PHE A 39 -1.046 11.678 -10.985 1.00 0.00 H new ATOM 566 N PHE A 40 2.326 7.500 -5.074 1.00 0.00 N ATOM 567 CA PHE A 40 2.653 6.815 -3.791 1.00 0.00 C ATOM 568 C PHE A 40 1.431 6.849 -2.870 1.00 0.00 C ATOM 569 O PHE A 40 0.927 7.901 -2.532 1.00 0.00 O ATOM 570 CB PHE A 40 3.820 7.536 -3.111 1.00 0.00 C ATOM 571 CG PHE A 40 5.089 7.286 -3.889 1.00 0.00 C ATOM 572 CD1 PHE A 40 5.390 8.070 -5.010 1.00 0.00 C ATOM 573 CD2 PHE A 40 5.968 6.273 -3.489 1.00 0.00 C ATOM 574 CE1 PHE A 40 6.569 7.840 -5.729 1.00 0.00 C ATOM 575 CE2 PHE A 40 7.146 6.042 -4.208 1.00 0.00 C ATOM 576 CZ PHE A 40 7.447 6.826 -5.329 1.00 0.00 C ATOM 0 H PHE A 40 2.423 8.515 -5.059 1.00 0.00 H new ATOM 0 HA PHE A 40 2.931 5.780 -3.992 1.00 0.00 H new ATOM 0 HB2 PHE A 40 3.619 8.606 -3.057 1.00 0.00 H new ATOM 0 HB3 PHE A 40 3.933 7.181 -2.087 1.00 0.00 H new ATOM 0 HD1 PHE A 40 4.713 8.852 -5.320 1.00 0.00 H new ATOM 0 HD2 PHE A 40 5.737 5.669 -2.624 1.00 0.00 H new ATOM 0 HE1 PHE A 40 6.801 8.445 -6.593 1.00 0.00 H new ATOM 0 HE2 PHE A 40 7.823 5.259 -3.899 1.00 0.00 H new ATOM 0 HZ PHE A 40 8.356 6.648 -5.884 1.00 0.00 H new ATOM 586 N LEU A 41 0.951 5.706 -2.459 1.00 0.00 N ATOM 587 CA LEU A 41 -0.236 5.679 -1.558 1.00 0.00 C ATOM 588 C LEU A 41 -0.007 6.646 -0.395 1.00 0.00 C ATOM 589 O LEU A 41 1.112 6.879 0.019 1.00 0.00 O ATOM 590 CB LEU A 41 -0.432 4.260 -1.014 1.00 0.00 C ATOM 591 CG LEU A 41 -1.732 4.183 -0.203 1.00 0.00 C ATOM 592 CD1 LEU A 41 -2.939 4.430 -1.115 1.00 0.00 C ATOM 593 CD2 LEU A 41 -1.852 2.794 0.428 1.00 0.00 C ATOM 0 H LEU A 41 1.329 4.792 -2.708 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.125 5.979 -2.113 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.465 3.547 -1.838 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.415 3.982 -0.386 1.00 0.00 H new ATOM 0 HG LEU A 41 -1.712 4.945 0.576 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -3.856 4.373 -0.528 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -2.858 5.419 -1.566 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -2.963 3.674 -1.900 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -2.775 2.735 1.005 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -1.866 2.038 -0.357 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -1.001 2.618 1.086 1.00 0.00 H new ATOM 605 N ARG A 42 -1.055 7.213 0.137 1.00 0.00 N ATOM 606 CA ARG A 42 -0.886 8.164 1.272 1.00 0.00 C ATOM 607 C ARG A 42 -2.183 8.239 2.080 1.00 0.00 C ATOM 608 O ARG A 42 -3.221 8.615 1.573 1.00 0.00 O ATOM 609 CB ARG A 42 -0.547 9.553 0.728 1.00 0.00 C ATOM 610 CG ARG A 42 0.105 10.387 1.833 1.00 0.00 C ATOM 611 CD ARG A 42 0.389 11.798 1.312 1.00 0.00 C ATOM 612 NE ARG A 42 -0.186 12.800 2.253 1.00 0.00 N ATOM 613 CZ ARG A 42 0.183 14.050 2.182 1.00 0.00 C ATOM 614 NH1 ARG A 42 1.056 14.421 1.287 1.00 0.00 N ATOM 615 NH2 ARG A 42 -0.322 14.927 3.005 1.00 0.00 N ATOM 0 H ARG A 42 -2.018 7.060 -0.164 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.078 7.816 1.915 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.128 9.467 -0.124 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -1.451 10.046 0.370 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -0.551 10.435 2.702 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.032 9.916 2.159 1.00 0.00 H new ATOM 0 HD2 ARG A 42 1.464 11.951 1.213 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -0.044 11.925 0.320 1.00 0.00 H new ATOM 0 HE ARG A 42 -0.868 12.509 2.953 1.00 0.00 H new ATOM 0 HH11 ARG A 42 1.450 13.735 0.643 1.00 0.00 H new ATOM 0 HH12 ARG A 42 1.345 15.398 1.231 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -1.005 14.636 3.704 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -0.034 15.904 2.949 1.00 0.00 H new ATOM 629 N ILE A 43 -2.131 7.890 3.336 1.00 0.00 N ATOM 630 CA ILE A 43 -3.358 7.947 4.178 1.00 0.00 C ATOM 631 C ILE A 43 -3.425 9.306 4.878 1.00 0.00 C ATOM 632 O ILE A 43 -2.474 9.743 5.495 1.00 0.00 O ATOM 633 CB ILE A 43 -3.311 6.834 5.227 1.00 0.00 C ATOM 634 CG1 ILE A 43 -3.265 5.475 4.526 1.00 0.00 C ATOM 635 CG2 ILE A 43 -4.559 6.910 6.108 1.00 0.00 C ATOM 636 CD1 ILE A 43 -2.461 4.489 5.375 1.00 0.00 C ATOM 0 H ILE A 43 -1.291 7.568 3.816 1.00 0.00 H new ATOM 0 HA ILE A 43 -4.239 7.814 3.550 1.00 0.00 H new ATOM 0 HB ILE A 43 -2.422 6.955 5.845 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -4.276 5.099 4.373 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -2.810 5.578 3.541 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -4.526 6.117 6.855 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -4.593 7.878 6.607 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.449 6.789 5.490 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -2.428 3.521 4.875 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.446 4.864 5.505 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -2.935 4.378 6.350 1.00 0.00 H new ATOM 648 N HIS A 44 -4.537 9.983 4.784 1.00 0.00 N ATOM 649 CA HIS A 44 -4.652 11.315 5.441 1.00 0.00 C ATOM 650 C HIS A 44 -5.183 11.128 6.876 1.00 0.00 C ATOM 651 O HIS A 44 -5.895 10.176 7.131 1.00 0.00 O ATOM 652 CB HIS A 44 -5.628 12.181 4.640 1.00 0.00 C ATOM 653 CG HIS A 44 -4.920 12.756 3.444 1.00 0.00 C ATOM 654 ND1 HIS A 44 -3.807 13.573 3.565 1.00 0.00 N ATOM 655 CD2 HIS A 44 -5.153 12.637 2.096 1.00 0.00 C ATOM 656 CE1 HIS A 44 -3.416 13.912 2.322 1.00 0.00 C ATOM 657 NE2 HIS A 44 -4.203 13.367 1.390 1.00 0.00 N ATOM 0 H HIS A 44 -5.369 9.672 4.282 1.00 0.00 H new ATOM 0 HA HIS A 44 -3.677 11.800 5.477 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -6.482 11.584 4.319 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -6.018 12.983 5.266 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -5.953 12.063 1.651 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -2.570 14.547 2.105 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -4.124 13.465 0.378 1.00 0.00 H new ATOM 665 N PRO A 45 -4.841 12.028 7.783 1.00 0.00 N ATOM 666 CA PRO A 45 -5.312 11.927 9.178 1.00 0.00 C ATOM 667 C PRO A 45 -6.843 11.908 9.224 1.00 0.00 C ATOM 668 O PRO A 45 -7.439 11.374 10.138 1.00 0.00 O ATOM 669 CB PRO A 45 -4.773 13.185 9.873 1.00 0.00 C ATOM 670 CG PRO A 45 -3.993 14.008 8.819 1.00 0.00 C ATOM 671 CD PRO A 45 -3.976 13.199 7.514 1.00 0.00 C ATOM 0 HA PRO A 45 -4.968 11.012 9.661 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -5.592 13.773 10.288 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.122 12.914 10.704 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -4.468 14.977 8.662 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.977 14.203 9.161 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.356 13.788 6.679 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.964 12.891 7.253 1.00 0.00 H new ATOM 679 N ASP A 46 -7.484 12.491 8.247 1.00 0.00 N ATOM 680 CA ASP A 46 -8.974 12.507 8.240 1.00 0.00 C ATOM 681 C ASP A 46 -9.500 11.123 7.855 1.00 0.00 C ATOM 682 O ASP A 46 -10.674 10.944 7.597 1.00 0.00 O ATOM 683 CB ASP A 46 -9.468 13.541 7.227 1.00 0.00 C ATOM 684 CG ASP A 46 -8.938 13.187 5.836 1.00 0.00 C ATOM 685 OD1 ASP A 46 -8.240 12.192 5.725 1.00 0.00 O ATOM 686 OD2 ASP A 46 -9.237 13.917 4.906 1.00 0.00 O ATOM 0 H ASP A 46 -7.041 12.956 7.455 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.338 12.769 9.234 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.558 13.564 7.217 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.130 14.537 7.514 1.00 0.00 H new ATOM 691 N GLY A 47 -8.641 10.142 7.815 1.00 0.00 N ATOM 692 CA GLY A 47 -9.096 8.770 7.447 1.00 0.00 C ATOM 693 C GLY A 47 -9.110 8.630 5.924 1.00 0.00 C ATOM 694 O GLY A 47 -8.785 7.591 5.383 1.00 0.00 O ATOM 0 H GLY A 47 -7.646 10.230 8.021 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -8.432 8.025 7.885 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -10.092 8.585 7.849 1.00 0.00 H new ATOM 698 N ARG A 48 -9.487 9.666 5.226 1.00 0.00 N ATOM 699 CA ARG A 48 -9.522 9.592 3.739 1.00 0.00 C ATOM 700 C ARG A 48 -8.218 8.976 3.229 1.00 0.00 C ATOM 701 O ARG A 48 -7.193 9.052 3.875 1.00 0.00 O ATOM 702 CB ARG A 48 -9.681 11.000 3.161 1.00 0.00 C ATOM 703 CG ARG A 48 -11.026 11.584 3.600 1.00 0.00 C ATOM 704 CD ARG A 48 -11.259 12.913 2.875 1.00 0.00 C ATOM 705 NE ARG A 48 -11.687 13.972 3.847 1.00 0.00 N ATOM 706 CZ ARG A 48 -12.622 13.744 4.733 1.00 0.00 C ATOM 707 NH1 ARG A 48 -13.260 12.606 4.743 1.00 0.00 N ATOM 708 NH2 ARG A 48 -12.934 14.669 5.598 1.00 0.00 N ATOM 0 H ARG A 48 -9.773 10.561 5.622 1.00 0.00 H new ATOM 0 HA ARG A 48 -10.363 8.974 3.426 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.866 11.639 3.502 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -9.625 10.966 2.073 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -11.831 10.886 3.372 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -11.034 11.738 4.679 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -10.345 13.223 2.369 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -12.022 12.786 2.107 1.00 0.00 H new ATOM 0 HE ARG A 48 -11.240 14.888 3.817 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -13.031 11.887 4.057 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -13.988 12.435 5.437 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -12.449 15.566 5.582 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -13.663 14.495 6.290 1.00 0.00 H new ATOM 722 N VAL A 49 -8.254 8.364 2.072 1.00 0.00 N ATOM 723 CA VAL A 49 -7.023 7.736 1.507 1.00 0.00 C ATOM 724 C VAL A 49 -6.892 8.115 0.031 1.00 0.00 C ATOM 725 O VAL A 49 -7.824 7.990 -0.738 1.00 0.00 O ATOM 726 CB VAL A 49 -7.122 6.215 1.634 1.00 0.00 C ATOM 727 CG1 VAL A 49 -5.909 5.567 0.966 1.00 0.00 C ATOM 728 CG2 VAL A 49 -7.155 5.826 3.115 1.00 0.00 C ATOM 0 H VAL A 49 -9.088 8.273 1.492 1.00 0.00 H new ATOM 0 HA VAL A 49 -6.150 8.090 2.054 1.00 0.00 H new ATOM 0 HB VAL A 49 -8.034 5.870 1.147 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.980 4.483 1.057 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.884 5.842 -0.088 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -4.997 5.913 1.453 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -7.226 4.742 3.205 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -6.244 6.172 3.602 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.019 6.287 3.593 1.00 0.00 H new ATOM 738 N ASP A 50 -5.740 8.577 -0.371 1.00 0.00 N ATOM 739 CA ASP A 50 -5.545 8.964 -1.797 1.00 0.00 C ATOM 740 C ASP A 50 -4.105 8.660 -2.213 1.00 0.00 C ATOM 741 O ASP A 50 -3.486 7.740 -1.717 1.00 0.00 O ATOM 742 CB ASP A 50 -5.820 10.460 -1.963 1.00 0.00 C ATOM 743 CG ASP A 50 -4.792 11.260 -1.161 1.00 0.00 C ATOM 744 OD1 ASP A 50 -3.981 10.641 -0.492 1.00 0.00 O ATOM 745 OD2 ASP A 50 -4.833 12.477 -1.229 1.00 0.00 O ATOM 0 H ASP A 50 -4.924 8.703 0.228 1.00 0.00 H new ATOM 0 HA ASP A 50 -6.233 8.398 -2.425 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -5.769 10.735 -3.016 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -6.828 10.696 -1.620 1.00 0.00 H new ATOM 750 N GLY A 51 -3.565 9.427 -3.121 1.00 0.00 N ATOM 751 CA GLY A 51 -2.165 9.180 -3.566 1.00 0.00 C ATOM 752 C GLY A 51 -1.524 10.499 -4.000 1.00 0.00 C ATOM 753 O GLY A 51 -2.193 11.402 -4.461 1.00 0.00 O ATOM 0 H GLY A 51 -4.033 10.213 -3.573 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.589 8.733 -2.756 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -2.156 8.470 -4.393 1.00 0.00 H new ATOM 757 N VAL A 52 -0.232 10.618 -3.855 1.00 0.00 N ATOM 758 CA VAL A 52 0.454 11.878 -4.260 1.00 0.00 C ATOM 759 C VAL A 52 1.839 11.545 -4.816 1.00 0.00 C ATOM 760 O VAL A 52 2.504 10.641 -4.353 1.00 0.00 O ATOM 761 CB VAL A 52 0.598 12.794 -3.042 1.00 0.00 C ATOM 762 CG1 VAL A 52 -0.727 12.844 -2.279 1.00 0.00 C ATOM 763 CG2 VAL A 52 1.694 12.252 -2.121 1.00 0.00 C ATOM 0 H VAL A 52 0.379 9.896 -3.473 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.134 12.384 -5.026 1.00 0.00 H new ATOM 0 HB VAL A 52 0.864 13.797 -3.374 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -0.623 13.496 -1.412 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -1.509 13.231 -2.933 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -0.994 11.840 -1.948 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.796 12.905 -1.254 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.428 11.248 -1.790 1.00 0.00 H new ATOM 0 HG23 VAL A 52 2.640 12.217 -2.662 1.00 0.00 H new ATOM 773 N ARG A 53 2.279 12.269 -5.809 1.00 0.00 N ATOM 774 CA ARG A 53 3.621 11.992 -6.396 1.00 0.00 C ATOM 775 C ARG A 53 4.705 12.565 -5.481 1.00 0.00 C ATOM 776 O ARG A 53 5.863 12.213 -5.580 1.00 0.00 O ATOM 777 CB ARG A 53 3.719 12.646 -7.775 1.00 0.00 C ATOM 778 CG ARG A 53 2.593 12.116 -8.670 1.00 0.00 C ATOM 779 CD ARG A 53 3.082 11.999 -10.118 1.00 0.00 C ATOM 780 NE ARG A 53 4.055 13.099 -10.425 1.00 0.00 N ATOM 781 CZ ARG A 53 3.762 14.351 -10.191 1.00 0.00 C ATOM 782 NH1 ARG A 53 2.548 14.698 -9.863 1.00 0.00 N ATOM 783 NH2 ARG A 53 4.679 15.267 -10.343 1.00 0.00 N ATOM 0 H ARG A 53 1.768 13.040 -6.239 1.00 0.00 H new ATOM 0 HA ARG A 53 3.760 10.915 -6.494 1.00 0.00 H new ATOM 0 HB2 ARG A 53 3.645 13.730 -7.682 1.00 0.00 H new ATOM 0 HB3 ARG A 53 4.688 12.430 -8.224 1.00 0.00 H new ATOM 0 HG2 ARG A 53 2.260 11.142 -8.311 1.00 0.00 H new ATOM 0 HG3 ARG A 53 1.734 12.785 -8.621 1.00 0.00 H new ATOM 0 HD2 ARG A 53 3.556 11.030 -10.272 1.00 0.00 H new ATOM 0 HD3 ARG A 53 2.235 12.052 -10.801 1.00 0.00 H new ATOM 0 HE ARG A 53 4.964 12.865 -10.825 1.00 0.00 H new ATOM 0 HH11 ARG A 53 1.818 13.990 -9.787 1.00 0.00 H new ATOM 0 HH12 ARG A 53 2.329 15.678 -9.682 1.00 0.00 H new ATOM 0 HH21 ARG A 53 5.618 15.004 -10.643 1.00 0.00 H new ATOM 0 HH22 ARG A 53 4.457 16.246 -10.162 1.00 0.00 H new ATOM 797 N GLU A 54 4.339 13.444 -4.588 1.00 0.00 N ATOM 798 CA GLU A 54 5.350 14.036 -3.667 1.00 0.00 C ATOM 799 C GLU A 54 6.003 12.922 -2.846 1.00 0.00 C ATOM 800 O GLU A 54 5.513 12.537 -1.803 1.00 0.00 O ATOM 801 CB GLU A 54 4.664 15.029 -2.726 1.00 0.00 C ATOM 802 CG GLU A 54 4.952 16.457 -3.194 1.00 0.00 C ATOM 803 CD GLU A 54 4.183 17.446 -2.316 1.00 0.00 C ATOM 804 OE1 GLU A 54 4.597 17.652 -1.188 1.00 0.00 O ATOM 805 OE2 GLU A 54 3.193 17.981 -2.789 1.00 0.00 O ATOM 0 H GLU A 54 3.384 13.777 -4.457 1.00 0.00 H new ATOM 0 HA GLU A 54 6.112 14.555 -4.248 1.00 0.00 H new ATOM 0 HB2 GLU A 54 3.589 14.849 -2.711 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.024 14.889 -1.707 1.00 0.00 H new ATOM 0 HG2 GLU A 54 6.021 16.661 -3.139 1.00 0.00 H new ATOM 0 HG3 GLU A 54 4.658 16.576 -4.237 1.00 0.00 H new ATOM 812 N LYS A 55 7.104 12.399 -3.310 1.00 0.00 N ATOM 813 CA LYS A 55 7.788 11.309 -2.559 1.00 0.00 C ATOM 814 C LYS A 55 8.627 11.913 -1.430 1.00 0.00 C ATOM 815 O LYS A 55 9.446 11.244 -0.831 1.00 0.00 O ATOM 816 CB LYS A 55 8.696 10.525 -3.508 1.00 0.00 C ATOM 817 CG LYS A 55 9.638 11.491 -4.231 1.00 0.00 C ATOM 818 CD LYS A 55 10.592 10.698 -5.129 1.00 0.00 C ATOM 819 CE LYS A 55 11.968 10.613 -4.464 1.00 0.00 C ATOM 820 NZ LYS A 55 11.837 9.952 -3.135 1.00 0.00 N ATOM 0 H LYS A 55 7.560 12.680 -4.178 1.00 0.00 H new ATOM 0 HA LYS A 55 7.041 10.638 -2.136 1.00 0.00 H new ATOM 0 HB2 LYS A 55 9.273 9.788 -2.950 1.00 0.00 H new ATOM 0 HB3 LYS A 55 8.095 9.976 -4.233 1.00 0.00 H new ATOM 0 HG2 LYS A 55 9.063 12.198 -4.829 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.205 12.074 -3.505 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.198 9.697 -5.302 1.00 0.00 H new ATOM 0 HD3 LYS A 55 10.676 11.180 -6.103 1.00 0.00 H new ATOM 0 HE2 LYS A 55 12.655 10.050 -5.096 1.00 0.00 H new ATOM 0 HE3 LYS A 55 12.389 11.611 -4.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 12.782 9.725 -2.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 11.351 10.593 -2.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.286 9.076 -3.236 1.00 0.00 H new ATOM 834 N SER A 56 8.429 13.175 -1.143 1.00 0.00 N ATOM 835 CA SER A 56 9.209 13.839 -0.055 1.00 0.00 C ATOM 836 C SER A 56 8.293 14.112 1.140 1.00 0.00 C ATOM 837 O SER A 56 8.654 14.819 2.060 1.00 0.00 O ATOM 838 CB SER A 56 9.773 15.161 -0.574 1.00 0.00 C ATOM 839 OG SER A 56 10.335 15.889 0.511 1.00 0.00 O ATOM 0 H SER A 56 7.757 13.777 -1.618 1.00 0.00 H new ATOM 0 HA SER A 56 10.026 13.188 0.257 1.00 0.00 H new ATOM 0 HB2 SER A 56 10.532 14.973 -1.333 1.00 0.00 H new ATOM 0 HB3 SER A 56 8.985 15.745 -1.049 1.00 0.00 H new ATOM 0 HG SER A 56 10.158 15.414 1.350 1.00 0.00 H new ATOM 845 N ASP A 57 7.109 13.560 1.134 1.00 0.00 N ATOM 846 CA ASP A 57 6.172 13.791 2.270 1.00 0.00 C ATOM 847 C ASP A 57 6.305 12.629 3.283 1.00 0.00 C ATOM 848 O ASP A 57 6.126 11.491 2.899 1.00 0.00 O ATOM 849 CB ASP A 57 4.739 13.819 1.732 1.00 0.00 C ATOM 850 CG ASP A 57 4.285 15.270 1.562 1.00 0.00 C ATOM 851 OD1 ASP A 57 4.859 15.957 0.734 1.00 0.00 O ATOM 852 OD2 ASP A 57 3.370 15.670 2.265 1.00 0.00 O ATOM 0 H ASP A 57 6.751 12.959 0.391 1.00 0.00 H new ATOM 0 HA ASP A 57 6.408 14.736 2.759 1.00 0.00 H new ATOM 0 HB2 ASP A 57 4.688 13.297 0.777 1.00 0.00 H new ATOM 0 HB3 ASP A 57 4.072 13.296 2.417 1.00 0.00 H new ATOM 857 N PRO A 58 6.606 12.907 4.547 1.00 0.00 N ATOM 858 CA PRO A 58 6.736 11.826 5.545 1.00 0.00 C ATOM 859 C PRO A 58 5.404 11.084 5.703 1.00 0.00 C ATOM 860 O PRO A 58 5.263 10.218 6.544 1.00 0.00 O ATOM 861 CB PRO A 58 7.111 12.531 6.855 1.00 0.00 C ATOM 862 CG PRO A 58 7.144 14.054 6.578 1.00 0.00 C ATOM 863 CD PRO A 58 6.840 14.265 5.088 1.00 0.00 C ATOM 0 HA PRO A 58 7.481 11.087 5.251 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.385 12.300 7.635 1.00 0.00 H new ATOM 0 HB3 PRO A 58 8.082 12.186 7.211 1.00 0.00 H new ATOM 0 HG2 PRO A 58 6.409 14.571 7.195 1.00 0.00 H new ATOM 0 HG3 PRO A 58 8.120 14.468 6.831 1.00 0.00 H new ATOM 0 HD2 PRO A 58 5.965 14.901 4.950 1.00 0.00 H new ATOM 0 HD3 PRO A 58 7.672 14.754 4.581 1.00 0.00 H new ATOM 871 N HIS A 59 4.423 11.418 4.909 1.00 0.00 N ATOM 872 CA HIS A 59 3.104 10.734 5.023 1.00 0.00 C ATOM 873 C HIS A 59 3.138 9.407 4.260 1.00 0.00 C ATOM 874 O HIS A 59 2.577 8.420 4.692 1.00 0.00 O ATOM 875 CB HIS A 59 2.012 11.631 4.437 1.00 0.00 C ATOM 876 CG HIS A 59 1.631 12.682 5.445 1.00 0.00 C ATOM 877 ND1 HIS A 59 1.986 14.013 5.295 1.00 0.00 N ATOM 878 CD2 HIS A 59 0.924 12.612 6.620 1.00 0.00 C ATOM 879 CE1 HIS A 59 1.497 14.684 6.354 1.00 0.00 C ATOM 880 NE2 HIS A 59 0.840 13.878 7.192 1.00 0.00 N ATOM 0 H HIS A 59 4.478 12.135 4.186 1.00 0.00 H new ATOM 0 HA HIS A 59 2.892 10.538 6.074 1.00 0.00 H new ATOM 0 HB2 HIS A 59 2.367 12.103 3.521 1.00 0.00 H new ATOM 0 HB3 HIS A 59 1.140 11.034 4.171 1.00 0.00 H new ATOM 0 HD2 HIS A 59 0.498 11.711 7.037 1.00 0.00 H new ATOM 0 HE1 HIS A 59 1.621 15.746 6.508 1.00 0.00 H new ATOM 0 HE2 HIS A 59 0.376 14.135 8.064 1.00 0.00 H new ATOM 888 N ILE A 60 3.786 9.373 3.126 1.00 0.00 N ATOM 889 CA ILE A 60 3.842 8.106 2.343 1.00 0.00 C ATOM 890 C ILE A 60 4.628 7.052 3.128 1.00 0.00 C ATOM 891 O ILE A 60 4.875 5.964 2.647 1.00 0.00 O ATOM 892 CB ILE A 60 4.530 8.358 1.000 1.00 0.00 C ATOM 893 CG1 ILE A 60 5.843 9.109 1.228 1.00 0.00 C ATOM 894 CG2 ILE A 60 3.615 9.196 0.106 1.00 0.00 C ATOM 895 CD1 ILE A 60 6.921 8.548 0.301 1.00 0.00 C ATOM 0 H ILE A 60 4.277 10.165 2.710 1.00 0.00 H new ATOM 0 HA ILE A 60 2.828 7.748 2.167 1.00 0.00 H new ATOM 0 HB ILE A 60 4.737 7.403 0.517 1.00 0.00 H new ATOM 0 HG12 ILE A 60 5.703 10.173 1.038 1.00 0.00 H new ATOM 0 HG13 ILE A 60 6.155 9.009 2.268 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.106 9.375 -0.851 1.00 0.00 H new ATOM 0 HG22 ILE A 60 2.680 8.661 -0.060 1.00 0.00 H new ATOM 0 HG23 ILE A 60 3.406 10.150 0.591 1.00 0.00 H new ATOM 0 HD11 ILE A 60 7.856 9.084 0.464 1.00 0.00 H new ATOM 0 HD12 ILE A 60 7.068 7.489 0.513 1.00 0.00 H new ATOM 0 HD13 ILE A 60 6.609 8.671 -0.736 1.00 0.00 H new ATOM 907 N LYS A 61 5.020 7.364 4.332 1.00 0.00 N ATOM 908 CA LYS A 61 5.786 6.376 5.145 1.00 0.00 C ATOM 909 C LYS A 61 4.809 5.478 5.905 1.00 0.00 C ATOM 910 O LYS A 61 4.498 5.717 7.056 1.00 0.00 O ATOM 911 CB LYS A 61 6.680 7.117 6.141 1.00 0.00 C ATOM 912 CG LYS A 61 8.083 7.274 5.552 1.00 0.00 C ATOM 913 CD LYS A 61 8.870 8.296 6.374 1.00 0.00 C ATOM 914 CE LYS A 61 10.282 7.766 6.630 1.00 0.00 C ATOM 915 NZ LYS A 61 11.125 8.854 7.202 1.00 0.00 N ATOM 0 H LYS A 61 4.844 8.259 4.788 1.00 0.00 H new ATOM 0 HA LYS A 61 6.405 5.766 4.488 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.257 8.096 6.366 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.728 6.567 7.081 1.00 0.00 H new ATOM 0 HG2 LYS A 61 8.599 6.314 5.555 1.00 0.00 H new ATOM 0 HG3 LYS A 61 8.019 7.599 4.513 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.918 9.247 5.843 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.364 8.485 7.321 1.00 0.00 H new ATOM 0 HE2 LYS A 61 10.246 6.920 7.317 1.00 0.00 H new ATOM 0 HE3 LYS A 61 10.720 7.403 5.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 12.085 8.494 7.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.169 9.648 6.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 10.710 9.180 8.098 1.00 0.00 H new ATOM 929 N LEU A 62 4.321 4.447 5.272 1.00 0.00 N ATOM 930 CA LEU A 62 3.363 3.535 5.959 1.00 0.00 C ATOM 931 C LEU A 62 4.135 2.410 6.652 1.00 0.00 C ATOM 932 O LEU A 62 5.028 1.814 6.083 1.00 0.00 O ATOM 933 CB LEU A 62 2.403 2.935 4.931 1.00 0.00 C ATOM 934 CG LEU A 62 2.007 4.009 3.916 1.00 0.00 C ATOM 935 CD1 LEU A 62 0.881 3.479 3.025 1.00 0.00 C ATOM 936 CD2 LEU A 62 1.523 5.258 4.657 1.00 0.00 C ATOM 0 H LEU A 62 4.544 4.196 4.309 1.00 0.00 H new ATOM 0 HA LEU A 62 2.796 4.097 6.701 1.00 0.00 H new ATOM 0 HB2 LEU A 62 2.876 2.095 4.422 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.515 2.546 5.430 1.00 0.00 H new ATOM 0 HG LEU A 62 2.870 4.262 3.301 1.00 0.00 H new ATOM 0 HD11 LEU A 62 0.599 4.244 2.302 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.223 2.589 2.497 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.018 3.226 3.641 1.00 0.00 H new ATOM 0 HD21 LEU A 62 1.241 6.023 3.934 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.660 5.004 5.272 1.00 0.00 H new ATOM 0 HD23 LEU A 62 2.323 5.637 5.293 1.00 0.00 H new ATOM 948 N GLN A 63 3.797 2.114 7.877 1.00 0.00 N ATOM 949 CA GLN A 63 4.508 1.027 8.606 1.00 0.00 C ATOM 950 C GLN A 63 3.795 -0.303 8.355 1.00 0.00 C ATOM 951 O GLN A 63 2.712 -0.540 8.854 1.00 0.00 O ATOM 952 CB GLN A 63 4.510 1.333 10.104 1.00 0.00 C ATOM 953 CG GLN A 63 5.150 0.169 10.863 1.00 0.00 C ATOM 954 CD GLN A 63 6.019 0.715 11.997 1.00 0.00 C ATOM 955 OE1 GLN A 63 7.160 1.077 11.783 1.00 0.00 O ATOM 956 NE2 GLN A 63 5.526 0.793 13.202 1.00 0.00 N ATOM 0 H GLN A 63 3.058 2.579 8.405 1.00 0.00 H new ATOM 0 HA GLN A 63 5.536 0.961 8.250 1.00 0.00 H new ATOM 0 HB2 GLN A 63 5.061 2.253 10.297 1.00 0.00 H new ATOM 0 HB3 GLN A 63 3.490 1.493 10.455 1.00 0.00 H new ATOM 0 HG2 GLN A 63 4.377 -0.485 11.266 1.00 0.00 H new ATOM 0 HG3 GLN A 63 5.755 -0.433 10.185 1.00 0.00 H new ATOM 0 HE21 GLN A 63 4.569 0.490 13.382 1.00 0.00 H new ATOM 0 HE22 GLN A 63 6.097 1.158 13.964 1.00 0.00 H new ATOM 965 N LEU A 64 4.391 -1.172 7.585 1.00 0.00 N ATOM 966 CA LEU A 64 3.743 -2.484 7.301 1.00 0.00 C ATOM 967 C LEU A 64 4.236 -3.526 8.307 1.00 0.00 C ATOM 968 O LEU A 64 5.341 -3.449 8.806 1.00 0.00 O ATOM 969 CB LEU A 64 4.101 -2.935 5.883 1.00 0.00 C ATOM 970 CG LEU A 64 3.209 -2.206 4.877 1.00 0.00 C ATOM 971 CD1 LEU A 64 3.428 -0.697 5.000 1.00 0.00 C ATOM 972 CD2 LEU A 64 3.565 -2.657 3.458 1.00 0.00 C ATOM 0 H LEU A 64 5.298 -1.030 7.141 1.00 0.00 H new ATOM 0 HA LEU A 64 2.661 -2.380 7.387 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.150 -2.723 5.676 1.00 0.00 H new ATOM 0 HB3 LEU A 64 3.969 -4.013 5.788 1.00 0.00 H new ATOM 0 HG LEU A 64 2.165 -2.440 5.083 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.792 -0.177 4.283 1.00 0.00 H new ATOM 0 HD12 LEU A 64 3.175 -0.374 6.010 1.00 0.00 H new ATOM 0 HD13 LEU A 64 4.473 -0.463 4.795 1.00 0.00 H new ATOM 0 HD21 LEU A 64 2.929 -2.138 2.741 1.00 0.00 H new ATOM 0 HD22 LEU A 64 4.610 -2.423 3.253 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.410 -3.732 3.368 1.00 0.00 H new ATOM 984 N GLN A 65 3.421 -4.502 8.608 1.00 0.00 N ATOM 985 CA GLN A 65 3.835 -5.553 9.579 1.00 0.00 C ATOM 986 C GLN A 65 3.259 -6.901 9.145 1.00 0.00 C ATOM 987 O GLN A 65 2.166 -6.980 8.621 1.00 0.00 O ATOM 988 CB GLN A 65 3.307 -5.198 10.971 1.00 0.00 C ATOM 989 CG GLN A 65 3.231 -6.465 11.826 1.00 0.00 C ATOM 990 CD GLN A 65 3.229 -6.083 13.307 1.00 0.00 C ATOM 991 OE1 GLN A 65 4.255 -5.741 13.860 1.00 0.00 O ATOM 992 NE2 GLN A 65 2.111 -6.125 13.977 1.00 0.00 N ATOM 0 H GLN A 65 2.484 -4.616 8.221 1.00 0.00 H new ATOM 0 HA GLN A 65 4.923 -5.614 9.608 1.00 0.00 H new ATOM 0 HB2 GLN A 65 3.961 -4.466 11.444 1.00 0.00 H new ATOM 0 HB3 GLN A 65 2.321 -4.740 10.892 1.00 0.00 H new ATOM 0 HG2 GLN A 65 2.329 -7.026 11.583 1.00 0.00 H new ATOM 0 HG3 GLN A 65 4.079 -7.115 11.608 1.00 0.00 H new ATOM 0 HE21 GLN A 65 1.249 -6.412 13.513 1.00 0.00 H new ATOM 0 HE22 GLN A 65 2.099 -5.871 14.965 1.00 0.00 H new ATOM 1001 N ALA A 66 3.986 -7.964 9.355 1.00 0.00 N ATOM 1002 CA ALA A 66 3.478 -9.305 8.950 1.00 0.00 C ATOM 1003 C ALA A 66 2.721 -9.939 10.119 1.00 0.00 C ATOM 1004 O ALA A 66 3.234 -10.054 11.214 1.00 0.00 O ATOM 1005 CB ALA A 66 4.654 -10.201 8.559 1.00 0.00 C ATOM 0 H ALA A 66 4.909 -7.962 9.789 1.00 0.00 H new ATOM 0 HA ALA A 66 2.806 -9.196 8.098 1.00 0.00 H new ATOM 0 HB1 ALA A 66 4.282 -11.182 8.263 1.00 0.00 H new ATOM 0 HB2 ALA A 66 5.193 -9.751 7.725 1.00 0.00 H new ATOM 0 HB3 ALA A 66 5.327 -10.310 9.410 1.00 0.00 H new ATOM 1011 N GLU A 67 1.502 -10.352 9.891 1.00 0.00 N ATOM 1012 CA GLU A 67 0.705 -10.981 10.983 1.00 0.00 C ATOM 1013 C GLU A 67 0.793 -12.503 10.867 1.00 0.00 C ATOM 1014 O GLU A 67 0.724 -13.217 11.848 1.00 0.00 O ATOM 1015 CB GLU A 67 -0.756 -10.545 10.862 1.00 0.00 C ATOM 1016 CG GLU A 67 -0.861 -9.038 11.101 1.00 0.00 C ATOM 1017 CD GLU A 67 -1.289 -8.779 12.547 1.00 0.00 C ATOM 1018 OE1 GLU A 67 -2.483 -8.751 12.794 1.00 0.00 O ATOM 1019 OE2 GLU A 67 -0.415 -8.613 13.381 1.00 0.00 O ATOM 0 H GLU A 67 1.024 -10.280 8.993 1.00 0.00 H new ATOM 0 HA GLU A 67 1.100 -10.667 11.949 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.140 -10.795 9.873 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.368 -11.082 11.587 1.00 0.00 H new ATOM 0 HG2 GLU A 67 0.098 -8.560 10.903 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.583 -8.599 10.413 1.00 0.00 H new ATOM 1026 N GLU A 68 0.945 -13.007 9.673 1.00 0.00 N ATOM 1027 CA GLU A 68 1.037 -14.482 9.491 1.00 0.00 C ATOM 1028 C GLU A 68 1.832 -14.790 8.220 1.00 0.00 C ATOM 1029 O GLU A 68 2.405 -13.910 7.607 1.00 0.00 O ATOM 1030 CB GLU A 68 -0.371 -15.069 9.369 1.00 0.00 C ATOM 1031 CG GLU A 68 -0.709 -15.854 10.637 1.00 0.00 C ATOM 1032 CD GLU A 68 0.117 -17.142 10.677 1.00 0.00 C ATOM 1033 OE1 GLU A 68 -0.239 -18.073 9.973 1.00 0.00 O ATOM 1034 OE2 GLU A 68 1.092 -17.173 11.409 1.00 0.00 O ATOM 0 H GLU A 68 1.009 -12.460 8.815 1.00 0.00 H new ATOM 0 HA GLU A 68 1.541 -14.924 10.350 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -1.097 -14.270 9.219 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -0.430 -15.722 8.498 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.500 -15.248 11.519 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -1.773 -16.091 10.658 1.00 0.00 H new ATOM 1041 N ARG A 69 1.873 -16.031 7.818 1.00 0.00 N ATOM 1042 CA ARG A 69 2.631 -16.390 6.587 1.00 0.00 C ATOM 1043 C ARG A 69 1.762 -16.128 5.355 1.00 0.00 C ATOM 1044 O ARG A 69 1.963 -16.709 4.308 1.00 0.00 O ATOM 1045 CB ARG A 69 3.012 -17.872 6.637 1.00 0.00 C ATOM 1046 CG ARG A 69 4.489 -18.031 6.272 1.00 0.00 C ATOM 1047 CD ARG A 69 4.807 -19.513 6.066 1.00 0.00 C ATOM 1048 NE ARG A 69 6.284 -19.700 6.005 1.00 0.00 N ATOM 1049 CZ ARG A 69 6.797 -20.893 6.134 1.00 0.00 C ATOM 1050 NH1 ARG A 69 6.017 -21.923 6.314 1.00 0.00 N ATOM 1051 NH2 ARG A 69 8.091 -21.057 6.082 1.00 0.00 N ATOM 0 H ARG A 69 1.414 -16.811 8.289 1.00 0.00 H new ATOM 0 HA ARG A 69 3.535 -15.783 6.528 1.00 0.00 H new ATOM 0 HB2 ARG A 69 2.827 -18.273 7.634 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.392 -18.442 5.945 1.00 0.00 H new ATOM 0 HG2 ARG A 69 4.713 -17.471 5.364 1.00 0.00 H new ATOM 0 HG3 ARG A 69 5.116 -17.620 7.063 1.00 0.00 H new ATOM 0 HD2 ARG A 69 4.388 -20.103 6.882 1.00 0.00 H new ATOM 0 HD3 ARG A 69 4.346 -19.870 5.145 1.00 0.00 H new ATOM 0 HE ARG A 69 6.894 -18.895 5.862 1.00 0.00 H new ATOM 0 HH11 ARG A 69 5.006 -21.796 6.354 1.00 0.00 H new ATOM 0 HH12 ARG A 69 6.418 -22.855 6.415 1.00 0.00 H new ATOM 0 HH21 ARG A 69 8.702 -20.252 5.940 1.00 0.00 H new ATOM 0 HH22 ARG A 69 8.491 -21.990 6.183 1.00 0.00 H new ATOM 1065 N GLY A 70 0.797 -15.258 5.472 1.00 0.00 N ATOM 1066 CA GLY A 70 -0.083 -14.959 4.307 1.00 0.00 C ATOM 1067 C GLY A 70 -0.953 -13.739 4.618 1.00 0.00 C ATOM 1068 O GLY A 70 -2.009 -13.556 4.046 1.00 0.00 O ATOM 0 H GLY A 70 0.580 -14.741 6.324 1.00 0.00 H new ATOM 0 HA2 GLY A 70 0.522 -14.770 3.421 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.713 -15.820 4.084 1.00 0.00 H new ATOM 1072 N VAL A 71 -0.518 -12.903 5.521 1.00 0.00 N ATOM 1073 CA VAL A 71 -1.321 -11.697 5.868 1.00 0.00 C ATOM 1074 C VAL A 71 -0.382 -10.564 6.288 1.00 0.00 C ATOM 1075 O VAL A 71 0.694 -10.797 6.802 1.00 0.00 O ATOM 1076 CB VAL A 71 -2.269 -12.028 7.022 1.00 0.00 C ATOM 1077 CG1 VAL A 71 -3.071 -10.782 7.399 1.00 0.00 C ATOM 1078 CG2 VAL A 71 -3.229 -13.139 6.590 1.00 0.00 C ATOM 0 H VAL A 71 0.358 -13.003 6.033 1.00 0.00 H new ATOM 0 HA VAL A 71 -1.902 -11.386 5.000 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.689 -12.361 7.883 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.746 -11.019 8.221 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.389 -9.989 7.706 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -3.651 -10.448 6.538 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.905 -13.376 7.412 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -3.808 -12.805 5.729 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.659 -14.028 6.322 1.00 0.00 H new ATOM 1088 N VAL A 72 -0.781 -9.340 6.072 1.00 0.00 N ATOM 1089 CA VAL A 72 0.089 -8.192 6.460 1.00 0.00 C ATOM 1090 C VAL A 72 -0.783 -7.027 6.932 1.00 0.00 C ATOM 1091 O VAL A 72 -1.693 -6.602 6.247 1.00 0.00 O ATOM 1092 CB VAL A 72 0.919 -7.751 5.253 1.00 0.00 C ATOM 1093 CG1 VAL A 72 1.769 -8.925 4.763 1.00 0.00 C ATOM 1094 CG2 VAL A 72 -0.015 -7.295 4.131 1.00 0.00 C ATOM 0 H VAL A 72 -1.671 -9.085 5.644 1.00 0.00 H new ATOM 0 HA VAL A 72 0.755 -8.497 7.267 1.00 0.00 H new ATOM 0 HB VAL A 72 1.570 -6.926 5.542 1.00 0.00 H new ATOM 0 HG11 VAL A 72 2.361 -8.612 3.903 1.00 0.00 H new ATOM 0 HG12 VAL A 72 2.435 -9.251 5.562 1.00 0.00 H new ATOM 0 HG13 VAL A 72 1.118 -9.750 4.474 1.00 0.00 H new ATOM 0 HG21 VAL A 72 0.576 -6.981 3.271 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -0.666 -8.120 3.842 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -0.621 -6.459 4.480 1.00 0.00 H new ATOM 1104 N SER A 73 -0.512 -6.508 8.099 1.00 0.00 N ATOM 1105 CA SER A 73 -1.323 -5.369 8.617 1.00 0.00 C ATOM 1106 C SER A 73 -0.635 -4.049 8.267 1.00 0.00 C ATOM 1107 O SER A 73 0.499 -3.813 8.632 1.00 0.00 O ATOM 1108 CB SER A 73 -1.455 -5.487 10.136 1.00 0.00 C ATOM 1109 OG SER A 73 -2.471 -6.431 10.448 1.00 0.00 O ATOM 0 H SER A 73 0.236 -6.824 8.716 1.00 0.00 H new ATOM 0 HA SER A 73 -2.313 -5.393 8.162 1.00 0.00 H new ATOM 0 HB2 SER A 73 -0.506 -5.800 10.572 1.00 0.00 H new ATOM 0 HB3 SER A 73 -1.700 -4.516 10.568 1.00 0.00 H new ATOM 0 HG SER A 73 -2.557 -6.510 11.421 1.00 0.00 H new ATOM 1115 N ILE A 74 -1.314 -3.185 7.561 1.00 0.00 N ATOM 1116 CA ILE A 74 -0.702 -1.879 7.188 1.00 0.00 C ATOM 1117 C ILE A 74 -1.098 -0.818 8.217 1.00 0.00 C ATOM 1118 O ILE A 74 -2.186 -0.839 8.756 1.00 0.00 O ATOM 1119 CB ILE A 74 -1.203 -1.459 5.806 1.00 0.00 C ATOM 1120 CG1 ILE A 74 -1.110 -2.648 4.847 1.00 0.00 C ATOM 1121 CG2 ILE A 74 -0.342 -0.310 5.276 1.00 0.00 C ATOM 1122 CD1 ILE A 74 -1.401 -2.178 3.420 1.00 0.00 C ATOM 0 H ILE A 74 -2.267 -3.328 7.227 1.00 0.00 H new ATOM 0 HA ILE A 74 0.383 -1.979 7.167 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.240 -1.131 5.881 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -0.117 -3.094 4.899 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -1.821 -3.421 5.139 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.700 -0.011 4.291 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -0.407 0.538 5.958 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.695 -0.637 5.201 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.335 -3.025 2.737 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -2.404 -1.753 3.374 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.672 -1.421 3.131 1.00 0.00 H new ATOM 1134 N LYS A 75 -0.222 0.110 8.495 1.00 0.00 N ATOM 1135 CA LYS A 75 -0.551 1.169 9.490 1.00 0.00 C ATOM 1136 C LYS A 75 0.142 2.475 9.092 1.00 0.00 C ATOM 1137 O LYS A 75 1.324 2.501 8.813 1.00 0.00 O ATOM 1138 CB LYS A 75 -0.067 0.737 10.875 1.00 0.00 C ATOM 1139 CG LYS A 75 0.064 1.966 11.776 1.00 0.00 C ATOM 1140 CD LYS A 75 -0.039 1.538 13.242 1.00 0.00 C ATOM 1141 CE LYS A 75 0.508 2.650 14.138 1.00 0.00 C ATOM 1142 NZ LYS A 75 1.987 2.744 13.968 1.00 0.00 N ATOM 0 H LYS A 75 0.706 0.180 8.076 1.00 0.00 H new ATOM 0 HA LYS A 75 -1.630 1.322 9.514 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -0.768 0.026 11.312 1.00 0.00 H new ATOM 0 HB3 LYS A 75 0.894 0.228 10.794 1.00 0.00 H new ATOM 0 HG2 LYS A 75 1.018 2.461 11.597 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -0.719 2.687 11.541 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -1.077 1.328 13.498 1.00 0.00 H new ATOM 0 HD3 LYS A 75 0.522 0.617 13.403 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.041 3.601 13.882 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.263 2.445 15.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 2.413 3.127 14.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.376 1.798 13.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 2.205 3.373 13.169 1.00 0.00 H new ATOM 1156 N GLY A 76 -0.584 3.559 9.066 1.00 0.00 N ATOM 1157 CA GLY A 76 0.034 4.861 8.688 1.00 0.00 C ATOM 1158 C GLY A 76 0.819 5.419 9.877 1.00 0.00 C ATOM 1159 O GLY A 76 0.342 5.434 10.995 1.00 0.00 O ATOM 0 H GLY A 76 -1.578 3.599 9.290 1.00 0.00 H new ATOM 0 HA2 GLY A 76 0.696 4.726 7.833 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -0.739 5.568 8.385 1.00 0.00 H new ATOM 1163 N VAL A 77 2.018 5.877 9.647 1.00 0.00 N ATOM 1164 CA VAL A 77 2.831 6.433 10.765 1.00 0.00 C ATOM 1165 C VAL A 77 2.319 7.830 11.122 1.00 0.00 C ATOM 1166 O VAL A 77 1.810 8.057 12.202 1.00 0.00 O ATOM 1167 CB VAL A 77 4.296 6.521 10.335 1.00 0.00 C ATOM 1168 CG1 VAL A 77 5.123 7.143 11.462 1.00 0.00 C ATOM 1169 CG2 VAL A 77 4.823 5.116 10.035 1.00 0.00 C ATOM 0 H VAL A 77 2.470 5.890 8.733 1.00 0.00 H new ATOM 0 HA VAL A 77 2.746 5.782 11.635 1.00 0.00 H new ATOM 0 HB VAL A 77 4.375 7.140 9.441 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.167 7.206 11.155 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.748 8.143 11.679 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.044 6.524 12.356 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.867 5.177 9.728 1.00 0.00 H new ATOM 0 HG22 VAL A 77 4.743 4.499 10.930 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.235 4.670 9.233 1.00 0.00 H new ATOM 1179 N SER A 78 2.449 8.767 10.224 1.00 0.00 N ATOM 1180 CA SER A 78 1.968 10.147 10.513 1.00 0.00 C ATOM 1181 C SER A 78 0.458 10.120 10.758 1.00 0.00 C ATOM 1182 O SER A 78 -0.065 10.871 11.558 1.00 0.00 O ATOM 1183 CB SER A 78 2.274 11.055 9.322 1.00 0.00 C ATOM 1184 OG SER A 78 3.625 11.489 9.397 1.00 0.00 O ATOM 0 H SER A 78 2.867 8.637 9.303 1.00 0.00 H new ATOM 0 HA SER A 78 2.474 10.529 11.400 1.00 0.00 H new ATOM 0 HB2 SER A 78 2.104 10.519 8.388 1.00 0.00 H new ATOM 0 HB3 SER A 78 1.603 11.914 9.323 1.00 0.00 H new ATOM 0 HG SER A 78 3.825 12.070 8.634 1.00 0.00 H new ATOM 1190 N ALA A 79 -0.248 9.259 10.077 1.00 0.00 N ATOM 1191 CA ALA A 79 -1.723 9.184 10.270 1.00 0.00 C ATOM 1192 C ALA A 79 -2.032 8.339 11.508 1.00 0.00 C ATOM 1193 O ALA A 79 -3.060 8.493 12.136 1.00 0.00 O ATOM 1194 CB ALA A 79 -2.367 8.543 9.040 1.00 0.00 C ATOM 0 H ALA A 79 0.134 8.604 9.395 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.124 10.189 10.406 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -3.446 8.488 9.181 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -2.147 9.145 8.158 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.968 7.538 8.902 1.00 0.00 H new ATOM 1200 N ASN A 80 -1.147 7.447 11.864 1.00 0.00 N ATOM 1201 CA ASN A 80 -1.391 6.593 13.060 1.00 0.00 C ATOM 1202 C ASN A 80 -2.778 5.954 12.959 1.00 0.00 C ATOM 1203 O ASN A 80 -3.571 6.021 13.877 1.00 0.00 O ATOM 1204 CB ASN A 80 -1.317 7.452 14.324 1.00 0.00 C ATOM 1205 CG ASN A 80 0.097 8.017 14.476 1.00 0.00 C ATOM 1206 OD1 ASN A 80 1.117 7.204 14.461 1.00 0.00 O flip ATOM 1207 ND2 ASN A 80 0.274 9.212 14.609 1.00 0.00 N flip ATOM 0 H ASN A 80 -0.267 7.274 11.378 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.634 5.810 13.107 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -2.041 8.265 14.267 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -1.577 6.855 15.198 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -0.524 9.848 14.621 1.00 0.00 H new ATOM 0 HD22 ASN A 80 1.220 9.579 14.709 1.00 0.00 H new ATOM 1214 N ARG A 81 -3.077 5.336 11.850 1.00 0.00 N ATOM 1215 CA ARG A 81 -4.413 4.695 11.691 1.00 0.00 C ATOM 1216 C ARG A 81 -4.282 3.460 10.796 1.00 0.00 C ATOM 1217 O ARG A 81 -3.455 3.410 9.908 1.00 0.00 O ATOM 1218 CB ARG A 81 -5.384 5.689 11.051 1.00 0.00 C ATOM 1219 CG ARG A 81 -5.872 6.681 12.110 1.00 0.00 C ATOM 1220 CD ARG A 81 -6.886 7.639 11.483 1.00 0.00 C ATOM 1221 NE ARG A 81 -8.230 7.403 12.082 1.00 0.00 N ATOM 1222 CZ ARG A 81 -9.176 8.288 11.929 1.00 0.00 C ATOM 1223 NH1 ARG A 81 -8.947 9.378 11.251 1.00 0.00 N ATOM 1224 NH2 ARG A 81 -10.353 8.081 12.455 1.00 0.00 N ATOM 0 H ARG A 81 -2.454 5.247 11.047 1.00 0.00 H new ATOM 0 HA ARG A 81 -4.792 4.397 12.669 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -4.892 6.222 10.238 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -6.231 5.158 10.617 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -6.328 6.145 12.942 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -5.029 7.241 12.515 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -6.578 8.671 11.650 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -6.926 7.488 10.404 1.00 0.00 H new ATOM 0 HE ARG A 81 -8.410 6.550 12.611 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -8.028 9.539 10.840 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -9.687 10.069 11.132 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -10.532 7.228 12.985 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -11.093 8.772 12.336 1.00 0.00 H new ATOM 1238 N TYR A 82 -5.093 2.463 11.023 1.00 0.00 N ATOM 1239 CA TYR A 82 -5.015 1.233 10.186 1.00 0.00 C ATOM 1240 C TYR A 82 -5.942 1.378 8.976 1.00 0.00 C ATOM 1241 O TYR A 82 -7.073 1.806 9.097 1.00 0.00 O ATOM 1242 CB TYR A 82 -5.446 0.022 11.015 1.00 0.00 C ATOM 1243 CG TYR A 82 -4.482 -0.175 12.161 1.00 0.00 C ATOM 1244 CD1 TYR A 82 -4.674 0.514 13.364 1.00 0.00 C ATOM 1245 CD2 TYR A 82 -3.395 -1.046 12.018 1.00 0.00 C ATOM 1246 CE1 TYR A 82 -3.779 0.330 14.426 1.00 0.00 C ATOM 1247 CE2 TYR A 82 -2.501 -1.230 13.079 1.00 0.00 C ATOM 1248 CZ TYR A 82 -2.693 -0.541 14.283 1.00 0.00 C ATOM 1249 OH TYR A 82 -1.812 -0.722 15.330 1.00 0.00 O ATOM 0 H TYR A 82 -5.806 2.447 11.752 1.00 0.00 H new ATOM 0 HA TYR A 82 -3.990 1.093 9.844 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -6.456 0.171 11.397 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -5.470 -0.870 10.389 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -5.512 1.187 13.474 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -3.246 -1.576 11.089 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -3.927 0.860 15.355 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -1.663 -1.903 12.969 1.00 0.00 H new ATOM 0 HH TYR A 82 -1.116 -1.360 15.066 1.00 0.00 H new ATOM 1259 N LEU A 83 -5.472 1.024 7.812 1.00 0.00 N ATOM 1260 CA LEU A 83 -6.325 1.140 6.596 1.00 0.00 C ATOM 1261 C LEU A 83 -7.510 0.180 6.714 1.00 0.00 C ATOM 1262 O LEU A 83 -7.407 -0.878 7.303 1.00 0.00 O ATOM 1263 CB LEU A 83 -5.495 0.779 5.359 1.00 0.00 C ATOM 1264 CG LEU A 83 -6.310 1.042 4.085 1.00 0.00 C ATOM 1265 CD1 LEU A 83 -6.596 2.541 3.938 1.00 0.00 C ATOM 1266 CD2 LEU A 83 -5.516 0.560 2.870 1.00 0.00 C ATOM 0 H LEU A 83 -4.533 0.659 7.650 1.00 0.00 H new ATOM 0 HA LEU A 83 -6.693 2.162 6.502 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -4.578 1.368 5.342 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -5.200 -0.269 5.402 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.256 0.504 4.151 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -7.175 2.714 3.031 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.163 2.890 4.801 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -5.654 3.087 3.877 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -6.091 0.745 1.963 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -4.570 1.099 2.816 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -5.320 -0.508 2.964 1.00 0.00 H new ATOM 1278 N ALA A 84 -8.636 0.541 6.162 1.00 0.00 N ATOM 1279 CA ALA A 84 -9.826 -0.352 6.244 1.00 0.00 C ATOM 1280 C ALA A 84 -10.659 -0.207 4.968 1.00 0.00 C ATOM 1281 O ALA A 84 -10.421 0.667 4.158 1.00 0.00 O ATOM 1282 CB ALA A 84 -10.674 0.037 7.456 1.00 0.00 C ATOM 0 H ALA A 84 -8.783 1.415 5.658 1.00 0.00 H new ATOM 0 HA ALA A 84 -9.499 -1.386 6.349 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.544 -0.616 7.516 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.080 -0.066 8.364 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.003 1.071 7.353 1.00 0.00 H new ATOM 1288 N MET A 85 -11.633 -1.060 4.787 1.00 0.00 N ATOM 1289 CA MET A 85 -12.487 -0.980 3.566 1.00 0.00 C ATOM 1290 C MET A 85 -13.946 -1.231 3.949 1.00 0.00 C ATOM 1291 O MET A 85 -14.268 -2.200 4.608 1.00 0.00 O ATOM 1292 CB MET A 85 -12.035 -2.039 2.558 1.00 0.00 C ATOM 1293 CG MET A 85 -12.907 -1.959 1.305 1.00 0.00 C ATOM 1294 SD MET A 85 -12.237 -3.057 0.032 1.00 0.00 S ATOM 1295 CE MET A 85 -11.252 -1.817 -0.844 1.00 0.00 C ATOM 0 H MET A 85 -11.874 -1.811 5.434 1.00 0.00 H new ATOM 0 HA MET A 85 -12.393 0.010 3.120 1.00 0.00 H new ATOM 0 HB2 MET A 85 -10.989 -1.883 2.296 1.00 0.00 H new ATOM 0 HB3 MET A 85 -12.108 -3.032 3.001 1.00 0.00 H new ATOM 0 HG2 MET A 85 -13.932 -2.244 1.543 1.00 0.00 H new ATOM 0 HG3 MET A 85 -12.939 -0.934 0.936 1.00 0.00 H new ATOM 0 HE1 MET A 85 -10.346 -2.281 -1.233 1.00 0.00 H new ATOM 0 HE2 MET A 85 -11.834 -1.407 -1.670 1.00 0.00 H new ATOM 0 HE3 MET A 85 -10.982 -1.015 -0.157 1.00 0.00 H new ATOM 1305 N LYS A 86 -14.834 -0.365 3.541 1.00 0.00 N ATOM 1306 CA LYS A 86 -16.271 -0.555 3.881 1.00 0.00 C ATOM 1307 C LYS A 86 -16.861 -1.667 3.012 1.00 0.00 C ATOM 1308 O LYS A 86 -16.188 -2.236 2.175 1.00 0.00 O ATOM 1309 CB LYS A 86 -17.031 0.747 3.627 1.00 0.00 C ATOM 1310 CG LYS A 86 -16.737 1.740 4.758 1.00 0.00 C ATOM 1311 CD LYS A 86 -17.928 1.820 5.720 1.00 0.00 C ATOM 1312 CE LYS A 86 -18.108 0.486 6.449 1.00 0.00 C ATOM 1313 NZ LYS A 86 -19.102 0.653 7.547 1.00 0.00 N ATOM 0 H LYS A 86 -14.625 0.466 2.987 1.00 0.00 H new ATOM 0 HA LYS A 86 -16.361 -0.830 4.932 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -16.734 1.173 2.669 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -18.102 0.550 3.570 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -15.843 1.430 5.300 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -16.531 2.726 4.341 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -17.768 2.620 6.443 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -18.835 2.067 5.168 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -18.446 -0.280 5.751 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -17.154 0.149 6.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -19.226 -0.252 8.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -18.762 1.372 8.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -20.013 0.956 7.147 1.00 0.00 H new ATOM 1327 N GLU A 87 -18.113 -1.981 3.201 1.00 0.00 N ATOM 1328 CA GLU A 87 -18.744 -3.055 2.385 1.00 0.00 C ATOM 1329 C GLU A 87 -19.230 -2.468 1.059 1.00 0.00 C ATOM 1330 O GLU A 87 -19.651 -3.182 0.169 1.00 0.00 O ATOM 1331 CB GLU A 87 -19.932 -3.645 3.149 1.00 0.00 C ATOM 1332 CG GLU A 87 -19.762 -3.374 4.645 1.00 0.00 C ATOM 1333 CD GLU A 87 -20.692 -4.293 5.440 1.00 0.00 C ATOM 1334 OE1 GLU A 87 -21.702 -4.699 4.890 1.00 0.00 O ATOM 1335 OE2 GLU A 87 -20.377 -4.575 6.584 1.00 0.00 O ATOM 0 H GLU A 87 -18.726 -1.540 3.886 1.00 0.00 H new ATOM 0 HA GLU A 87 -18.013 -3.840 2.189 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -20.863 -3.204 2.792 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -19.998 -4.718 2.968 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -18.727 -3.543 4.941 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -19.990 -2.331 4.864 1.00 0.00 H new ATOM 1342 N ASP A 88 -19.175 -1.173 0.917 1.00 0.00 N ATOM 1343 CA ASP A 88 -19.634 -0.542 -0.353 1.00 0.00 C ATOM 1344 C ASP A 88 -18.444 -0.380 -1.301 1.00 0.00 C ATOM 1345 O ASP A 88 -18.524 -0.698 -2.471 1.00 0.00 O ATOM 1346 CB ASP A 88 -20.236 0.833 -0.052 1.00 0.00 C ATOM 1347 CG ASP A 88 -19.114 1.829 0.249 1.00 0.00 C ATOM 1348 OD1 ASP A 88 -18.481 2.278 -0.692 1.00 0.00 O ATOM 1349 OD2 ASP A 88 -18.908 2.125 1.415 1.00 0.00 O ATOM 0 H ASP A 88 -18.832 -0.524 1.625 1.00 0.00 H new ATOM 0 HA ASP A 88 -20.388 -1.175 -0.820 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -20.824 1.178 -0.903 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -20.915 0.766 0.798 1.00 0.00 H new ATOM 1354 N GLY A 89 -17.341 0.112 -0.806 1.00 0.00 N ATOM 1355 CA GLY A 89 -16.147 0.293 -1.681 1.00 0.00 C ATOM 1356 C GLY A 89 -15.367 1.531 -1.234 1.00 0.00 C ATOM 1357 O GLY A 89 -14.271 1.784 -1.691 1.00 0.00 O ATOM 0 H GLY A 89 -17.215 0.396 0.165 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -15.509 -0.589 -1.630 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -16.458 0.402 -2.720 1.00 0.00 H new ATOM 1361 N ARG A 90 -15.923 2.305 -0.342 1.00 0.00 N ATOM 1362 CA ARG A 90 -15.211 3.525 0.132 1.00 0.00 C ATOM 1363 C ARG A 90 -14.037 3.117 1.024 1.00 0.00 C ATOM 1364 O ARG A 90 -14.192 2.366 1.966 1.00 0.00 O ATOM 1365 CB ARG A 90 -16.178 4.401 0.931 1.00 0.00 C ATOM 1366 CG ARG A 90 -17.156 5.088 -0.024 1.00 0.00 C ATOM 1367 CD ARG A 90 -18.399 5.530 0.749 1.00 0.00 C ATOM 1368 NE ARG A 90 -18.937 6.785 0.151 1.00 0.00 N ATOM 1369 CZ ARG A 90 -20.144 7.183 0.445 1.00 0.00 C ATOM 1370 NH1 ARG A 90 -20.879 6.485 1.266 1.00 0.00 N ATOM 1371 NH2 ARG A 90 -20.614 8.281 -0.080 1.00 0.00 N ATOM 0 H ARG A 90 -16.839 2.145 0.078 1.00 0.00 H new ATOM 0 HA ARG A 90 -14.838 4.084 -0.726 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -16.724 3.793 1.652 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -15.623 5.148 1.499 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -16.680 5.950 -0.491 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -17.437 4.406 -0.826 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -19.156 4.747 0.719 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -18.149 5.692 1.798 1.00 0.00 H new ATOM 0 HE ARG A 90 -18.361 7.333 -0.488 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -20.510 5.628 1.678 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -21.823 6.796 1.496 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -20.038 8.828 -0.720 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -21.558 8.593 0.149 1.00 0.00 H new ATOM 1385 N LEU A 91 -12.862 3.607 0.736 1.00 0.00 N ATOM 1386 CA LEU A 91 -11.679 3.247 1.568 1.00 0.00 C ATOM 1387 C LEU A 91 -11.511 4.278 2.687 1.00 0.00 C ATOM 1388 O LEU A 91 -11.677 5.464 2.482 1.00 0.00 O ATOM 1389 CB LEU A 91 -10.423 3.238 0.693 1.00 0.00 C ATOM 1390 CG LEU A 91 -10.365 1.934 -0.104 1.00 0.00 C ATOM 1391 CD1 LEU A 91 -11.657 1.766 -0.907 1.00 0.00 C ATOM 1392 CD2 LEU A 91 -9.174 1.976 -1.063 1.00 0.00 C ATOM 0 H LEU A 91 -12.670 4.241 -0.040 1.00 0.00 H new ATOM 0 HA LEU A 91 -11.827 2.258 2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -10.434 4.091 0.014 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -9.533 3.336 1.315 1.00 0.00 H new ATOM 0 HG LEU A 91 -10.252 1.095 0.583 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -11.614 0.836 -1.475 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -12.507 1.737 -0.226 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -11.771 2.605 -1.593 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -9.132 1.047 -1.632 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -9.288 2.816 -1.748 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -8.252 2.095 -0.493 1.00 0.00 H new ATOM 1404 N LEU A 92 -11.185 3.835 3.871 1.00 0.00 N ATOM 1405 CA LEU A 92 -11.008 4.792 5.000 1.00 0.00 C ATOM 1406 C LEU A 92 -9.976 4.238 5.985 1.00 0.00 C ATOM 1407 O LEU A 92 -9.381 3.204 5.757 1.00 0.00 O ATOM 1408 CB LEU A 92 -12.346 5.006 5.721 1.00 0.00 C ATOM 1409 CG LEU A 92 -13.114 3.681 5.833 1.00 0.00 C ATOM 1410 CD1 LEU A 92 -12.321 2.686 6.683 1.00 0.00 C ATOM 1411 CD2 LEU A 92 -14.469 3.941 6.497 1.00 0.00 C ATOM 0 H LEU A 92 -11.034 2.854 4.105 1.00 0.00 H new ATOM 0 HA LEU A 92 -10.659 5.747 4.607 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -12.169 5.416 6.715 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -12.946 5.736 5.178 1.00 0.00 H new ATOM 0 HG LEU A 92 -13.259 3.265 4.836 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -12.873 1.749 6.757 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.353 2.501 6.218 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -12.171 3.098 7.681 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -15.020 3.004 6.580 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -14.313 4.359 7.492 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -15.041 4.646 5.893 1.00 0.00 H new ATOM 1423 N ALA A 93 -9.760 4.921 7.078 1.00 0.00 N ATOM 1424 CA ALA A 93 -8.767 4.438 8.082 1.00 0.00 C ATOM 1425 C ALA A 93 -9.288 4.732 9.490 1.00 0.00 C ATOM 1426 O ALA A 93 -10.148 5.568 9.682 1.00 0.00 O ATOM 1427 CB ALA A 93 -7.436 5.163 7.869 1.00 0.00 C ATOM 0 H ALA A 93 -10.229 5.794 7.319 1.00 0.00 H new ATOM 0 HA ALA A 93 -8.619 3.365 7.964 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.709 4.812 8.601 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -7.067 4.958 6.864 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -7.583 6.236 7.990 1.00 0.00 H new ATOM 1433 N SER A 94 -8.775 4.050 10.478 1.00 0.00 N ATOM 1434 CA SER A 94 -9.243 4.291 11.872 1.00 0.00 C ATOM 1435 C SER A 94 -8.080 4.076 12.844 1.00 0.00 C ATOM 1436 O SER A 94 -7.031 3.589 12.474 1.00 0.00 O ATOM 1437 CB SER A 94 -10.372 3.317 12.207 1.00 0.00 C ATOM 1438 OG SER A 94 -9.840 2.005 12.328 1.00 0.00 O ATOM 0 H SER A 94 -8.052 3.337 10.380 1.00 0.00 H new ATOM 0 HA SER A 94 -9.608 5.314 11.961 1.00 0.00 H new ATOM 0 HB2 SER A 94 -10.858 3.612 13.137 1.00 0.00 H new ATOM 0 HB3 SER A 94 -11.133 3.343 11.427 1.00 0.00 H new ATOM 0 HG SER A 94 -9.820 1.746 13.273 1.00 0.00 H new ATOM 1444 N LYS A 95 -8.258 4.437 14.085 1.00 0.00 N ATOM 1445 CA LYS A 95 -7.162 4.253 15.078 1.00 0.00 C ATOM 1446 C LYS A 95 -7.151 2.802 15.564 1.00 0.00 C ATOM 1447 O LYS A 95 -6.109 2.223 15.796 1.00 0.00 O ATOM 1448 CB LYS A 95 -7.389 5.187 16.268 1.00 0.00 C ATOM 1449 CG LYS A 95 -7.171 6.636 15.830 1.00 0.00 C ATOM 1450 CD LYS A 95 -7.530 7.578 16.980 1.00 0.00 C ATOM 1451 CE LYS A 95 -8.861 8.270 16.678 1.00 0.00 C ATOM 1452 NZ LYS A 95 -9.239 9.142 17.826 1.00 0.00 N ATOM 0 H LYS A 95 -9.114 4.851 14.454 1.00 0.00 H new ATOM 0 HA LYS A 95 -6.206 4.487 14.610 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -8.400 5.061 16.654 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -6.705 4.934 17.078 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.132 6.785 15.535 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -7.785 6.859 14.958 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -7.602 7.019 17.913 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -6.744 8.321 17.114 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -8.776 8.865 15.768 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -9.638 7.526 16.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -10.144 9.613 17.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -9.336 8.563 18.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -8.501 9.860 17.974 1.00 0.00 H new ATOM 1466 N SER A 96 -8.303 2.209 15.718 1.00 0.00 N ATOM 1467 CA SER A 96 -8.357 0.797 16.188 1.00 0.00 C ATOM 1468 C SER A 96 -8.354 -0.144 14.982 1.00 0.00 C ATOM 1469 O SER A 96 -9.166 -0.023 14.086 1.00 0.00 O ATOM 1470 CB SER A 96 -9.633 0.578 17.002 1.00 0.00 C ATOM 1471 OG SER A 96 -10.730 1.177 16.325 1.00 0.00 O ATOM 0 H SER A 96 -9.209 2.642 15.538 1.00 0.00 H new ATOM 0 HA SER A 96 -7.488 0.590 16.812 1.00 0.00 H new ATOM 0 HB2 SER A 96 -9.813 -0.488 17.138 1.00 0.00 H new ATOM 0 HB3 SER A 96 -9.523 1.012 17.996 1.00 0.00 H new ATOM 0 HG SER A 96 -10.678 0.968 15.369 1.00 0.00 H new ATOM 1477 N VAL A 97 -7.446 -1.081 14.950 1.00 0.00 N ATOM 1478 CA VAL A 97 -7.393 -2.028 13.802 1.00 0.00 C ATOM 1479 C VAL A 97 -8.562 -3.011 13.896 1.00 0.00 C ATOM 1480 O VAL A 97 -8.658 -3.787 14.826 1.00 0.00 O ATOM 1481 CB VAL A 97 -6.072 -2.799 13.839 1.00 0.00 C ATOM 1482 CG1 VAL A 97 -6.041 -3.703 15.072 1.00 0.00 C ATOM 1483 CG2 VAL A 97 -5.946 -3.656 12.577 1.00 0.00 C ATOM 0 H VAL A 97 -6.739 -1.231 15.670 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.463 -1.471 12.868 1.00 0.00 H new ATOM 0 HB VAL A 97 -5.242 -2.093 13.885 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.100 -4.252 15.097 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -6.131 -3.094 15.972 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.871 -4.408 15.027 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -5.005 -4.206 12.603 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.776 -4.360 12.531 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -5.967 -3.013 11.697 1.00 0.00 H new ATOM 1493 N THR A 98 -9.453 -2.982 12.942 1.00 0.00 N ATOM 1494 CA THR A 98 -10.616 -3.913 12.978 1.00 0.00 C ATOM 1495 C THR A 98 -10.288 -5.173 12.174 1.00 0.00 C ATOM 1496 O THR A 98 -9.160 -5.389 11.775 1.00 0.00 O ATOM 1497 CB THR A 98 -11.839 -3.224 12.369 1.00 0.00 C ATOM 1498 OG1 THR A 98 -11.488 -2.666 11.110 1.00 0.00 O ATOM 1499 CG2 THR A 98 -12.320 -2.114 13.305 1.00 0.00 C ATOM 0 H THR A 98 -9.425 -2.353 12.139 1.00 0.00 H new ATOM 0 HA THR A 98 -10.829 -4.187 14.011 1.00 0.00 H new ATOM 0 HB THR A 98 -12.638 -3.953 12.234 1.00 0.00 H new ATOM 0 HG1 THR A 98 -12.271 -2.226 10.718 1.00 0.00 H new ATOM 0 HG21 THR A 98 -13.191 -1.624 12.870 1.00 0.00 H new ATOM 0 HG22 THR A 98 -12.589 -2.543 14.270 1.00 0.00 H new ATOM 0 HG23 THR A 98 -11.523 -1.383 13.442 1.00 0.00 H new ATOM 1507 N ASP A 99 -11.262 -6.007 11.936 1.00 0.00 N ATOM 1508 CA ASP A 99 -11.006 -7.253 11.159 1.00 0.00 C ATOM 1509 C ASP A 99 -10.972 -6.926 9.665 1.00 0.00 C ATOM 1510 O ASP A 99 -10.587 -7.742 8.851 1.00 0.00 O ATOM 1511 CB ASP A 99 -12.120 -8.265 11.436 1.00 0.00 C ATOM 1512 CG ASP A 99 -12.264 -8.467 12.944 1.00 0.00 C ATOM 1513 OD1 ASP A 99 -11.489 -7.876 13.678 1.00 0.00 O ATOM 1514 OD2 ASP A 99 -13.148 -9.209 13.341 1.00 0.00 O ATOM 0 H ASP A 99 -12.225 -5.880 12.246 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.048 -7.677 11.459 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -13.061 -7.910 11.015 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -11.892 -9.214 10.952 1.00 0.00 H new ATOM 1519 N GLU A 100 -11.371 -5.739 9.297 1.00 0.00 N ATOM 1520 CA GLU A 100 -11.361 -5.362 7.855 1.00 0.00 C ATOM 1521 C GLU A 100 -10.047 -4.652 7.522 1.00 0.00 C ATOM 1522 O GLU A 100 -9.901 -4.056 6.473 1.00 0.00 O ATOM 1523 CB GLU A 100 -12.534 -4.422 7.565 1.00 0.00 C ATOM 1524 CG GLU A 100 -13.844 -5.100 7.970 1.00 0.00 C ATOM 1525 CD GLU A 100 -14.227 -4.668 9.386 1.00 0.00 C ATOM 1526 OE1 GLU A 100 -14.643 -3.532 9.546 1.00 0.00 O ATOM 1527 OE2 GLU A 100 -14.099 -5.481 10.287 1.00 0.00 O ATOM 0 H GLU A 100 -11.704 -5.014 9.933 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.454 -6.260 7.245 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.410 -3.489 8.114 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -12.556 -4.167 6.505 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -14.636 -4.832 7.270 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.733 -6.184 7.927 1.00 0.00 H new ATOM 1534 N CYS A 101 -9.089 -4.712 8.408 1.00 0.00 N ATOM 1535 CA CYS A 101 -7.784 -4.040 8.147 1.00 0.00 C ATOM 1536 C CYS A 101 -6.791 -5.052 7.568 1.00 0.00 C ATOM 1537 O CYS A 101 -5.618 -4.770 7.426 1.00 0.00 O ATOM 1538 CB CYS A 101 -7.230 -3.480 9.459 1.00 0.00 C ATOM 1539 SG CYS A 101 -8.167 -2.004 9.927 1.00 0.00 S ATOM 0 H CYS A 101 -9.154 -5.198 9.302 1.00 0.00 H new ATOM 0 HA CYS A 101 -7.931 -3.228 7.435 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -7.298 -4.232 10.245 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -6.175 -3.233 9.345 1.00 0.00 H new ATOM 0 HG CYS A 101 -8.108 -1.130 8.967 1.00 0.00 H new ATOM 1545 N PHE A 102 -7.254 -6.227 7.232 1.00 0.00 N ATOM 1546 CA PHE A 102 -6.338 -7.258 6.662 1.00 0.00 C ATOM 1547 C PHE A 102 -6.445 -7.253 5.136 1.00 0.00 C ATOM 1548 O PHE A 102 -7.486 -6.969 4.577 1.00 0.00 O ATOM 1549 CB PHE A 102 -6.735 -8.637 7.193 1.00 0.00 C ATOM 1550 CG PHE A 102 -6.471 -8.703 8.679 1.00 0.00 C ATOM 1551 CD1 PHE A 102 -5.157 -8.638 9.159 1.00 0.00 C ATOM 1552 CD2 PHE A 102 -7.539 -8.829 9.576 1.00 0.00 C ATOM 1553 CE1 PHE A 102 -4.911 -8.698 10.536 1.00 0.00 C ATOM 1554 CE2 PHE A 102 -7.292 -8.889 10.953 1.00 0.00 C ATOM 1555 CZ PHE A 102 -5.979 -8.824 11.433 1.00 0.00 C ATOM 0 H PHE A 102 -8.227 -6.517 7.328 1.00 0.00 H new ATOM 0 HA PHE A 102 -5.312 -7.033 6.954 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -7.790 -8.825 6.992 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -6.169 -9.413 6.678 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -4.333 -8.542 8.467 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -8.552 -8.880 9.206 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -3.898 -8.647 10.906 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -8.115 -8.986 11.645 1.00 0.00 H new ATOM 0 HZ PHE A 102 -5.789 -8.871 12.495 1.00 0.00 H new ATOM 1565 N PHE A 103 -5.376 -7.569 4.458 1.00 0.00 N ATOM 1566 CA PHE A 103 -5.414 -7.588 2.968 1.00 0.00 C ATOM 1567 C PHE A 103 -4.418 -8.628 2.449 1.00 0.00 C ATOM 1568 O PHE A 103 -3.221 -8.478 2.593 1.00 0.00 O ATOM 1569 CB PHE A 103 -5.027 -6.209 2.427 1.00 0.00 C ATOM 1570 CG PHE A 103 -5.936 -5.159 3.017 1.00 0.00 C ATOM 1571 CD1 PHE A 103 -5.650 -4.609 4.272 1.00 0.00 C ATOM 1572 CD2 PHE A 103 -7.064 -4.730 2.306 1.00 0.00 C ATOM 1573 CE1 PHE A 103 -6.493 -3.633 4.817 1.00 0.00 C ATOM 1574 CE2 PHE A 103 -7.906 -3.753 2.851 1.00 0.00 C ATOM 1575 CZ PHE A 103 -7.620 -3.205 4.106 1.00 0.00 C ATOM 0 H PHE A 103 -4.477 -7.815 4.872 1.00 0.00 H new ATOM 0 HA PHE A 103 -6.421 -7.842 2.635 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -3.989 -5.988 2.677 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -5.102 -6.200 1.340 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -4.779 -4.937 4.820 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -7.284 -5.153 1.337 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -6.274 -3.210 5.786 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -8.776 -3.423 2.303 1.00 0.00 H new ATOM 0 HZ PHE A 103 -8.269 -2.451 4.526 1.00 0.00 H new ATOM 1585 N PHE A 104 -4.897 -9.680 1.840 1.00 0.00 N ATOM 1586 CA PHE A 104 -3.963 -10.714 1.314 1.00 0.00 C ATOM 1587 C PHE A 104 -2.958 -10.044 0.378 1.00 0.00 C ATOM 1588 O PHE A 104 -3.250 -9.034 -0.230 1.00 0.00 O ATOM 1589 CB PHE A 104 -4.745 -11.776 0.537 1.00 0.00 C ATOM 1590 CG PHE A 104 -5.478 -12.687 1.497 1.00 0.00 C ATOM 1591 CD1 PHE A 104 -4.758 -13.504 2.378 1.00 0.00 C ATOM 1592 CD2 PHE A 104 -6.879 -12.719 1.501 1.00 0.00 C ATOM 1593 CE1 PHE A 104 -5.437 -14.350 3.262 1.00 0.00 C ATOM 1594 CE2 PHE A 104 -7.557 -13.565 2.383 1.00 0.00 C ATOM 1595 CZ PHE A 104 -6.837 -14.381 3.264 1.00 0.00 C ATOM 0 H PHE A 104 -5.888 -9.866 1.685 1.00 0.00 H new ATOM 0 HA PHE A 104 -3.442 -11.190 2.145 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -5.456 -11.296 -0.136 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -4.064 -12.360 -0.082 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -3.678 -13.481 2.375 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -7.435 -12.090 0.822 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.882 -14.979 3.942 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -8.637 -13.589 2.385 1.00 0.00 H new ATOM 0 HZ PHE A 104 -7.362 -15.035 3.945 1.00 0.00 H new ATOM 1605 N GLU A 105 -1.777 -10.598 0.261 1.00 0.00 N ATOM 1606 CA GLU A 105 -0.742 -9.999 -0.635 1.00 0.00 C ATOM 1607 C GLU A 105 -0.257 -11.054 -1.630 1.00 0.00 C ATOM 1608 O GLU A 105 0.630 -11.833 -1.341 1.00 0.00 O ATOM 1609 CB GLU A 105 0.439 -9.516 0.210 1.00 0.00 C ATOM 1610 CG GLU A 105 1.319 -8.585 -0.627 1.00 0.00 C ATOM 1611 CD GLU A 105 2.753 -8.623 -0.094 1.00 0.00 C ATOM 1612 OE1 GLU A 105 2.931 -8.379 1.088 1.00 0.00 O ATOM 1613 OE2 GLU A 105 3.648 -8.894 -0.878 1.00 0.00 O ATOM 0 H GLU A 105 -1.484 -11.444 0.750 1.00 0.00 H new ATOM 0 HA GLU A 105 -1.172 -9.158 -1.179 1.00 0.00 H new ATOM 0 HB2 GLU A 105 0.077 -8.993 1.095 1.00 0.00 H new ATOM 0 HB3 GLU A 105 1.022 -10.368 0.560 1.00 0.00 H new ATOM 0 HG2 GLU A 105 1.300 -8.892 -1.673 1.00 0.00 H new ATOM 0 HG3 GLU A 105 0.931 -7.567 -0.587 1.00 0.00 H new ATOM 1620 N ARG A 106 -0.832 -11.088 -2.802 1.00 0.00 N ATOM 1621 CA ARG A 106 -0.402 -12.092 -3.815 1.00 0.00 C ATOM 1622 C ARG A 106 0.677 -11.480 -4.711 1.00 0.00 C ATOM 1623 O ARG A 106 0.509 -10.407 -5.257 1.00 0.00 O ATOM 1624 CB ARG A 106 -1.604 -12.504 -4.668 1.00 0.00 C ATOM 1625 CG ARG A 106 -1.120 -13.248 -5.914 1.00 0.00 C ATOM 1626 CD ARG A 106 -2.287 -14.022 -6.532 1.00 0.00 C ATOM 1627 NE ARG A 106 -3.405 -13.081 -6.827 1.00 0.00 N ATOM 1628 CZ ARG A 106 -4.376 -13.448 -7.617 1.00 0.00 C ATOM 1629 NH1 ARG A 106 -4.370 -14.640 -8.148 1.00 0.00 N ATOM 1630 NH2 ARG A 106 -5.354 -12.624 -7.875 1.00 0.00 N ATOM 0 H ARG A 106 -1.581 -10.463 -3.101 1.00 0.00 H new ATOM 0 HA ARG A 106 0.001 -12.970 -3.310 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -2.272 -13.141 -4.089 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -2.176 -11.623 -4.958 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -0.715 -12.541 -6.638 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -0.314 -13.933 -5.651 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -1.964 -14.519 -7.447 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -2.624 -14.801 -5.848 1.00 0.00 H new ATOM 0 HE ARG A 106 -3.411 -12.150 -6.411 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -3.606 -15.285 -7.945 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -5.129 -14.927 -8.766 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -5.359 -11.693 -7.459 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -6.113 -12.911 -8.493 1.00 0.00 H new ATOM 1644 N LEU A 107 1.786 -12.153 -4.867 1.00 0.00 N ATOM 1645 CA LEU A 107 2.874 -11.607 -5.726 1.00 0.00 C ATOM 1646 C LEU A 107 2.729 -12.154 -7.148 1.00 0.00 C ATOM 1647 O LEU A 107 2.447 -13.319 -7.349 1.00 0.00 O ATOM 1648 CB LEU A 107 4.232 -12.027 -5.157 1.00 0.00 C ATOM 1649 CG LEU A 107 5.342 -11.237 -5.850 1.00 0.00 C ATOM 1650 CD1 LEU A 107 5.767 -10.065 -4.963 1.00 0.00 C ATOM 1651 CD2 LEU A 107 6.544 -12.153 -6.091 1.00 0.00 C ATOM 0 H LEU A 107 1.984 -13.056 -4.437 1.00 0.00 H new ATOM 0 HA LEU A 107 2.807 -10.519 -5.747 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.259 -11.847 -4.082 1.00 0.00 H new ATOM 0 HB3 LEU A 107 4.385 -13.096 -5.305 1.00 0.00 H new ATOM 0 HG LEU A 107 4.975 -10.857 -6.803 1.00 0.00 H new ATOM 0 HD11 LEU A 107 6.559 -9.502 -5.458 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.912 -9.412 -4.789 1.00 0.00 H new ATOM 0 HD13 LEU A 107 6.134 -10.445 -4.009 1.00 0.00 H new ATOM 0 HD21 LEU A 107 7.336 -11.591 -6.585 1.00 0.00 H new ATOM 0 HD22 LEU A 107 6.909 -12.533 -5.137 1.00 0.00 H new ATOM 0 HD23 LEU A 107 6.244 -12.989 -6.723 1.00 0.00 H new ATOM 1663 N GLU A 108 2.918 -11.323 -8.136 1.00 0.00 N ATOM 1664 CA GLU A 108 2.791 -11.795 -9.543 1.00 0.00 C ATOM 1665 C GLU A 108 4.164 -12.230 -10.060 1.00 0.00 C ATOM 1666 O GLU A 108 5.148 -12.192 -9.347 1.00 0.00 O ATOM 1667 CB GLU A 108 2.254 -10.660 -10.417 1.00 0.00 C ATOM 1668 CG GLU A 108 0.911 -10.181 -9.862 1.00 0.00 C ATOM 1669 CD GLU A 108 1.147 -9.043 -8.869 1.00 0.00 C ATOM 1670 OE1 GLU A 108 1.396 -7.935 -9.316 1.00 0.00 O ATOM 1671 OE2 GLU A 108 1.075 -9.297 -7.678 1.00 0.00 O ATOM 0 H GLU A 108 3.155 -10.337 -8.029 1.00 0.00 H new ATOM 0 HA GLU A 108 2.103 -12.639 -9.582 1.00 0.00 H new ATOM 0 HB2 GLU A 108 2.966 -9.835 -10.438 1.00 0.00 H new ATOM 0 HB3 GLU A 108 2.133 -11.004 -11.444 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.270 -9.841 -10.675 1.00 0.00 H new ATOM 0 HG3 GLU A 108 0.394 -11.005 -9.371 1.00 0.00 H new ATOM 1678 N SER A 109 4.239 -12.643 -11.296 1.00 0.00 N ATOM 1679 CA SER A 109 5.549 -13.081 -11.860 1.00 0.00 C ATOM 1680 C SER A 109 6.213 -11.905 -12.580 1.00 0.00 C ATOM 1681 O SER A 109 6.683 -12.033 -13.693 1.00 0.00 O ATOM 1682 CB SER A 109 5.319 -14.222 -12.852 1.00 0.00 C ATOM 1683 OG SER A 109 4.233 -15.021 -12.405 1.00 0.00 O ATOM 0 H SER A 109 3.450 -12.696 -11.940 1.00 0.00 H new ATOM 0 HA SER A 109 6.196 -13.425 -11.053 1.00 0.00 H new ATOM 0 HB2 SER A 109 5.106 -13.820 -13.843 1.00 0.00 H new ATOM 0 HB3 SER A 109 6.220 -14.829 -12.941 1.00 0.00 H new ATOM 0 HG SER A 109 4.082 -15.752 -13.040 1.00 0.00 H new ATOM 1689 N ASN A 110 6.259 -10.761 -11.953 1.00 0.00 N ATOM 1690 CA ASN A 110 6.895 -9.581 -12.605 1.00 0.00 C ATOM 1691 C ASN A 110 7.356 -8.593 -11.530 1.00 0.00 C ATOM 1692 O ASN A 110 7.515 -7.417 -11.784 1.00 0.00 O ATOM 1693 CB ASN A 110 5.884 -8.901 -13.530 1.00 0.00 C ATOM 1694 CG ASN A 110 5.786 -9.683 -14.841 1.00 0.00 C ATOM 1695 OD1 ASN A 110 6.765 -10.224 -15.314 1.00 0.00 O ATOM 1696 ND2 ASN A 110 4.636 -9.766 -15.453 1.00 0.00 N ATOM 0 H ASN A 110 5.884 -10.593 -11.019 1.00 0.00 H new ATOM 0 HA ASN A 110 7.755 -9.907 -13.190 1.00 0.00 H new ATOM 0 HB2 ASN A 110 4.908 -8.855 -13.048 1.00 0.00 H new ATOM 0 HB3 ASN A 110 6.190 -7.874 -13.729 1.00 0.00 H new ATOM 0 HD21 ASN A 110 4.560 -10.285 -16.328 1.00 0.00 H new ATOM 0 HD22 ASN A 110 3.813 -9.312 -15.056 1.00 0.00 H new ATOM 1703 N ASN A 111 7.574 -9.069 -10.333 1.00 0.00 N ATOM 1704 CA ASN A 111 8.030 -8.174 -9.227 1.00 0.00 C ATOM 1705 C ASN A 111 6.939 -7.151 -8.897 1.00 0.00 C ATOM 1706 O ASN A 111 7.195 -5.967 -8.808 1.00 0.00 O ATOM 1707 CB ASN A 111 9.310 -7.442 -9.643 1.00 0.00 C ATOM 1708 CG ASN A 111 10.214 -8.397 -10.425 1.00 0.00 C ATOM 1709 OD1 ASN A 111 10.041 -9.684 -10.305 1.00 0.00 O flip ATOM 1710 ND2 ASN A 111 11.089 -7.967 -11.150 1.00 0.00 N flip ATOM 0 H ASN A 111 7.455 -10.048 -10.071 1.00 0.00 H new ATOM 0 HA ASN A 111 8.232 -8.780 -8.344 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.063 -6.575 -10.256 1.00 0.00 H new ATOM 0 HB3 ASN A 111 9.832 -7.071 -8.761 1.00 0.00 H new ATOM 0 HD21 ASN A 111 11.225 -6.960 -11.244 1.00 0.00 H new ATOM 0 HD22 ASN A 111 11.688 -8.613 -11.665 1.00 0.00 H new ATOM 1717 N TYR A 112 5.727 -7.602 -8.704 1.00 0.00 N ATOM 1718 CA TYR A 112 4.617 -6.663 -8.365 1.00 0.00 C ATOM 1719 C TYR A 112 3.710 -7.309 -7.317 1.00 0.00 C ATOM 1720 O TYR A 112 3.279 -8.435 -7.465 1.00 0.00 O ATOM 1721 CB TYR A 112 3.801 -6.355 -9.622 1.00 0.00 C ATOM 1722 CG TYR A 112 4.560 -5.377 -10.484 1.00 0.00 C ATOM 1723 CD1 TYR A 112 4.579 -4.017 -10.154 1.00 0.00 C ATOM 1724 CD2 TYR A 112 5.248 -5.833 -11.613 1.00 0.00 C ATOM 1725 CE1 TYR A 112 5.285 -3.113 -10.955 1.00 0.00 C ATOM 1726 CE2 TYR A 112 5.956 -4.930 -12.414 1.00 0.00 C ATOM 1727 CZ TYR A 112 5.975 -3.569 -12.085 1.00 0.00 C ATOM 1728 OH TYR A 112 6.672 -2.678 -12.874 1.00 0.00 O ATOM 0 H TYR A 112 5.457 -8.584 -8.767 1.00 0.00 H new ATOM 0 HA TYR A 112 5.034 -5.737 -7.969 1.00 0.00 H new ATOM 0 HB2 TYR A 112 3.608 -7.273 -10.178 1.00 0.00 H new ATOM 0 HB3 TYR A 112 2.832 -5.939 -9.347 1.00 0.00 H new ATOM 0 HD1 TYR A 112 4.049 -3.666 -9.281 1.00 0.00 H new ATOM 0 HD2 TYR A 112 5.233 -6.883 -11.867 1.00 0.00 H new ATOM 0 HE1 TYR A 112 5.298 -2.063 -10.702 1.00 0.00 H new ATOM 0 HE2 TYR A 112 6.488 -5.283 -13.286 1.00 0.00 H new ATOM 0 HH TYR A 112 7.094 -3.159 -13.616 1.00 0.00 H new ATOM 1738 N ASN A 113 3.419 -6.605 -6.257 1.00 0.00 N ATOM 1739 CA ASN A 113 2.543 -7.178 -5.196 1.00 0.00 C ATOM 1740 C ASN A 113 1.095 -6.749 -5.438 1.00 0.00 C ATOM 1741 O ASN A 113 0.835 -5.732 -6.049 1.00 0.00 O ATOM 1742 CB ASN A 113 3.002 -6.671 -3.828 1.00 0.00 C ATOM 1743 CG ASN A 113 4.504 -6.916 -3.669 1.00 0.00 C ATOM 1744 OD1 ASN A 113 5.332 -6.399 -4.535 1.00 0.00 O flip ATOM 1745 ND2 ASN A 113 4.928 -7.583 -2.746 1.00 0.00 N flip ATOM 0 H ASN A 113 3.751 -5.657 -6.080 1.00 0.00 H new ATOM 0 HA ASN A 113 2.607 -8.266 -5.223 1.00 0.00 H new ATOM 0 HB2 ASN A 113 2.784 -5.607 -3.731 1.00 0.00 H new ATOM 0 HB3 ASN A 113 2.454 -7.182 -3.037 1.00 0.00 H new ATOM 0 HD21 ASN A 113 4.281 -7.987 -2.069 1.00 0.00 H new ATOM 0 HD22 ASN A 113 5.931 -7.739 -2.648 1.00 0.00 H new ATOM 1752 N THR A 114 0.153 -7.522 -4.959 1.00 0.00 N ATOM 1753 CA THR A 114 -1.287 -7.176 -5.148 1.00 0.00 C ATOM 1754 C THR A 114 -2.009 -7.288 -3.803 1.00 0.00 C ATOM 1755 O THR A 114 -2.051 -8.341 -3.199 1.00 0.00 O ATOM 1756 CB THR A 114 -1.920 -8.145 -6.149 1.00 0.00 C ATOM 1757 OG1 THR A 114 -1.606 -9.479 -5.777 1.00 0.00 O ATOM 1758 CG2 THR A 114 -1.377 -7.863 -7.550 1.00 0.00 C ATOM 0 H THR A 114 0.322 -8.384 -4.441 1.00 0.00 H new ATOM 0 HA THR A 114 -1.373 -6.158 -5.529 1.00 0.00 H new ATOM 0 HB THR A 114 -3.002 -8.012 -6.149 1.00 0.00 H new ATOM 0 HG1 THR A 114 -0.657 -9.652 -5.949 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.829 -8.554 -8.261 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.619 -6.839 -7.835 1.00 0.00 H new ATOM 0 HG23 THR A 114 -0.295 -7.994 -7.554 1.00 0.00 H new ATOM 1766 N TYR A 115 -2.572 -6.212 -3.328 1.00 0.00 N ATOM 1767 CA TYR A 115 -3.282 -6.258 -2.018 1.00 0.00 C ATOM 1768 C TYR A 115 -4.771 -6.535 -2.244 1.00 0.00 C ATOM 1769 O TYR A 115 -5.508 -5.683 -2.703 1.00 0.00 O ATOM 1770 CB TYR A 115 -3.118 -4.915 -1.304 1.00 0.00 C ATOM 1771 CG TYR A 115 -1.671 -4.723 -0.916 1.00 0.00 C ATOM 1772 CD1 TYR A 115 -1.120 -5.474 0.129 1.00 0.00 C ATOM 1773 CD2 TYR A 115 -0.881 -3.793 -1.603 1.00 0.00 C ATOM 1774 CE1 TYR A 115 0.222 -5.294 0.489 1.00 0.00 C ATOM 1775 CE2 TYR A 115 0.461 -3.613 -1.243 1.00 0.00 C ATOM 1776 CZ TYR A 115 1.012 -4.364 -0.197 1.00 0.00 C ATOM 1777 OH TYR A 115 2.334 -4.188 0.158 1.00 0.00 O ATOM 0 H TYR A 115 -2.571 -5.303 -3.790 1.00 0.00 H new ATOM 0 HA TYR A 115 -2.857 -7.054 -1.406 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -3.442 -4.103 -1.955 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -3.751 -4.883 -0.417 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -1.729 -6.192 0.658 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -1.306 -3.215 -2.410 1.00 0.00 H new ATOM 0 HE1 TYR A 115 0.647 -5.873 1.296 1.00 0.00 H new ATOM 0 HE2 TYR A 115 1.070 -2.895 -1.772 1.00 0.00 H new ATOM 0 HH TYR A 115 2.692 -5.028 0.513 1.00 0.00 H new ATOM 1787 N ARG A 116 -5.219 -7.721 -1.917 1.00 0.00 N ATOM 1788 CA ARG A 116 -6.661 -8.062 -2.101 1.00 0.00 C ATOM 1789 C ARG A 116 -7.377 -7.977 -0.751 1.00 0.00 C ATOM 1790 O ARG A 116 -6.798 -8.236 0.286 1.00 0.00 O ATOM 1791 CB ARG A 116 -6.780 -9.484 -2.657 1.00 0.00 C ATOM 1792 CG ARG A 116 -8.243 -9.782 -2.991 1.00 0.00 C ATOM 1793 CD ARG A 116 -8.367 -11.220 -3.499 1.00 0.00 C ATOM 1794 NE ARG A 116 -7.879 -12.162 -2.452 1.00 0.00 N ATOM 1795 CZ ARG A 116 -8.162 -13.432 -2.536 1.00 0.00 C ATOM 1796 NH1 ARG A 116 -8.872 -13.877 -3.536 1.00 0.00 N ATOM 1797 NH2 ARG A 116 -7.735 -14.258 -1.619 1.00 0.00 N ATOM 0 H ARG A 116 -4.645 -8.470 -1.529 1.00 0.00 H new ATOM 0 HA ARG A 116 -7.118 -7.361 -2.799 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -6.164 -9.589 -3.550 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -6.409 -10.203 -1.927 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -8.865 -9.642 -2.107 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -8.604 -9.085 -3.748 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -9.405 -11.441 -3.746 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -7.788 -11.345 -4.414 1.00 0.00 H new ATOM 0 HE ARG A 116 -7.324 -11.813 -1.670 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -9.206 -13.231 -4.252 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -9.094 -14.870 -3.602 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -7.180 -13.910 -0.837 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -7.956 -15.252 -1.685 1.00 0.00 H new ATOM 1811 N SER A 117 -8.632 -7.611 -0.752 1.00 0.00 N ATOM 1812 CA SER A 117 -9.376 -7.504 0.537 1.00 0.00 C ATOM 1813 C SER A 117 -9.666 -8.902 1.091 1.00 0.00 C ATOM 1814 O SER A 117 -9.695 -9.876 0.365 1.00 0.00 O ATOM 1815 CB SER A 117 -10.694 -6.764 0.304 1.00 0.00 C ATOM 1816 OG SER A 117 -11.592 -7.058 1.366 1.00 0.00 O ATOM 0 H SER A 117 -9.172 -7.382 -1.587 1.00 0.00 H new ATOM 0 HA SER A 117 -8.769 -6.954 1.256 1.00 0.00 H new ATOM 0 HB2 SER A 117 -10.517 -5.690 0.249 1.00 0.00 H new ATOM 0 HB3 SER A 117 -11.129 -7.064 -0.649 1.00 0.00 H new ATOM 0 HG SER A 117 -12.080 -6.246 1.616 1.00 0.00 H new ATOM 1822 N ARG A 118 -9.882 -9.005 2.376 1.00 0.00 N ATOM 1823 CA ARG A 118 -10.170 -10.337 2.985 1.00 0.00 C ATOM 1824 C ARG A 118 -11.685 -10.545 3.062 1.00 0.00 C ATOM 1825 O ARG A 118 -12.262 -11.275 2.280 1.00 0.00 O ATOM 1826 CB ARG A 118 -9.577 -10.390 4.396 1.00 0.00 C ATOM 1827 CG ARG A 118 -9.766 -11.793 4.983 1.00 0.00 C ATOM 1828 CD ARG A 118 -9.176 -11.836 6.397 1.00 0.00 C ATOM 1829 NE ARG A 118 -8.298 -13.041 6.563 1.00 0.00 N ATOM 1830 CZ ARG A 118 -8.690 -14.228 6.177 1.00 0.00 C ATOM 1831 NH1 ARG A 118 -9.892 -14.405 5.704 1.00 0.00 N ATOM 1832 NH2 ARG A 118 -7.880 -15.245 6.288 1.00 0.00 N ATOM 0 H ARG A 118 -9.871 -8.223 3.031 1.00 0.00 H new ATOM 0 HA ARG A 118 -9.725 -11.121 2.373 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -8.517 -10.138 4.365 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -10.062 -9.650 5.033 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -10.825 -12.048 5.011 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -9.277 -12.533 4.350 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -8.600 -10.930 6.585 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -9.980 -11.860 7.132 1.00 0.00 H new ATOM 0 HE ARG A 118 -7.376 -12.933 6.986 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -10.534 -13.615 5.633 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -10.191 -15.333 5.405 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -6.945 -15.113 6.674 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -8.182 -16.172 5.988 1.00 0.00 H new ATOM 1846 N LYS A 119 -12.331 -9.913 4.004 1.00 0.00 N ATOM 1847 CA LYS A 119 -13.807 -10.077 4.136 1.00 0.00 C ATOM 1848 C LYS A 119 -14.474 -9.824 2.784 1.00 0.00 C ATOM 1849 O LYS A 119 -15.650 -10.078 2.605 1.00 0.00 O ATOM 1850 CB LYS A 119 -14.338 -9.076 5.166 1.00 0.00 C ATOM 1851 CG LYS A 119 -15.712 -9.532 5.661 1.00 0.00 C ATOM 1852 CD LYS A 119 -16.258 -8.510 6.660 1.00 0.00 C ATOM 1853 CE LYS A 119 -17.746 -8.774 6.902 1.00 0.00 C ATOM 1854 NZ LYS A 119 -17.931 -10.172 7.382 1.00 0.00 N ATOM 0 H LYS A 119 -11.901 -9.290 4.688 1.00 0.00 H new ATOM 0 HA LYS A 119 -14.033 -11.092 4.464 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -13.645 -8.999 6.004 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -14.411 -8.084 4.720 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -16.397 -9.637 4.820 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -15.634 -10.512 6.132 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -15.709 -8.575 7.599 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -16.115 -7.500 6.277 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -18.136 -8.071 7.638 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -18.309 -8.617 5.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -18.878 -10.273 7.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -17.834 -10.829 6.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -17.211 -10.391 8.100 1.00 0.00 H new ATOM 1868 N TYR A 120 -13.734 -9.328 1.829 1.00 0.00 N ATOM 1869 CA TYR A 120 -14.320 -9.060 0.485 1.00 0.00 C ATOM 1870 C TYR A 120 -13.286 -9.389 -0.593 1.00 0.00 C ATOM 1871 O TYR A 120 -12.842 -8.528 -1.326 1.00 0.00 O ATOM 1872 CB TYR A 120 -14.713 -7.584 0.382 1.00 0.00 C ATOM 1873 CG TYR A 120 -15.485 -7.180 1.615 1.00 0.00 C ATOM 1874 CD1 TYR A 120 -16.775 -7.681 1.828 1.00 0.00 C ATOM 1875 CD2 TYR A 120 -14.912 -6.305 2.547 1.00 0.00 C ATOM 1876 CE1 TYR A 120 -17.492 -7.307 2.971 1.00 0.00 C ATOM 1877 CE2 TYR A 120 -15.629 -5.932 3.690 1.00 0.00 C ATOM 1878 CZ TYR A 120 -16.919 -6.433 3.902 1.00 0.00 C ATOM 1879 OH TYR A 120 -17.625 -6.065 5.029 1.00 0.00 O ATOM 0 H TYR A 120 -12.745 -9.096 1.923 1.00 0.00 H new ATOM 0 HA TYR A 120 -15.205 -9.680 0.344 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -13.821 -6.966 0.280 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -15.319 -7.420 -0.509 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -17.217 -8.356 1.110 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -13.917 -5.918 2.384 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -18.487 -7.693 3.134 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -15.187 -5.258 4.408 1.00 0.00 H new ATOM 0 HH TYR A 120 -17.082 -5.455 5.570 1.00 0.00 H new ATOM 1889 N THR A 121 -12.899 -10.631 -0.694 1.00 0.00 N ATOM 1890 CA THR A 121 -11.892 -11.018 -1.722 1.00 0.00 C ATOM 1891 C THR A 121 -12.457 -10.765 -3.121 1.00 0.00 C ATOM 1892 O THR A 121 -11.834 -11.076 -4.117 1.00 0.00 O ATOM 1893 CB THR A 121 -11.554 -12.504 -1.570 1.00 0.00 C ATOM 1894 OG1 THR A 121 -12.642 -13.285 -2.046 1.00 0.00 O ATOM 1895 CG2 THR A 121 -11.301 -12.823 -0.096 1.00 0.00 C ATOM 0 H THR A 121 -13.237 -11.395 -0.109 1.00 0.00 H new ATOM 0 HA THR A 121 -10.990 -10.422 -1.585 1.00 0.00 H new ATOM 0 HB THR A 121 -10.659 -12.735 -2.148 1.00 0.00 H new ATOM 0 HG1 THR A 121 -12.428 -14.237 -1.951 1.00 0.00 H new ATOM 0 HG21 THR A 121 -11.061 -13.881 0.011 1.00 0.00 H new ATOM 0 HG22 THR A 121 -10.467 -12.223 0.268 1.00 0.00 H new ATOM 0 HG23 THR A 121 -12.195 -12.593 0.485 1.00 0.00 H new ATOM 1903 N SER A 122 -13.633 -10.205 -3.207 1.00 0.00 N ATOM 1904 CA SER A 122 -14.231 -9.936 -4.545 1.00 0.00 C ATOM 1905 C SER A 122 -13.814 -8.545 -5.023 1.00 0.00 C ATOM 1906 O SER A 122 -14.347 -8.024 -5.983 1.00 0.00 O ATOM 1907 CB SER A 122 -15.755 -10.004 -4.444 1.00 0.00 C ATOM 1908 OG SER A 122 -16.163 -11.365 -4.382 1.00 0.00 O ATOM 0 H SER A 122 -14.204 -9.923 -2.410 1.00 0.00 H new ATOM 0 HA SER A 122 -13.879 -10.683 -5.256 1.00 0.00 H new ATOM 0 HB2 SER A 122 -16.096 -9.470 -3.557 1.00 0.00 H new ATOM 0 HB3 SER A 122 -16.210 -9.515 -5.305 1.00 0.00 H new ATOM 0 HG SER A 122 -17.140 -11.411 -4.315 1.00 0.00 H new ATOM 1914 N TRP A 123 -12.867 -7.934 -4.363 1.00 0.00 N ATOM 1915 CA TRP A 123 -12.427 -6.575 -4.789 1.00 0.00 C ATOM 1916 C TRP A 123 -10.980 -6.336 -4.350 1.00 0.00 C ATOM 1917 O TRP A 123 -10.553 -6.793 -3.306 1.00 0.00 O ATOM 1918 CB TRP A 123 -13.336 -5.522 -4.154 1.00 0.00 C ATOM 1919 CG TRP A 123 -14.605 -5.426 -4.939 1.00 0.00 C ATOM 1920 CD1 TRP A 123 -14.684 -5.093 -6.247 1.00 0.00 C ATOM 1921 CD2 TRP A 123 -15.973 -5.656 -4.492 1.00 0.00 C ATOM 1922 NE1 TRP A 123 -16.012 -5.106 -6.633 1.00 0.00 N ATOM 1923 CE2 TRP A 123 -16.845 -5.447 -5.586 1.00 0.00 C ATOM 1924 CE3 TRP A 123 -16.535 -6.023 -3.256 1.00 0.00 C ATOM 1925 CZ2 TRP A 123 -18.227 -5.595 -5.460 1.00 0.00 C ATOM 1926 CZ3 TRP A 123 -17.927 -6.174 -3.125 1.00 0.00 C ATOM 1927 CH2 TRP A 123 -18.770 -5.961 -4.224 1.00 0.00 C ATOM 0 H TRP A 123 -12.381 -8.315 -3.551 1.00 0.00 H new ATOM 0 HA TRP A 123 -12.488 -6.501 -5.875 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -13.554 -5.789 -3.120 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -12.833 -4.555 -4.134 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -13.847 -4.856 -6.886 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -16.336 -4.890 -7.576 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -15.894 -6.190 -2.403 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 -18.872 -5.428 -6.310 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -18.349 -6.456 -2.172 1.00 0.00 H new ATOM 0 HH2 TRP A 123 -19.838 -6.079 -4.117 1.00 0.00 H new ATOM 1938 N TYR A 124 -10.229 -5.617 -5.146 1.00 0.00 N ATOM 1939 CA TYR A 124 -8.804 -5.330 -4.801 1.00 0.00 C ATOM 1940 C TYR A 124 -8.635 -3.833 -4.540 1.00 0.00 C ATOM 1941 O TYR A 124 -9.503 -3.038 -4.842 1.00 0.00 O ATOM 1942 CB TYR A 124 -7.907 -5.743 -5.970 1.00 0.00 C ATOM 1943 CG TYR A 124 -8.046 -7.226 -6.217 1.00 0.00 C ATOM 1944 CD1 TYR A 124 -9.217 -7.733 -6.795 1.00 0.00 C ATOM 1945 CD2 TYR A 124 -7.005 -8.094 -5.870 1.00 0.00 C ATOM 1946 CE1 TYR A 124 -9.345 -9.108 -7.026 1.00 0.00 C ATOM 1947 CE2 TYR A 124 -7.133 -9.469 -6.101 1.00 0.00 C ATOM 1948 CZ TYR A 124 -8.303 -9.976 -6.679 1.00 0.00 C ATOM 1949 OH TYR A 124 -8.430 -11.331 -6.907 1.00 0.00 O ATOM 0 H TYR A 124 -10.546 -5.213 -6.028 1.00 0.00 H new ATOM 0 HA TYR A 124 -8.526 -5.890 -3.908 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -8.182 -5.188 -6.867 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -6.868 -5.497 -5.749 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -10.021 -7.063 -7.062 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -6.102 -7.703 -5.424 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -10.248 -9.499 -7.472 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -6.329 -10.139 -5.833 1.00 0.00 H new ATOM 0 HH TYR A 124 -7.617 -11.790 -6.610 1.00 0.00 H new ATOM 1959 N VAL A 125 -7.520 -3.441 -3.986 1.00 0.00 N ATOM 1960 CA VAL A 125 -7.292 -1.994 -3.710 1.00 0.00 C ATOM 1961 C VAL A 125 -6.542 -1.366 -4.887 1.00 0.00 C ATOM 1962 O VAL A 125 -5.529 -1.870 -5.328 1.00 0.00 O ATOM 1963 CB VAL A 125 -6.461 -1.841 -2.435 1.00 0.00 C ATOM 1964 CG1 VAL A 125 -6.516 -0.388 -1.960 1.00 0.00 C ATOM 1965 CG2 VAL A 125 -7.027 -2.756 -1.347 1.00 0.00 C ATOM 0 H VAL A 125 -6.757 -4.060 -3.713 1.00 0.00 H new ATOM 0 HA VAL A 125 -8.251 -1.493 -3.579 1.00 0.00 H new ATOM 0 HB VAL A 125 -5.426 -2.116 -2.640 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -5.924 -0.280 -1.051 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -6.114 0.264 -2.735 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -7.550 -0.111 -1.754 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -6.436 -2.648 -0.437 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -8.062 -2.481 -1.142 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -6.987 -3.791 -1.685 1.00 0.00 H new ATOM 1975 N ALA A 126 -7.032 -0.271 -5.402 1.00 0.00 N ATOM 1976 CA ALA A 126 -6.342 0.381 -6.552 1.00 0.00 C ATOM 1977 C ALA A 126 -6.669 1.877 -6.568 1.00 0.00 C ATOM 1978 O ALA A 126 -7.732 2.291 -6.153 1.00 0.00 O ATOM 1979 CB ALA A 126 -6.818 -0.258 -7.859 1.00 0.00 C ATOM 0 H ALA A 126 -7.877 0.199 -5.078 1.00 0.00 H new ATOM 0 HA ALA A 126 -5.265 0.248 -6.450 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.315 0.217 -8.701 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.584 -1.322 -7.850 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -7.895 -0.125 -7.958 1.00 0.00 H new ATOM 1985 N LEU A 127 -5.758 2.685 -7.047 1.00 0.00 N ATOM 1986 CA LEU A 127 -5.998 4.157 -7.097 1.00 0.00 C ATOM 1987 C LEU A 127 -6.242 4.587 -8.546 1.00 0.00 C ATOM 1988 O LEU A 127 -6.159 3.791 -9.461 1.00 0.00 O ATOM 1989 CB LEU A 127 -4.768 4.892 -6.558 1.00 0.00 C ATOM 1990 CG LEU A 127 -4.287 4.215 -5.274 1.00 0.00 C ATOM 1991 CD1 LEU A 127 -3.089 4.982 -4.713 1.00 0.00 C ATOM 1992 CD2 LEU A 127 -5.419 4.215 -4.244 1.00 0.00 C ATOM 0 H LEU A 127 -4.852 2.385 -7.408 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.870 4.401 -6.490 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.973 4.887 -7.304 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -5.013 5.936 -6.361 1.00 0.00 H new ATOM 0 HG LEU A 127 -3.993 3.188 -5.492 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.745 4.501 -3.798 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.283 4.985 -5.447 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -3.384 6.008 -4.494 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -5.078 3.733 -3.328 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -5.712 5.242 -4.026 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -6.275 3.670 -4.644 1.00 0.00 H new ATOM 2004 N LYS A 128 -6.538 5.840 -8.760 1.00 0.00 N ATOM 2005 CA LYS A 128 -6.783 6.327 -10.149 1.00 0.00 C ATOM 2006 C LYS A 128 -5.491 6.925 -10.710 1.00 0.00 C ATOM 2007 O LYS A 128 -4.424 6.750 -10.155 1.00 0.00 O ATOM 2008 CB LYS A 128 -7.871 7.402 -10.130 1.00 0.00 C ATOM 2009 CG LYS A 128 -9.218 6.765 -9.780 1.00 0.00 C ATOM 2010 CD LYS A 128 -9.915 6.306 -11.062 1.00 0.00 C ATOM 2011 CE LYS A 128 -10.684 7.478 -11.674 1.00 0.00 C ATOM 2012 NZ LYS A 128 -10.700 7.342 -13.158 1.00 0.00 N ATOM 0 H LYS A 128 -6.621 6.549 -8.032 1.00 0.00 H new ATOM 0 HA LYS A 128 -7.105 5.495 -10.775 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -7.622 8.173 -9.401 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -7.930 7.891 -11.103 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -9.068 5.917 -9.111 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -9.845 7.482 -9.250 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -9.180 5.929 -11.773 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -10.597 5.485 -10.843 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -11.704 7.498 -11.289 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -10.217 8.421 -11.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -11.223 8.139 -13.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -9.724 7.343 -13.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -11.164 6.449 -13.420 1.00 0.00 H new ATOM 2026 N ARG A 129 -5.580 7.631 -11.804 1.00 0.00 N ATOM 2027 CA ARG A 129 -4.357 8.243 -12.397 1.00 0.00 C ATOM 2028 C ARG A 129 -4.208 9.677 -11.885 1.00 0.00 C ATOM 2029 O ARG A 129 -3.151 10.270 -11.967 1.00 0.00 O ATOM 2030 CB ARG A 129 -4.480 8.256 -13.922 1.00 0.00 C ATOM 2031 CG ARG A 129 -5.836 8.841 -14.323 1.00 0.00 C ATOM 2032 CD ARG A 129 -5.657 9.763 -15.530 1.00 0.00 C ATOM 2033 NE ARG A 129 -4.725 9.128 -16.505 1.00 0.00 N ATOM 2034 CZ ARG A 129 -4.648 9.582 -17.726 1.00 0.00 C ATOM 2035 NH1 ARG A 129 -5.386 10.595 -18.093 1.00 0.00 N ATOM 2036 NH2 ARG A 129 -3.834 9.025 -18.580 1.00 0.00 N ATOM 0 H ARG A 129 -6.446 7.810 -12.312 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.482 7.660 -12.109 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.674 8.848 -14.357 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -4.379 7.244 -14.314 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -6.533 8.039 -14.565 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -6.266 9.396 -13.489 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -6.621 9.953 -16.002 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -5.263 10.728 -15.209 1.00 0.00 H new ATOM 0 HE ARG A 129 -4.147 8.338 -16.218 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -6.022 11.031 -17.425 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -5.326 10.950 -19.047 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -3.257 8.234 -18.293 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -3.774 9.380 -19.534 1.00 0.00 H new ATOM 2050 N THR A 130 -5.261 10.238 -11.353 1.00 0.00 N ATOM 2051 CA THR A 130 -5.185 11.633 -10.833 1.00 0.00 C ATOM 2052 C THR A 130 -4.898 11.601 -9.331 1.00 0.00 C ATOM 2053 O THR A 130 -4.826 12.625 -8.681 1.00 0.00 O ATOM 2054 CB THR A 130 -6.517 12.343 -11.083 1.00 0.00 C ATOM 2055 OG1 THR A 130 -6.598 13.498 -10.259 1.00 0.00 O ATOM 2056 CG2 THR A 130 -7.672 11.397 -10.753 1.00 0.00 C ATOM 0 H THR A 130 -6.172 9.789 -11.256 1.00 0.00 H new ATOM 0 HA THR A 130 -4.386 12.169 -11.345 1.00 0.00 H new ATOM 0 HB THR A 130 -6.581 12.638 -12.130 1.00 0.00 H new ATOM 0 HG1 THR A 130 -5.757 13.609 -9.768 1.00 0.00 H new ATOM 0 HG21 THR A 130 -8.620 11.904 -10.932 1.00 0.00 H new ATOM 0 HG22 THR A 130 -7.609 10.512 -11.386 1.00 0.00 H new ATOM 0 HG23 THR A 130 -7.611 11.100 -9.706 1.00 0.00 H new ATOM 2064 N GLY A 131 -4.732 10.431 -8.774 1.00 0.00 N ATOM 2065 CA GLY A 131 -4.448 10.333 -7.314 1.00 0.00 C ATOM 2066 C GLY A 131 -5.756 10.121 -6.549 1.00 0.00 C ATOM 2067 O GLY A 131 -5.803 10.230 -5.339 1.00 0.00 O ATOM 0 H GLY A 131 -4.781 9.540 -9.267 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -3.764 9.506 -7.121 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -3.956 11.242 -6.967 1.00 0.00 H new ATOM 2071 N GLN A 132 -6.820 9.818 -7.242 1.00 0.00 N ATOM 2072 CA GLN A 132 -8.123 9.600 -6.552 1.00 0.00 C ATOM 2073 C GLN A 132 -8.299 8.109 -6.255 1.00 0.00 C ATOM 2074 O GLN A 132 -7.923 7.261 -7.039 1.00 0.00 O ATOM 2075 CB GLN A 132 -9.264 10.081 -7.451 1.00 0.00 C ATOM 2076 CG GLN A 132 -9.187 11.600 -7.608 1.00 0.00 C ATOM 2077 CD GLN A 132 -9.546 12.269 -6.280 1.00 0.00 C ATOM 2078 OE1 GLN A 132 -10.449 11.835 -5.592 1.00 0.00 O ATOM 2079 NE2 GLN A 132 -8.873 13.315 -5.887 1.00 0.00 N ATOM 0 H GLN A 132 -6.843 9.712 -8.256 1.00 0.00 H new ATOM 0 HA GLN A 132 -8.138 10.161 -5.617 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -9.199 9.601 -8.427 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -10.224 9.798 -7.020 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -8.184 11.894 -7.916 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -9.870 11.931 -8.390 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -8.115 13.680 -6.464 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -9.105 13.768 -5.003 1.00 0.00 H new ATOM 2088 N TYR A 133 -8.869 7.785 -5.127 1.00 0.00 N ATOM 2089 CA TYR A 133 -9.070 6.349 -4.776 1.00 0.00 C ATOM 2090 C TYR A 133 -10.124 5.737 -5.702 1.00 0.00 C ATOM 2091 O TYR A 133 -11.254 6.182 -5.755 1.00 0.00 O ATOM 2092 CB TYR A 133 -9.536 6.240 -3.321 1.00 0.00 C ATOM 2093 CG TYR A 133 -10.967 6.705 -3.208 1.00 0.00 C ATOM 2094 CD1 TYR A 133 -11.262 8.074 -3.208 1.00 0.00 C ATOM 2095 CD2 TYR A 133 -12.002 5.767 -3.105 1.00 0.00 C ATOM 2096 CE1 TYR A 133 -12.590 8.505 -3.104 1.00 0.00 C ATOM 2097 CE2 TYR A 133 -13.330 6.198 -3.001 1.00 0.00 C ATOM 2098 CZ TYR A 133 -13.623 7.566 -3.001 1.00 0.00 C ATOM 2099 OH TYR A 133 -14.933 7.992 -2.898 1.00 0.00 O ATOM 0 H TYR A 133 -9.205 8.452 -4.432 1.00 0.00 H new ATOM 0 HA TYR A 133 -8.130 5.811 -4.896 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -9.451 5.209 -2.978 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -8.896 6.844 -2.678 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -10.464 8.798 -3.288 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -11.776 4.711 -3.106 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -12.817 9.561 -3.103 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -14.128 5.475 -2.921 1.00 0.00 H new ATOM 0 HH TYR A 133 -15.526 7.214 -2.836 1.00 0.00 H new ATOM 2109 N LYS A 134 -9.764 4.719 -6.436 1.00 0.00 N ATOM 2110 CA LYS A 134 -10.745 4.081 -7.359 1.00 0.00 C ATOM 2111 C LYS A 134 -11.809 3.346 -6.541 1.00 0.00 C ATOM 2112 O LYS A 134 -11.502 2.582 -5.648 1.00 0.00 O ATOM 2113 CB LYS A 134 -10.018 3.083 -8.263 1.00 0.00 C ATOM 2114 CG LYS A 134 -11.021 2.422 -9.212 1.00 0.00 C ATOM 2115 CD LYS A 134 -10.379 2.241 -10.589 1.00 0.00 C ATOM 2116 CE LYS A 134 -9.116 1.388 -10.455 1.00 0.00 C ATOM 2117 NZ LYS A 134 -7.925 2.276 -10.343 1.00 0.00 N ATOM 0 H LYS A 134 -8.833 4.302 -6.436 1.00 0.00 H new ATOM 0 HA LYS A 134 -11.221 4.847 -7.971 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -9.243 3.593 -8.835 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -9.521 2.325 -7.658 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.332 1.456 -8.814 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -11.918 3.036 -9.295 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -11.083 1.763 -11.270 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.131 3.212 -11.017 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.189 0.747 -9.576 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.014 0.732 -11.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.150 1.892 -10.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -8.170 3.229 -10.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -7.622 2.327 -9.349 1.00 0.00 H new ATOM 2131 N LEU A 135 -13.061 3.573 -6.837 1.00 0.00 N ATOM 2132 CA LEU A 135 -14.143 2.887 -6.073 1.00 0.00 C ATOM 2133 C LEU A 135 -13.822 1.394 -5.966 1.00 0.00 C ATOM 2134 O LEU A 135 -13.211 0.817 -6.844 1.00 0.00 O ATOM 2135 CB LEU A 135 -15.477 3.073 -6.802 1.00 0.00 C ATOM 2136 CG LEU A 135 -16.641 2.834 -5.830 1.00 0.00 C ATOM 2137 CD1 LEU A 135 -16.701 3.953 -4.781 1.00 0.00 C ATOM 2138 CD2 LEU A 135 -17.957 2.809 -6.612 1.00 0.00 C ATOM 0 H LEU A 135 -13.381 4.202 -7.573 1.00 0.00 H new ATOM 0 HA LEU A 135 -14.213 3.316 -5.073 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.538 4.080 -7.216 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -15.543 2.379 -7.640 1.00 0.00 H new ATOM 0 HG LEU A 135 -16.487 1.881 -5.324 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -17.532 3.769 -4.100 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -15.768 3.975 -4.218 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -16.846 4.911 -5.279 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -18.786 2.639 -5.924 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -18.097 3.763 -7.120 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -17.927 2.007 -7.349 1.00 0.00 H new ATOM 2150 N GLY A 136 -14.225 0.767 -4.896 1.00 0.00 N ATOM 2151 CA GLY A 136 -13.941 -0.688 -4.732 1.00 0.00 C ATOM 2152 C GLY A 136 -14.674 -1.480 -5.816 1.00 0.00 C ATOM 2153 O GLY A 136 -14.213 -2.513 -6.259 1.00 0.00 O ATOM 0 H GLY A 136 -14.739 1.198 -4.128 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -12.868 -0.869 -4.798 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -14.260 -1.022 -3.745 1.00 0.00 H new ATOM 2157 N SER A 137 -15.813 -1.010 -6.244 1.00 0.00 N ATOM 2158 CA SER A 137 -16.572 -1.741 -7.297 1.00 0.00 C ATOM 2159 C SER A 137 -15.934 -1.480 -8.662 1.00 0.00 C ATOM 2160 O SER A 137 -16.197 -2.174 -9.624 1.00 0.00 O ATOM 2161 CB SER A 137 -18.022 -1.256 -7.311 1.00 0.00 C ATOM 2162 OG SER A 137 -18.098 -0.027 -8.022 1.00 0.00 O ATOM 0 H SER A 137 -16.251 -0.151 -5.910 1.00 0.00 H new ATOM 0 HA SER A 137 -16.548 -2.810 -7.084 1.00 0.00 H new ATOM 0 HB2 SER A 137 -18.663 -2.002 -7.781 1.00 0.00 H new ATOM 0 HB3 SER A 137 -18.383 -1.123 -6.291 1.00 0.00 H new ATOM 0 HG SER A 137 -19.026 0.287 -8.035 1.00 0.00 H new ATOM 2168 N LYS A 138 -15.098 -0.482 -8.757 1.00 0.00 N ATOM 2169 CA LYS A 138 -14.445 -0.178 -10.062 1.00 0.00 C ATOM 2170 C LYS A 138 -13.140 -0.967 -10.177 1.00 0.00 C ATOM 2171 O LYS A 138 -12.480 -0.947 -11.197 1.00 0.00 O ATOM 2172 CB LYS A 138 -14.147 1.320 -10.146 1.00 0.00 C ATOM 2173 CG LYS A 138 -15.422 2.074 -10.532 1.00 0.00 C ATOM 2174 CD LYS A 138 -15.144 3.578 -10.541 1.00 0.00 C ATOM 2175 CE LYS A 138 -16.251 4.297 -11.313 1.00 0.00 C ATOM 2176 NZ LYS A 138 -17.502 3.489 -11.255 1.00 0.00 N ATOM 0 H LYS A 138 -14.839 0.136 -7.988 1.00 0.00 H new ATOM 0 HA LYS A 138 -15.112 -0.461 -10.876 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -13.774 1.682 -9.188 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -13.365 1.505 -10.883 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -15.764 1.751 -11.515 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -16.220 1.845 -9.826 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -15.094 3.955 -9.520 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -14.176 3.777 -11.002 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -16.424 5.285 -10.887 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -15.949 4.445 -12.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -18.311 4.081 -11.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -17.424 2.681 -11.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -17.646 3.141 -10.286 1.00 0.00 H new ATOM 2190 N THR A 139 -12.762 -1.663 -9.140 1.00 0.00 N ATOM 2191 CA THR A 139 -11.499 -2.451 -9.193 1.00 0.00 C ATOM 2192 C THR A 139 -11.789 -3.838 -9.772 1.00 0.00 C ATOM 2193 O THR A 139 -12.902 -4.321 -9.723 1.00 0.00 O ATOM 2194 CB THR A 139 -10.928 -2.598 -7.781 1.00 0.00 C ATOM 2195 OG1 THR A 139 -11.874 -3.264 -6.957 1.00 0.00 O ATOM 2196 CG2 THR A 139 -10.629 -1.214 -7.201 1.00 0.00 C ATOM 0 H THR A 139 -13.273 -1.720 -8.259 1.00 0.00 H new ATOM 0 HA THR A 139 -10.776 -1.936 -9.825 1.00 0.00 H new ATOM 0 HB THR A 139 -10.006 -3.179 -7.821 1.00 0.00 H new ATOM 0 HG1 THR A 139 -12.561 -2.628 -6.667 1.00 0.00 H new ATOM 0 HG21 THR A 139 -10.222 -1.321 -6.195 1.00 0.00 H new ATOM 0 HG22 THR A 139 -9.903 -0.704 -7.834 1.00 0.00 H new ATOM 0 HG23 THR A 139 -11.549 -0.630 -7.160 1.00 0.00 H new ATOM 2204 N GLY A 140 -10.795 -4.481 -10.320 1.00 0.00 N ATOM 2205 CA GLY A 140 -11.015 -5.836 -10.902 1.00 0.00 C ATOM 2206 C GLY A 140 -9.798 -6.230 -11.747 1.00 0.00 C ATOM 2207 O GLY A 140 -8.855 -5.471 -11.853 1.00 0.00 O ATOM 0 H GLY A 140 -9.841 -4.128 -10.390 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -11.171 -6.565 -10.107 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -11.915 -5.838 -11.517 1.00 0.00 H new ATOM 2211 N PRO A 141 -9.850 -7.406 -12.324 1.00 0.00 N ATOM 2212 CA PRO A 141 -8.749 -7.910 -13.163 1.00 0.00 C ATOM 2213 C PRO A 141 -8.529 -6.982 -14.362 1.00 0.00 C ATOM 2214 O PRO A 141 -9.347 -6.136 -14.663 1.00 0.00 O ATOM 2215 CB PRO A 141 -9.212 -9.296 -13.633 1.00 0.00 C ATOM 2216 CG PRO A 141 -10.616 -9.553 -13.028 1.00 0.00 C ATOM 2217 CD PRO A 141 -11.000 -8.323 -12.191 1.00 0.00 C ATOM 0 HA PRO A 141 -7.804 -7.957 -12.621 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -9.251 -9.338 -14.722 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -8.510 -10.064 -13.310 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -11.348 -9.720 -13.818 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -10.606 -10.449 -12.408 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -11.917 -7.864 -12.559 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -11.174 -8.592 -11.149 1.00 0.00 H new ATOM 2225 N GLY A 142 -7.429 -7.134 -15.048 1.00 0.00 N ATOM 2226 CA GLY A 142 -7.157 -6.261 -16.225 1.00 0.00 C ATOM 2227 C GLY A 142 -6.654 -4.898 -15.747 1.00 0.00 C ATOM 2228 O GLY A 142 -5.843 -4.264 -16.392 1.00 0.00 O ATOM 0 H GLY A 142 -6.707 -7.825 -14.844 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -6.415 -6.727 -16.873 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -8.064 -6.138 -16.817 1.00 0.00 H new ATOM 2232 N GLN A 143 -7.128 -4.441 -14.620 1.00 0.00 N ATOM 2233 CA GLN A 143 -6.676 -3.119 -14.102 1.00 0.00 C ATOM 2234 C GLN A 143 -5.264 -3.254 -13.527 1.00 0.00 C ATOM 2235 O GLN A 143 -5.066 -3.814 -12.467 1.00 0.00 O ATOM 2236 CB GLN A 143 -7.631 -2.647 -13.004 1.00 0.00 C ATOM 2237 CG GLN A 143 -9.067 -2.668 -13.532 1.00 0.00 C ATOM 2238 CD GLN A 143 -9.658 -1.258 -13.462 1.00 0.00 C ATOM 2239 OE1 GLN A 143 -10.265 -0.890 -12.476 1.00 0.00 O ATOM 2240 NE2 GLN A 143 -9.505 -0.449 -14.474 1.00 0.00 N ATOM 0 H GLN A 143 -7.809 -4.926 -14.036 1.00 0.00 H new ATOM 0 HA GLN A 143 -6.671 -2.392 -14.915 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -7.544 -3.292 -12.130 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -7.365 -1.640 -12.684 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -9.082 -3.029 -14.560 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -9.672 -3.357 -12.943 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -8.995 -0.758 -15.302 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -9.895 0.493 -14.438 1.00 0.00 H new ATOM 2249 N LYS A 144 -4.281 -2.745 -14.218 1.00 0.00 N ATOM 2250 CA LYS A 144 -2.884 -2.845 -13.711 1.00 0.00 C ATOM 2251 C LYS A 144 -2.742 -2.012 -12.435 1.00 0.00 C ATOM 2252 O LYS A 144 -1.698 -1.986 -11.814 1.00 0.00 O ATOM 2253 CB LYS A 144 -1.917 -2.322 -14.775 1.00 0.00 C ATOM 2254 CG LYS A 144 -2.135 -3.087 -16.082 1.00 0.00 C ATOM 2255 CD LYS A 144 -1.197 -2.537 -17.158 1.00 0.00 C ATOM 2256 CE LYS A 144 -1.905 -1.424 -17.932 1.00 0.00 C ATOM 2257 NZ LYS A 144 -2.745 -2.022 -19.008 1.00 0.00 N ATOM 0 H LYS A 144 -4.385 -2.264 -15.112 1.00 0.00 H new ATOM 0 HA LYS A 144 -2.651 -3.887 -13.490 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -2.077 -1.256 -14.934 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -0.888 -2.443 -14.437 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -1.947 -4.150 -15.929 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -3.172 -2.990 -16.404 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -0.286 -2.153 -16.699 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -0.899 -3.335 -17.838 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -2.526 -0.835 -17.257 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -1.171 -0.744 -18.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -3.226 -1.265 -19.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -2.142 -2.565 -19.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -3.454 -2.654 -18.584 1.00 0.00 H new ATOM 2271 N ALA A 145 -3.781 -1.330 -12.040 1.00 0.00 N ATOM 2272 CA ALA A 145 -3.702 -0.501 -10.804 1.00 0.00 C ATOM 2273 C ALA A 145 -3.409 -1.404 -9.604 1.00 0.00 C ATOM 2274 O ALA A 145 -3.188 -0.936 -8.505 1.00 0.00 O ATOM 2275 CB ALA A 145 -5.033 0.221 -10.587 1.00 0.00 C ATOM 0 H ALA A 145 -4.681 -1.311 -12.519 1.00 0.00 H new ATOM 0 HA ALA A 145 -2.904 0.234 -10.910 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -4.975 0.827 -9.683 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -5.242 0.864 -11.442 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -5.832 -0.513 -10.481 1.00 0.00 H new ATOM 2281 N ILE A 146 -3.405 -2.693 -9.808 1.00 0.00 N ATOM 2282 CA ILE A 146 -3.126 -3.626 -8.680 1.00 0.00 C ATOM 2283 C ILE A 146 -1.633 -3.967 -8.656 1.00 0.00 C ATOM 2284 O ILE A 146 -1.167 -4.694 -7.802 1.00 0.00 O ATOM 2285 CB ILE A 146 -3.941 -4.907 -8.864 1.00 0.00 C ATOM 2286 CG1 ILE A 146 -3.535 -5.585 -10.175 1.00 0.00 C ATOM 2287 CG2 ILE A 146 -5.431 -4.561 -8.912 1.00 0.00 C ATOM 2288 CD1 ILE A 146 -4.580 -6.637 -10.551 1.00 0.00 C ATOM 0 H ILE A 146 -3.583 -3.140 -10.707 1.00 0.00 H new ATOM 0 HA ILE A 146 -3.404 -3.152 -7.739 1.00 0.00 H new ATOM 0 HB ILE A 146 -3.750 -5.582 -8.030 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -3.449 -4.843 -10.969 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -2.556 -6.052 -10.067 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -6.012 -5.474 -9.043 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -5.722 -4.076 -7.980 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -5.621 -3.887 -9.747 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -4.291 -7.120 -11.485 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -4.644 -7.385 -9.761 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -5.551 -6.157 -10.676 1.00 0.00 H new ATOM 2300 N LEU A 147 -0.881 -3.447 -9.589 1.00 0.00 N ATOM 2301 CA LEU A 147 0.579 -3.741 -9.618 1.00 0.00 C ATOM 2302 C LEU A 147 1.319 -2.738 -8.731 1.00 0.00 C ATOM 2303 O LEU A 147 1.730 -1.686 -9.180 1.00 0.00 O ATOM 2304 CB LEU A 147 1.095 -3.623 -11.055 1.00 0.00 C ATOM 2305 CG LEU A 147 0.259 -4.513 -11.977 1.00 0.00 C ATOM 2306 CD1 LEU A 147 0.766 -4.380 -13.414 1.00 0.00 C ATOM 2307 CD2 LEU A 147 0.382 -5.973 -11.531 1.00 0.00 C ATOM 0 H LEU A 147 -1.215 -2.832 -10.331 1.00 0.00 H new ATOM 0 HA LEU A 147 0.752 -4.752 -9.249 1.00 0.00 H new ATOM 0 HB2 LEU A 147 1.041 -2.586 -11.387 1.00 0.00 H new ATOM 0 HB3 LEU A 147 2.143 -3.918 -11.101 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.785 -4.203 -11.927 1.00 0.00 H new ATOM 0 HD11 LEU A 147 0.170 -5.014 -14.070 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.679 -3.342 -13.736 1.00 0.00 H new ATOM 0 HD13 LEU A 147 1.810 -4.689 -13.461 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.214 -6.606 -12.189 1.00 0.00 H new ATOM 0 HD22 LEU A 147 1.426 -6.281 -11.579 1.00 0.00 H new ATOM 0 HD23 LEU A 147 0.021 -6.072 -10.507 1.00 0.00 H new ATOM 2319 N PHE A 148 1.492 -3.055 -7.477 1.00 0.00 N ATOM 2320 CA PHE A 148 2.205 -2.118 -6.561 1.00 0.00 C ATOM 2321 C PHE A 148 3.684 -2.503 -6.484 1.00 0.00 C ATOM 2322 O PHE A 148 4.086 -3.558 -6.932 1.00 0.00 O ATOM 2323 CB PHE A 148 1.584 -2.198 -5.165 1.00 0.00 C ATOM 2324 CG PHE A 148 0.277 -1.444 -5.150 1.00 0.00 C ATOM 2325 CD1 PHE A 148 -0.908 -2.090 -5.520 1.00 0.00 C ATOM 2326 CD2 PHE A 148 0.251 -0.097 -4.767 1.00 0.00 C ATOM 2327 CE1 PHE A 148 -2.121 -1.390 -5.506 1.00 0.00 C ATOM 2328 CE2 PHE A 148 -0.962 0.602 -4.753 1.00 0.00 C ATOM 2329 CZ PHE A 148 -2.148 -0.043 -5.123 1.00 0.00 C ATOM 0 H PHE A 148 1.171 -3.922 -7.046 1.00 0.00 H new ATOM 0 HA PHE A 148 2.115 -1.101 -6.942 1.00 0.00 H new ATOM 0 HB2 PHE A 148 1.418 -3.239 -4.889 1.00 0.00 H new ATOM 0 HB3 PHE A 148 2.267 -1.777 -4.427 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -0.887 -3.128 -5.816 1.00 0.00 H new ATOM 0 HD2 PHE A 148 1.166 0.402 -4.483 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -3.036 -1.889 -5.791 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -0.983 1.640 -4.456 1.00 0.00 H new ATOM 0 HZ PHE A 148 -3.083 0.497 -5.113 1.00 0.00 H new ATOM 2339 N LEU A 149 4.495 -1.649 -5.921 1.00 0.00 N ATOM 2340 CA LEU A 149 5.951 -1.955 -5.813 1.00 0.00 C ATOM 2341 C LEU A 149 6.490 -1.391 -4.491 1.00 0.00 C ATOM 2342 O LEU A 149 7.175 -0.388 -4.492 1.00 0.00 O ATOM 2343 CB LEU A 149 6.687 -1.292 -6.983 1.00 0.00 C ATOM 2344 CG LEU A 149 8.162 -1.715 -6.982 1.00 0.00 C ATOM 2345 CD1 LEU A 149 8.282 -3.224 -7.219 1.00 0.00 C ATOM 2346 CD2 LEU A 149 8.905 -0.974 -8.097 1.00 0.00 C ATOM 0 H LEU A 149 4.212 -0.750 -5.530 1.00 0.00 H new ATOM 0 HA LEU A 149 6.106 -3.034 -5.841 1.00 0.00 H new ATOM 0 HB2 LEU A 149 6.219 -1.576 -7.926 1.00 0.00 H new ATOM 0 HB3 LEU A 149 6.611 -0.208 -6.904 1.00 0.00 H new ATOM 0 HG LEU A 149 8.598 -1.468 -6.014 1.00 0.00 H new ATOM 0 HD11 LEU A 149 9.334 -3.510 -7.216 1.00 0.00 H new ATOM 0 HD12 LEU A 149 7.758 -3.759 -6.427 1.00 0.00 H new ATOM 0 HD13 LEU A 149 7.840 -3.477 -8.183 1.00 0.00 H new ATOM 0 HD21 LEU A 149 9.953 -1.274 -8.097 1.00 0.00 H new ATOM 0 HD22 LEU A 149 8.457 -1.221 -9.059 1.00 0.00 H new ATOM 0 HD23 LEU A 149 8.835 0.101 -7.929 1.00 0.00 H new ATOM 2358 N PRO A 150 6.156 -2.037 -3.396 1.00 0.00 N ATOM 2359 CA PRO A 150 6.598 -1.585 -2.062 1.00 0.00 C ATOM 2360 C PRO A 150 8.127 -1.592 -1.969 1.00 0.00 C ATOM 2361 O PRO A 150 8.761 -2.627 -2.034 1.00 0.00 O ATOM 2362 CB PRO A 150 5.985 -2.593 -1.079 1.00 0.00 C ATOM 2363 CG PRO A 150 5.122 -3.584 -1.900 1.00 0.00 C ATOM 2364 CD PRO A 150 5.321 -3.255 -3.389 1.00 0.00 C ATOM 0 HA PRO A 150 6.282 -0.564 -1.848 1.00 0.00 H new ATOM 0 HB2 PRO A 150 6.768 -3.125 -0.538 1.00 0.00 H new ATOM 0 HB3 PRO A 150 5.375 -2.080 -0.335 1.00 0.00 H new ATOM 0 HG2 PRO A 150 5.419 -4.612 -1.693 1.00 0.00 H new ATOM 0 HG3 PRO A 150 4.071 -3.494 -1.626 1.00 0.00 H new ATOM 0 HD2 PRO A 150 5.812 -4.075 -3.913 1.00 0.00 H new ATOM 0 HD3 PRO A 150 4.367 -3.084 -3.888 1.00 0.00 H new ATOM 2372 N MET A 151 8.720 -0.438 -1.812 1.00 0.00 N ATOM 2373 CA MET A 151 10.205 -0.364 -1.710 1.00 0.00 C ATOM 2374 C MET A 151 10.610 -0.328 -0.235 1.00 0.00 C ATOM 2375 O MET A 151 10.438 0.666 0.441 1.00 0.00 O ATOM 2376 CB MET A 151 10.704 0.910 -2.399 1.00 0.00 C ATOM 2377 CG MET A 151 10.231 0.931 -3.853 1.00 0.00 C ATOM 2378 SD MET A 151 10.469 2.589 -4.539 1.00 0.00 S ATOM 2379 CE MET A 151 11.283 2.086 -6.074 1.00 0.00 C ATOM 0 H MET A 151 8.237 0.458 -1.750 1.00 0.00 H new ATOM 0 HA MET A 151 10.645 -1.237 -2.193 1.00 0.00 H new ATOM 0 HB2 MET A 151 10.331 1.789 -1.873 1.00 0.00 H new ATOM 0 HB3 MET A 151 11.792 0.953 -2.360 1.00 0.00 H new ATOM 0 HG2 MET A 151 10.788 0.200 -4.439 1.00 0.00 H new ATOM 0 HG3 MET A 151 9.179 0.650 -3.909 1.00 0.00 H new ATOM 0 HE1 MET A 151 11.524 2.970 -6.664 1.00 0.00 H new ATOM 0 HE2 MET A 151 12.200 1.545 -5.839 1.00 0.00 H new ATOM 0 HE3 MET A 151 10.616 1.439 -6.644 1.00 0.00 H new ATOM 2389 N SER A 152 11.150 -1.403 0.270 1.00 0.00 N ATOM 2390 CA SER A 152 11.565 -1.421 1.701 1.00 0.00 C ATOM 2391 C SER A 152 12.681 -0.397 1.918 1.00 0.00 C ATOM 2392 O SER A 152 13.493 -0.156 1.048 1.00 0.00 O ATOM 2393 CB SER A 152 12.072 -2.816 2.068 1.00 0.00 C ATOM 2394 OG SER A 152 12.504 -2.818 3.421 1.00 0.00 O ATOM 0 H SER A 152 11.321 -2.267 -0.244 1.00 0.00 H new ATOM 0 HA SER A 152 10.712 -1.169 2.331 1.00 0.00 H new ATOM 0 HB2 SER A 152 11.281 -3.552 1.926 1.00 0.00 H new ATOM 0 HB3 SER A 152 12.894 -3.101 1.411 1.00 0.00 H new ATOM 0 HG SER A 152 12.828 -3.712 3.660 1.00 0.00 H new ATOM 2400 N ALA A 153 12.728 0.207 3.074 1.00 0.00 N ATOM 2401 CA ALA A 153 13.791 1.217 3.345 1.00 0.00 C ATOM 2402 C ALA A 153 15.057 0.507 3.829 1.00 0.00 C ATOM 2403 O ALA A 153 15.568 0.789 4.895 1.00 0.00 O ATOM 2404 CB ALA A 153 13.308 2.190 4.422 1.00 0.00 C ATOM 0 H ALA A 153 12.077 0.045 3.842 1.00 0.00 H new ATOM 0 HA ALA A 153 14.010 1.768 2.430 1.00 0.00 H new ATOM 0 HB1 ALA A 153 14.085 2.928 4.620 1.00 0.00 H new ATOM 0 HB2 ALA A 153 12.406 2.696 4.077 1.00 0.00 H new ATOM 0 HB3 ALA A 153 13.088 1.640 5.337 1.00 0.00 H new ATOM 2410 N LYS A 154 15.568 -0.409 3.054 1.00 0.00 N ATOM 2411 CA LYS A 154 16.801 -1.134 3.471 1.00 0.00 C ATOM 2412 C LYS A 154 17.908 -0.124 3.777 1.00 0.00 C ATOM 2413 O LYS A 154 18.099 0.279 4.907 1.00 0.00 O ATOM 2414 CB LYS A 154 17.256 -2.060 2.340 1.00 0.00 C ATOM 2415 CG LYS A 154 16.383 -3.316 2.327 1.00 0.00 C ATOM 2416 CD LYS A 154 16.837 -4.242 1.196 1.00 0.00 C ATOM 2417 CE LYS A 154 15.655 -4.533 0.270 1.00 0.00 C ATOM 2418 NZ LYS A 154 14.544 -5.137 1.057 1.00 0.00 N ATOM 0 H LYS A 154 15.185 -0.687 2.150 1.00 0.00 H new ATOM 0 HA LYS A 154 16.590 -1.724 4.363 1.00 0.00 H new ATOM 0 HB2 LYS A 154 17.184 -1.544 1.382 1.00 0.00 H new ATOM 0 HB3 LYS A 154 18.302 -2.333 2.478 1.00 0.00 H new ATOM 0 HG2 LYS A 154 16.455 -3.832 3.285 1.00 0.00 H new ATOM 0 HG3 LYS A 154 15.337 -3.043 2.190 1.00 0.00 H new ATOM 0 HD2 LYS A 154 17.647 -3.777 0.634 1.00 0.00 H new ATOM 0 HD3 LYS A 154 17.228 -5.172 1.608 1.00 0.00 H new ATOM 0 HE2 LYS A 154 15.318 -3.613 -0.207 1.00 0.00 H new ATOM 0 HE3 LYS A 154 15.962 -5.211 -0.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 13.634 -4.894 0.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 14.654 -6.171 1.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 14.567 -4.768 2.029 1.00 0.00 H new ATOM 2432 N SER A 155 18.640 0.289 2.779 1.00 0.00 N ATOM 2433 CA SER A 155 19.734 1.273 3.012 1.00 0.00 C ATOM 2434 C SER A 155 19.144 2.681 3.106 1.00 0.00 C ATOM 2435 O SER A 155 18.493 2.965 4.099 1.00 0.00 O ATOM 2436 CB SER A 155 20.729 1.214 1.853 1.00 0.00 C ATOM 2437 OG SER A 155 21.344 -0.067 1.827 1.00 0.00 O ATOM 2438 OXT SER A 155 19.352 3.453 2.185 1.00 0.00 O ATOM 0 H SER A 155 18.527 -0.013 1.811 1.00 0.00 H new ATOM 0 HA SER A 155 20.246 1.031 3.943 1.00 0.00 H new ATOM 0 HB2 SER A 155 20.217 1.404 0.909 1.00 0.00 H new ATOM 0 HB3 SER A 155 21.485 1.991 1.968 1.00 0.00 H new ATOM 0 HG SER A 155 21.981 -0.109 1.084 1.00 0.00 H new TER 2444 SER A 155