USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1016 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 78 LYS NZ :NH3+ -166:sc= 1.15 (180deg=1.03) USER MOD Set 1.2: A 97 GLN : amide:sc= -1.91! C(o=-0.76!,f=-4.7!) USER MOD Set 2.1: A 28 TYR OH : rot 30:sc= 0.284 USER MOD Set 2.2: A 85 GLN : amide:sc= 0.287 K(o=0.57,f=-0.2) USER MOD Set 3.1: A 15 THR OG1 : rot -18:sc= 1.03 USER MOD Set 3.2: A 19 TYR OH : rot 19:sc= 1.03 USER MOD Single : A 1 GLY N :NH3+ -174:sc= 1.24 (180deg=1.11) USER MOD Single : A 5 SER OG : rot -51:sc= -2.01! USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0.0422 USER MOD Single : A 20 MET CE :methyl 165:sc= -0.603 (180deg=-0.975) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 174:sc= 0.769 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 100:sc= -1.37! USER MOD Single : A 43 LYS NZ :NH3+ -107:sc= 1.07 (180deg=-0.528) USER MOD Single : A 45 LYS NZ :NH3+ -158:sc= 1.28 (180deg=0.107) USER MOD Single : A 51 GLN : amide:sc= -3.56! K(o=-3.6!,f=-1.4) USER MOD Single : A 56 ASN : amide:sc= -2.75! K(o=-2.7!,f=-1.3) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 HIS : no HE2:sc= 0.0774 K(o=0.077,f=-0.45) USER MOD Single : A 71 ASN : amide:sc= 1.18 K(o=1.2,f=-0.12) USER MOD Single : A 73 ASN : amide:sc= -3.36! K(o=-3.4!,f=-1.5) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 14:sc= 0.932 USER MOD Single : A 89 LYS NZ :NH3+ -166:sc= -0.0331 (180deg=-0.255) USER MOD Single : A 90 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 GLN : amide:sc= 0.673 K(o=0.67,f=-1.4) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 168:sc= 1.19 (180deg=1.08) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.527 USER MOD Single : A 107 LYS NZ :NH3+ 175:sc= 0.822 (180deg=0.689) USER MOD Single : A 117 LYS NZ :NH3+ 150:sc= 1.2 (180deg=-0.102) USER MOD Single : A 121 SER OG : rot 180:sc= 0.00199 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.167 -18.651 1.875 1.00 0.00 N ATOM 2 CA GLY A 1 -11.257 -19.776 0.965 1.00 0.00 C ATOM 3 C GLY A 1 -9.945 -20.506 0.898 1.00 0.00 C ATOM 4 O GLY A 1 -9.060 -20.223 1.702 1.00 0.00 O ATOM 0 H1 GLY A 1 -12.107 -18.220 1.988 1.00 0.00 H new ATOM 0 H2 GLY A 1 -10.824 -18.979 2.800 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.506 -17.946 1.491 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.042 -20.456 1.295 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -11.536 -19.426 -0.029 1.00 0.00 H new ATOM 10 N PRO A 2 -9.772 -21.445 -0.058 1.00 0.00 N ATOM 11 CA PRO A 2 -8.537 -22.235 -0.184 1.00 0.00 C ATOM 12 C PRO A 2 -7.309 -21.376 -0.537 1.00 0.00 C ATOM 13 O PRO A 2 -6.193 -21.661 -0.092 1.00 0.00 O ATOM 14 CB PRO A 2 -8.855 -23.236 -1.308 1.00 0.00 C ATOM 15 CG PRO A 2 -9.968 -22.608 -2.076 1.00 0.00 C ATOM 16 CD PRO A 2 -10.772 -21.832 -1.076 1.00 0.00 C ATOM 0 HA PRO A 2 -8.269 -22.714 0.758 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -7.985 -23.408 -1.942 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -9.151 -24.204 -0.903 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -9.582 -21.954 -2.858 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -10.580 -23.365 -2.566 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -11.243 -20.959 -1.529 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -11.570 -22.437 -0.646 1.00 0.00 H new ATOM 24 N LEU A 3 -7.514 -20.332 -1.326 1.00 0.00 N ATOM 25 CA LEU A 3 -6.440 -19.418 -1.683 1.00 0.00 C ATOM 26 C LEU A 3 -6.816 -18.022 -1.261 1.00 0.00 C ATOM 27 O LEU A 3 -7.361 -17.245 -2.058 1.00 0.00 O ATOM 28 CB LEU A 3 -6.091 -19.424 -3.205 1.00 0.00 C ATOM 29 CG LEU A 3 -5.392 -20.666 -3.804 1.00 0.00 C ATOM 30 CD1 LEU A 3 -4.128 -21.018 -3.040 1.00 0.00 C ATOM 31 CD2 LEU A 3 -6.326 -21.858 -3.915 1.00 0.00 C ATOM 0 H LEU A 3 -8.419 -20.096 -1.733 1.00 0.00 H new ATOM 0 HA LEU A 3 -5.548 -19.762 -1.159 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -7.018 -19.269 -3.757 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -5.455 -18.561 -3.401 1.00 0.00 H new ATOM 0 HG LEU A 3 -5.100 -20.401 -4.820 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -3.664 -21.896 -3.489 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -3.433 -20.179 -3.080 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -4.379 -21.232 -2.001 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.787 -22.704 -4.341 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.695 -22.125 -2.925 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -7.167 -21.602 -4.559 1.00 0.00 H new ATOM 43 N GLY A 4 -6.628 -17.734 -0.006 1.00 0.00 N ATOM 44 CA GLY A 4 -6.944 -16.429 0.491 1.00 0.00 C ATOM 45 C GLY A 4 -8.376 -16.304 0.926 1.00 0.00 C ATOM 46 O GLY A 4 -9.193 -17.207 0.687 1.00 0.00 O ATOM 0 H GLY A 4 -6.259 -18.383 0.689 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.292 -16.198 1.333 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.738 -15.690 -0.284 1.00 0.00 H new ATOM 50 N SER A 5 -8.693 -15.218 1.573 1.00 0.00 N ATOM 51 CA SER A 5 -10.036 -14.985 2.014 1.00 0.00 C ATOM 52 C SER A 5 -10.591 -13.548 1.730 1.00 0.00 C ATOM 53 O SER A 5 -11.491 -13.408 0.914 1.00 0.00 O ATOM 54 CB SER A 5 -10.256 -15.506 3.458 1.00 0.00 C ATOM 55 OG SER A 5 -9.123 -15.253 4.287 1.00 0.00 O ATOM 0 H SER A 5 -8.033 -14.476 1.807 1.00 0.00 H new ATOM 0 HA SER A 5 -10.676 -15.592 1.373 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.136 -15.027 3.888 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.456 -16.577 3.432 1.00 0.00 H new ATOM 0 HG SER A 5 -8.312 -15.574 3.840 1.00 0.00 H new ATOM 61 N PRO A 6 -10.050 -12.460 2.334 1.00 0.00 N ATOM 62 CA PRO A 6 -10.577 -11.115 2.159 1.00 0.00 C ATOM 63 C PRO A 6 -9.650 -10.255 1.285 1.00 0.00 C ATOM 64 O PRO A 6 -9.347 -9.115 1.644 1.00 0.00 O ATOM 65 CB PRO A 6 -10.521 -10.629 3.607 1.00 0.00 C ATOM 66 CG PRO A 6 -9.283 -11.276 4.178 1.00 0.00 C ATOM 67 CD PRO A 6 -8.915 -12.414 3.255 1.00 0.00 C ATOM 0 HA PRO A 6 -11.552 -11.069 1.673 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -10.460 -9.542 3.658 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -11.413 -10.924 4.159 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -8.468 -10.556 4.246 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -9.470 -11.643 5.187 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -7.977 -12.225 2.733 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -8.795 -13.352 3.797 1.00 0.00 H new ATOM 75 N LEU A 7 -9.268 -10.806 0.122 1.00 0.00 N ATOM 76 CA LEU A 7 -8.288 -10.196 -0.824 1.00 0.00 C ATOM 77 C LEU A 7 -8.515 -8.704 -1.071 1.00 0.00 C ATOM 78 O LEU A 7 -7.571 -7.911 -1.031 1.00 0.00 O ATOM 79 CB LEU A 7 -8.247 -10.939 -2.187 1.00 0.00 C ATOM 80 CG LEU A 7 -7.644 -12.363 -2.226 1.00 0.00 C ATOM 81 CD1 LEU A 7 -6.248 -12.390 -1.632 1.00 0.00 C ATOM 82 CD2 LEU A 7 -8.551 -13.398 -1.572 1.00 0.00 C ATOM 0 H LEU A 7 -9.631 -11.702 -0.203 1.00 0.00 H new ATOM 0 HA LEU A 7 -7.326 -10.305 -0.323 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -9.268 -10.999 -2.564 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.685 -10.320 -2.887 1.00 0.00 H new ATOM 0 HG LEU A 7 -7.563 -12.641 -3.277 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -5.854 -13.405 -1.675 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -5.598 -11.724 -2.200 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -6.288 -12.060 -0.594 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.081 -14.380 -1.626 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -8.714 -13.131 -0.528 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.508 -13.424 -2.093 1.00 0.00 H new ATOM 94 N ILE A 8 -9.737 -8.333 -1.350 1.00 0.00 N ATOM 95 CA ILE A 8 -10.065 -6.953 -1.559 1.00 0.00 C ATOM 96 C ILE A 8 -11.198 -6.561 -0.646 1.00 0.00 C ATOM 97 O ILE A 8 -12.221 -7.253 -0.575 1.00 0.00 O ATOM 98 CB ILE A 8 -10.421 -6.648 -3.044 1.00 0.00 C ATOM 99 CG1 ILE A 8 -9.207 -6.928 -3.929 1.00 0.00 C ATOM 100 CG2 ILE A 8 -10.867 -5.190 -3.217 1.00 0.00 C ATOM 101 CD1 ILE A 8 -9.478 -6.799 -5.400 1.00 0.00 C ATOM 0 H ILE A 8 -10.525 -8.975 -1.438 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.183 -6.358 -1.322 1.00 0.00 H new ATOM 0 HB ILE A 8 -11.248 -7.293 -3.340 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -8.406 -6.241 -3.656 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -8.846 -7.936 -3.724 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -11.109 -5.005 -4.264 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -11.748 -5.004 -2.602 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -10.061 -4.524 -2.908 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -8.567 -7.013 -5.958 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -10.256 -7.505 -5.690 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -9.809 -5.784 -5.621 1.00 0.00 H new ATOM 113 N GLY A 9 -11.004 -5.489 0.074 1.00 0.00 N ATOM 114 CA GLY A 9 -12.004 -5.002 0.957 1.00 0.00 C ATOM 115 C GLY A 9 -11.409 -4.186 2.055 1.00 0.00 C ATOM 116 O GLY A 9 -10.761 -3.167 1.801 1.00 0.00 O ATOM 0 H GLY A 9 -10.147 -4.937 0.058 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -12.721 -4.398 0.400 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.556 -5.840 1.382 1.00 0.00 H new ATOM 120 N GLU A 10 -11.586 -4.643 3.259 1.00 0.00 N ATOM 121 CA GLU A 10 -11.115 -3.950 4.432 1.00 0.00 C ATOM 122 C GLU A 10 -10.135 -4.839 5.178 1.00 0.00 C ATOM 123 O GLU A 10 -10.373 -6.043 5.339 1.00 0.00 O ATOM 124 CB GLU A 10 -12.308 -3.570 5.316 1.00 0.00 C ATOM 125 CG GLU A 10 -13.295 -2.644 4.614 1.00 0.00 C ATOM 126 CD GLU A 10 -14.569 -2.439 5.377 1.00 0.00 C ATOM 127 OE1 GLU A 10 -15.521 -3.215 5.173 1.00 0.00 O ATOM 128 OE2 GLU A 10 -14.667 -1.491 6.166 1.00 0.00 O ATOM 0 H GLU A 10 -12.067 -5.519 3.462 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.599 -3.033 4.147 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.827 -4.477 5.627 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -11.943 -3.085 6.221 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.820 -1.677 4.449 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -13.531 -3.054 3.632 1.00 0.00 H new ATOM 135 N ILE A 11 -9.050 -4.260 5.609 1.00 0.00 N ATOM 136 CA ILE A 11 -7.998 -4.987 6.284 1.00 0.00 C ATOM 137 C ILE A 11 -8.246 -4.929 7.797 1.00 0.00 C ATOM 138 O ILE A 11 -8.637 -3.894 8.321 1.00 0.00 O ATOM 139 CB ILE A 11 -6.597 -4.373 5.974 1.00 0.00 C ATOM 140 CG1 ILE A 11 -6.336 -4.308 4.501 1.00 0.00 C ATOM 141 CG2 ILE A 11 -5.486 -5.175 6.592 1.00 0.00 C ATOM 142 CD1 ILE A 11 -4.982 -3.680 4.147 1.00 0.00 C ATOM 0 H ILE A 11 -8.864 -3.263 5.504 1.00 0.00 H new ATOM 0 HA ILE A 11 -8.007 -6.018 5.930 1.00 0.00 H new ATOM 0 HB ILE A 11 -6.615 -3.369 6.399 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.380 -5.316 4.087 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.130 -3.733 4.024 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -4.528 -4.714 6.352 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -5.615 -5.202 7.674 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -5.508 -6.191 6.198 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -4.860 -3.665 3.064 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -4.942 -2.660 4.531 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -4.180 -4.267 4.595 1.00 0.00 H new ATOM 154 N GLY A 12 -8.029 -6.029 8.470 1.00 0.00 N ATOM 155 CA GLY A 12 -8.217 -6.094 9.886 1.00 0.00 C ATOM 156 C GLY A 12 -7.146 -6.942 10.536 1.00 0.00 C ATOM 157 O GLY A 12 -6.285 -7.489 9.827 1.00 0.00 O ATOM 0 H GLY A 12 -7.717 -6.903 8.046 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -8.195 -5.088 10.306 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -9.200 -6.510 10.107 1.00 0.00 H new ATOM 161 N PRO A 13 -7.193 -7.105 11.875 1.00 0.00 N ATOM 162 CA PRO A 13 -6.190 -7.853 12.662 1.00 0.00 C ATOM 163 C PRO A 13 -5.901 -9.267 12.147 1.00 0.00 C ATOM 164 O PRO A 13 -4.781 -9.752 12.247 1.00 0.00 O ATOM 165 CB PRO A 13 -6.801 -7.914 14.074 1.00 0.00 C ATOM 166 CG PRO A 13 -8.223 -7.505 13.903 1.00 0.00 C ATOM 167 CD PRO A 13 -8.231 -6.548 12.756 1.00 0.00 C ATOM 0 HA PRO A 13 -5.222 -7.355 12.609 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -6.728 -8.918 14.492 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -6.279 -7.245 14.758 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -8.857 -8.368 13.698 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -8.607 -7.035 14.808 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -9.203 -6.510 12.265 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -7.994 -5.532 13.072 1.00 0.00 H new ATOM 175 N GLU A 14 -6.883 -9.903 11.573 1.00 0.00 N ATOM 176 CA GLU A 14 -6.718 -11.274 11.127 1.00 0.00 C ATOM 177 C GLU A 14 -6.459 -11.381 9.631 1.00 0.00 C ATOM 178 O GLU A 14 -6.119 -12.456 9.139 1.00 0.00 O ATOM 179 CB GLU A 14 -7.958 -12.091 11.482 1.00 0.00 C ATOM 180 CG GLU A 14 -9.249 -11.538 10.893 1.00 0.00 C ATOM 181 CD GLU A 14 -10.445 -12.341 11.298 1.00 0.00 C ATOM 182 OE1 GLU A 14 -10.932 -12.155 12.437 1.00 0.00 O ATOM 183 OE2 GLU A 14 -10.913 -13.191 10.505 1.00 0.00 O ATOM 0 H GLU A 14 -7.805 -9.504 11.400 1.00 0.00 H new ATOM 0 HA GLU A 14 -5.841 -11.668 11.641 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -7.820 -13.114 11.133 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -8.054 -12.135 12.567 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -9.381 -10.505 11.216 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -9.174 -11.525 9.806 1.00 0.00 H new ATOM 190 N THR A 15 -6.565 -10.287 8.908 1.00 0.00 N ATOM 191 CA THR A 15 -6.552 -10.400 7.476 1.00 0.00 C ATOM 192 C THR A 15 -5.168 -10.216 6.908 1.00 0.00 C ATOM 193 O THR A 15 -4.866 -10.777 5.862 1.00 0.00 O ATOM 194 CB THR A 15 -7.549 -9.427 6.804 1.00 0.00 C ATOM 195 OG1 THR A 15 -7.115 -8.085 6.961 1.00 0.00 O ATOM 196 CG2 THR A 15 -8.917 -9.563 7.437 1.00 0.00 C ATOM 0 H THR A 15 -6.658 -9.341 9.277 1.00 0.00 H new ATOM 0 HA THR A 15 -6.876 -11.416 7.249 1.00 0.00 H new ATOM 0 HB THR A 15 -7.600 -9.676 5.744 1.00 0.00 H new ATOM 0 HG1 THR A 15 -6.458 -8.036 7.686 1.00 0.00 H new ATOM 0 HG21 THR A 15 -9.611 -8.873 6.956 1.00 0.00 H new ATOM 0 HG22 THR A 15 -9.276 -10.585 7.312 1.00 0.00 H new ATOM 0 HG23 THR A 15 -8.851 -9.329 8.500 1.00 0.00 H new ATOM 204 N TYR A 16 -4.313 -9.451 7.631 1.00 0.00 N ATOM 205 CA TYR A 16 -2.929 -9.144 7.192 1.00 0.00 C ATOM 206 C TYR A 16 -2.226 -10.394 6.694 1.00 0.00 C ATOM 207 O TYR A 16 -1.688 -10.442 5.579 1.00 0.00 O ATOM 208 CB TYR A 16 -2.073 -8.618 8.338 1.00 0.00 C ATOM 209 CG TYR A 16 -2.536 -7.377 9.037 1.00 0.00 C ATOM 210 CD1 TYR A 16 -2.436 -6.131 8.439 1.00 0.00 C ATOM 211 CD2 TYR A 16 -3.033 -7.451 10.318 1.00 0.00 C ATOM 212 CE1 TYR A 16 -2.835 -4.991 9.111 1.00 0.00 C ATOM 213 CE2 TYR A 16 -3.423 -6.324 10.990 1.00 0.00 C ATOM 214 CZ TYR A 16 -3.326 -5.100 10.389 1.00 0.00 C ATOM 215 OH TYR A 16 -3.711 -3.980 11.082 1.00 0.00 O ATOM 0 H TYR A 16 -4.561 -9.033 8.528 1.00 0.00 H new ATOM 0 HA TYR A 16 -3.030 -8.396 6.406 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -1.985 -9.410 9.082 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -1.071 -8.432 7.951 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -2.042 -6.050 7.437 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -3.117 -8.413 10.801 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -2.761 -4.024 8.636 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -3.808 -6.402 11.996 1.00 0.00 H new ATOM 0 HH TYR A 16 -4.035 -4.240 11.970 1.00 0.00 H new ATOM 225 N SER A 17 -2.284 -11.401 7.534 1.00 0.00 N ATOM 226 CA SER A 17 -1.657 -12.679 7.341 1.00 0.00 C ATOM 227 C SER A 17 -2.074 -13.342 6.018 1.00 0.00 C ATOM 228 O SER A 17 -1.265 -13.966 5.354 1.00 0.00 O ATOM 229 CB SER A 17 -2.062 -13.546 8.515 1.00 0.00 C ATOM 230 OG SER A 17 -1.904 -12.812 9.724 1.00 0.00 O ATOM 0 H SER A 17 -2.797 -11.344 8.414 1.00 0.00 H new ATOM 0 HA SER A 17 -0.576 -12.553 7.287 1.00 0.00 H new ATOM 0 HB2 SER A 17 -3.098 -13.866 8.404 1.00 0.00 H new ATOM 0 HB3 SER A 17 -1.451 -14.448 8.542 1.00 0.00 H new ATOM 0 HG SER A 17 -2.168 -13.372 10.484 1.00 0.00 H new ATOM 236 N ASP A 18 -3.308 -13.131 5.617 1.00 0.00 N ATOM 237 CA ASP A 18 -3.861 -13.771 4.429 1.00 0.00 C ATOM 238 C ASP A 18 -3.230 -13.178 3.172 1.00 0.00 C ATOM 239 O ASP A 18 -2.790 -13.905 2.260 1.00 0.00 O ATOM 240 CB ASP A 18 -5.381 -13.592 4.399 1.00 0.00 C ATOM 241 CG ASP A 18 -6.065 -14.394 3.318 1.00 0.00 C ATOM 242 OD1 ASP A 18 -6.233 -13.895 2.194 1.00 0.00 O ATOM 243 OD2 ASP A 18 -6.493 -15.540 3.598 1.00 0.00 O ATOM 0 H ASP A 18 -3.961 -12.513 6.099 1.00 0.00 H new ATOM 0 HA ASP A 18 -3.635 -14.837 4.461 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -5.791 -13.880 5.367 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -5.611 -12.536 4.256 1.00 0.00 H new ATOM 248 N TYR A 19 -3.066 -11.864 3.166 1.00 0.00 N ATOM 249 CA TYR A 19 -2.518 -11.188 2.000 1.00 0.00 C ATOM 250 C TYR A 19 -1.040 -11.503 1.920 1.00 0.00 C ATOM 251 O TYR A 19 -0.440 -11.582 0.847 1.00 0.00 O ATOM 252 CB TYR A 19 -2.673 -9.690 2.129 1.00 0.00 C ATOM 253 CG TYR A 19 -4.052 -9.200 2.491 1.00 0.00 C ATOM 254 CD1 TYR A 19 -5.108 -9.280 1.606 1.00 0.00 C ATOM 255 CD2 TYR A 19 -4.286 -8.644 3.728 1.00 0.00 C ATOM 256 CE1 TYR A 19 -6.352 -8.813 1.953 1.00 0.00 C ATOM 257 CE2 TYR A 19 -5.521 -8.179 4.078 1.00 0.00 C ATOM 258 CZ TYR A 19 -6.553 -8.266 3.193 1.00 0.00 C ATOM 259 OH TYR A 19 -7.791 -7.789 3.546 1.00 0.00 O ATOM 0 H TYR A 19 -3.301 -11.250 3.946 1.00 0.00 H new ATOM 0 HA TYR A 19 -3.049 -11.528 1.110 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -1.972 -9.335 2.885 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -2.382 -9.231 1.184 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -4.954 -9.715 0.629 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -3.475 -8.574 4.438 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.170 -8.877 1.250 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -5.679 -7.744 5.054 1.00 0.00 H new ATOM 0 HH TYR A 19 -8.470 -8.172 2.953 1.00 0.00 H new ATOM 269 N MET A 20 -0.480 -11.733 3.080 1.00 0.00 N ATOM 270 CA MET A 20 0.913 -12.031 3.230 1.00 0.00 C ATOM 271 C MET A 20 1.160 -13.491 2.858 1.00 0.00 C ATOM 272 O MET A 20 2.276 -13.901 2.536 1.00 0.00 O ATOM 273 CB MET A 20 1.295 -11.749 4.676 1.00 0.00 C ATOM 274 CG MET A 20 2.704 -11.234 4.871 1.00 0.00 C ATOM 275 SD MET A 20 3.062 -9.799 3.816 1.00 0.00 S ATOM 276 CE MET A 20 1.568 -8.784 3.991 1.00 0.00 C ATOM 0 H MET A 20 -0.993 -11.717 3.961 1.00 0.00 H new ATOM 0 HA MET A 20 1.525 -11.415 2.572 1.00 0.00 H new ATOM 0 HB2 MET A 20 0.597 -11.019 5.086 1.00 0.00 H new ATOM 0 HB3 MET A 20 1.175 -12.665 5.254 1.00 0.00 H new ATOM 0 HG2 MET A 20 2.847 -10.959 5.916 1.00 0.00 H new ATOM 0 HG3 MET A 20 3.414 -12.031 4.651 1.00 0.00 H new ATOM 0 HE1 MET A 20 1.766 -7.778 3.620 1.00 0.00 H new ATOM 0 HE2 MET A 20 0.756 -9.229 3.416 1.00 0.00 H new ATOM 0 HE3 MET A 20 1.283 -8.734 5.042 1.00 0.00 H new ATOM 286 N SER A 21 0.099 -14.261 2.888 1.00 0.00 N ATOM 287 CA SER A 21 0.128 -15.635 2.504 1.00 0.00 C ATOM 288 C SER A 21 -0.117 -15.746 0.995 1.00 0.00 C ATOM 289 O SER A 21 0.174 -16.780 0.392 1.00 0.00 O ATOM 290 CB SER A 21 -0.938 -16.425 3.303 1.00 0.00 C ATOM 291 OG SER A 21 -0.903 -17.830 3.033 1.00 0.00 O ATOM 0 H SER A 21 -0.821 -13.936 3.187 1.00 0.00 H new ATOM 0 HA SER A 21 1.105 -16.063 2.728 1.00 0.00 H new ATOM 0 HB2 SER A 21 -0.783 -16.260 4.369 1.00 0.00 H new ATOM 0 HB3 SER A 21 -1.928 -16.038 3.062 1.00 0.00 H new ATOM 0 HG SER A 21 -1.593 -18.282 3.562 1.00 0.00 H new ATOM 297 N ALA A 22 -0.649 -14.678 0.383 1.00 0.00 N ATOM 298 CA ALA A 22 -0.914 -14.686 -1.045 1.00 0.00 C ATOM 299 C ALA A 22 0.386 -14.655 -1.836 1.00 0.00 C ATOM 300 O ALA A 22 0.536 -15.353 -2.833 1.00 0.00 O ATOM 301 CB ALA A 22 -1.797 -13.515 -1.430 1.00 0.00 C ATOM 0 H ALA A 22 -0.899 -13.810 0.857 1.00 0.00 H new ATOM 0 HA ALA A 22 -1.440 -15.610 -1.288 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -1.984 -13.538 -2.504 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -2.744 -13.582 -0.895 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -1.298 -12.582 -1.169 1.00 0.00 H new ATOM 307 N GLY A 23 1.325 -13.842 -1.383 1.00 0.00 N ATOM 308 CA GLY A 23 2.607 -13.745 -2.063 1.00 0.00 C ATOM 309 C GLY A 23 2.626 -12.609 -3.057 1.00 0.00 C ATOM 310 O GLY A 23 3.613 -12.379 -3.746 1.00 0.00 O ATOM 0 H GLY A 23 1.228 -13.247 -0.560 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.399 -13.599 -1.328 1.00 0.00 H new ATOM 0 HA3 GLY A 23 2.818 -14.683 -2.577 1.00 0.00 H new ATOM 314 N ILE A 24 1.530 -11.920 -3.137 1.00 0.00 N ATOM 315 CA ILE A 24 1.388 -10.776 -4.005 1.00 0.00 C ATOM 316 C ILE A 24 1.365 -9.506 -3.168 1.00 0.00 C ATOM 317 O ILE A 24 0.993 -9.564 -2.004 1.00 0.00 O ATOM 318 CB ILE A 24 0.109 -10.864 -4.881 1.00 0.00 C ATOM 319 CG1 ILE A 24 -1.117 -11.257 -4.033 1.00 0.00 C ATOM 320 CG2 ILE A 24 0.317 -11.842 -6.032 1.00 0.00 C ATOM 321 CD1 ILE A 24 -2.443 -11.152 -4.760 1.00 0.00 C ATOM 0 H ILE A 24 0.692 -12.134 -2.596 1.00 0.00 H new ATOM 0 HA ILE A 24 2.242 -10.759 -4.682 1.00 0.00 H new ATOM 0 HB ILE A 24 -0.085 -9.878 -5.303 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -0.988 -12.282 -3.684 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -1.150 -10.621 -3.149 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -0.589 -11.891 -6.636 1.00 0.00 H new ATOM 0 HG22 ILE A 24 1.148 -11.504 -6.651 1.00 0.00 H new ATOM 0 HG23 ILE A 24 0.541 -12.831 -5.633 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.250 -11.447 -4.089 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -2.599 -10.123 -5.085 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -2.435 -11.810 -5.629 1.00 0.00 H new ATOM 333 N PRO A 25 1.797 -8.363 -3.735 1.00 0.00 N ATOM 334 CA PRO A 25 1.847 -7.063 -3.035 1.00 0.00 C ATOM 335 C PRO A 25 0.513 -6.655 -2.391 1.00 0.00 C ATOM 336 O PRO A 25 -0.563 -6.837 -2.964 1.00 0.00 O ATOM 337 CB PRO A 25 2.230 -6.064 -4.135 1.00 0.00 C ATOM 338 CG PRO A 25 2.052 -6.800 -5.424 1.00 0.00 C ATOM 339 CD PRO A 25 2.281 -8.239 -5.118 1.00 0.00 C ATOM 0 HA PRO A 25 2.550 -7.102 -2.203 1.00 0.00 H new ATOM 0 HB2 PRO A 25 1.596 -5.178 -4.098 1.00 0.00 H new ATOM 0 HB3 PRO A 25 3.259 -5.725 -4.016 1.00 0.00 H new ATOM 0 HG2 PRO A 25 1.051 -6.642 -5.827 1.00 0.00 H new ATOM 0 HG3 PRO A 25 2.758 -6.445 -6.175 1.00 0.00 H new ATOM 0 HD2 PRO A 25 1.731 -8.889 -5.798 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.334 -8.507 -5.203 1.00 0.00 H new ATOM 347 N LEU A 26 0.591 -6.115 -1.206 1.00 0.00 N ATOM 348 CA LEU A 26 -0.568 -5.703 -0.470 1.00 0.00 C ATOM 349 C LEU A 26 -0.638 -4.193 -0.527 1.00 0.00 C ATOM 350 O LEU A 26 0.306 -3.513 -0.170 1.00 0.00 O ATOM 351 CB LEU A 26 -0.409 -6.131 0.985 1.00 0.00 C ATOM 352 CG LEU A 26 -1.679 -6.302 1.873 1.00 0.00 C ATOM 353 CD1 LEU A 26 -1.289 -6.719 3.265 1.00 0.00 C ATOM 354 CD2 LEU A 26 -2.528 -5.050 1.937 1.00 0.00 C ATOM 0 H LEU A 26 1.472 -5.948 -0.720 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.469 -6.150 -0.889 1.00 0.00 H new ATOM 0 HB2 LEU A 26 0.125 -7.081 0.990 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.236 -5.400 1.473 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.283 -7.079 1.404 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.185 -6.835 3.875 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.753 -7.667 3.224 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.646 -5.957 3.706 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.397 -5.232 2.570 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.940 -4.233 2.354 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -2.859 -4.783 0.933 1.00 0.00 H new ATOM 366 N ALA A 27 -1.728 -3.696 -0.950 1.00 0.00 N ATOM 367 CA ALA A 27 -1.945 -2.291 -1.003 1.00 0.00 C ATOM 368 C ALA A 27 -2.745 -1.854 0.209 1.00 0.00 C ATOM 369 O ALA A 27 -3.947 -2.135 0.318 1.00 0.00 O ATOM 370 CB ALA A 27 -2.650 -1.917 -2.274 1.00 0.00 C ATOM 0 H ALA A 27 -2.516 -4.254 -1.278 1.00 0.00 H new ATOM 0 HA ALA A 27 -0.983 -1.778 -0.991 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -2.808 -0.839 -2.299 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -2.042 -2.214 -3.128 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -3.613 -2.426 -2.319 1.00 0.00 H new ATOM 376 N TYR A 28 -2.069 -1.227 1.122 1.00 0.00 N ATOM 377 CA TYR A 28 -2.651 -0.738 2.340 1.00 0.00 C ATOM 378 C TYR A 28 -3.201 0.603 2.114 1.00 0.00 C ATOM 379 O TYR A 28 -2.461 1.560 1.880 1.00 0.00 O ATOM 380 CB TYR A 28 -1.623 -0.600 3.431 1.00 0.00 C ATOM 381 CG TYR A 28 -1.148 -1.861 4.064 1.00 0.00 C ATOM 382 CD1 TYR A 28 -0.138 -2.605 3.493 1.00 0.00 C ATOM 383 CD2 TYR A 28 -1.689 -2.293 5.262 1.00 0.00 C ATOM 384 CE1 TYR A 28 0.320 -3.743 4.094 1.00 0.00 C ATOM 385 CE2 TYR A 28 -1.239 -3.437 5.868 1.00 0.00 C ATOM 386 CZ TYR A 28 -0.230 -4.158 5.280 1.00 0.00 C ATOM 387 OH TYR A 28 0.249 -5.296 5.890 1.00 0.00 O ATOM 0 H TYR A 28 -1.071 -1.035 1.041 1.00 0.00 H new ATOM 0 HA TYR A 28 -3.418 -1.453 2.638 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -0.758 -0.079 3.020 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -2.038 0.037 4.212 1.00 0.00 H new ATOM 0 HD1 TYR A 28 0.297 -2.284 2.558 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -2.478 -1.720 5.727 1.00 0.00 H new ATOM 0 HE1 TYR A 28 1.114 -4.315 3.636 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -1.674 -3.768 6.799 1.00 0.00 H new ATOM 0 HH TYR A 28 1.199 -5.408 5.675 1.00 0.00 H new ATOM 397 N ILE A 29 -4.449 0.703 2.171 1.00 0.00 N ATOM 398 CA ILE A 29 -5.058 1.952 2.017 1.00 0.00 C ATOM 399 C ILE A 29 -5.429 2.464 3.382 1.00 0.00 C ATOM 400 O ILE A 29 -6.521 2.199 3.877 1.00 0.00 O ATOM 401 CB ILE A 29 -6.298 1.851 1.148 1.00 0.00 C ATOM 402 CG1 ILE A 29 -5.954 1.112 -0.148 1.00 0.00 C ATOM 403 CG2 ILE A 29 -6.806 3.253 0.858 1.00 0.00 C ATOM 404 CD1 ILE A 29 -7.071 0.256 -0.684 1.00 0.00 C ATOM 0 H ILE A 29 -5.089 -0.076 2.326 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.365 2.635 1.526 1.00 0.00 H new ATOM 0 HB ILE A 29 -7.080 1.291 1.662 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -5.675 1.843 -0.907 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -5.081 0.483 0.026 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -7.698 3.195 0.234 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -7.051 3.752 1.795 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -6.034 3.819 0.336 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -6.746 -0.233 -1.603 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -7.337 -0.500 0.055 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.940 0.880 -0.893 1.00 0.00 H new ATOM 416 N PHE A 30 -4.490 3.093 4.028 1.00 0.00 N ATOM 417 CA PHE A 30 -4.736 3.675 5.315 1.00 0.00 C ATOM 418 C PHE A 30 -5.490 4.909 5.117 1.00 0.00 C ATOM 419 O PHE A 30 -5.065 5.759 4.386 1.00 0.00 O ATOM 420 CB PHE A 30 -3.461 4.036 6.008 1.00 0.00 C ATOM 421 CG PHE A 30 -2.720 2.902 6.636 1.00 0.00 C ATOM 422 CD1 PHE A 30 -1.943 2.035 5.892 1.00 0.00 C ATOM 423 CD2 PHE A 30 -2.824 2.698 7.990 1.00 0.00 C ATOM 424 CE1 PHE A 30 -1.297 0.977 6.501 1.00 0.00 C ATOM 425 CE2 PHE A 30 -2.186 1.666 8.603 1.00 0.00 C ATOM 426 CZ PHE A 30 -1.421 0.790 7.858 1.00 0.00 C ATOM 0 H PHE A 30 -3.539 3.216 3.680 1.00 0.00 H new ATOM 0 HA PHE A 30 -5.277 2.949 5.922 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -2.802 4.521 5.287 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -3.685 4.771 6.781 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -1.840 2.186 4.828 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -3.426 3.372 8.581 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -0.696 0.299 5.913 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.277 1.531 9.671 1.00 0.00 H new ATOM 0 HZ PHE A 30 -0.922 -0.038 8.339 1.00 0.00 H new ATOM 436 N ALA A 31 -6.581 5.007 5.733 1.00 0.00 N ATOM 437 CA ALA A 31 -7.380 6.191 5.627 1.00 0.00 C ATOM 438 C ALA A 31 -7.845 6.637 6.978 1.00 0.00 C ATOM 439 O ALA A 31 -8.467 5.875 7.717 1.00 0.00 O ATOM 440 CB ALA A 31 -8.539 6.020 4.633 1.00 0.00 C ATOM 0 H ALA A 31 -6.970 4.281 6.334 1.00 0.00 H new ATOM 0 HA ALA A 31 -6.752 6.983 5.219 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.117 6.943 4.586 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.140 5.791 3.645 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.183 5.205 4.962 1.00 0.00 H new ATOM 446 N GLU A 32 -7.486 7.855 7.343 1.00 0.00 N ATOM 447 CA GLU A 32 -7.907 8.405 8.625 1.00 0.00 C ATOM 448 C GLU A 32 -9.305 8.938 8.468 1.00 0.00 C ATOM 449 O GLU A 32 -10.026 9.180 9.437 1.00 0.00 O ATOM 450 CB GLU A 32 -7.015 9.572 9.045 1.00 0.00 C ATOM 451 CG GLU A 32 -6.980 9.772 10.560 1.00 0.00 C ATOM 452 CD GLU A 32 -6.221 11.003 10.995 1.00 0.00 C ATOM 453 OE1 GLU A 32 -4.981 10.974 11.038 1.00 0.00 O ATOM 454 OE2 GLU A 32 -6.866 12.014 11.345 1.00 0.00 O ATOM 0 H GLU A 32 -6.910 8.479 6.778 1.00 0.00 H new ATOM 0 HA GLU A 32 -7.847 7.619 9.378 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -6.002 9.399 8.682 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -7.372 10.486 8.570 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -8.002 9.837 10.932 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -6.527 8.895 11.023 1.00 0.00 H new ATOM 461 N THR A 33 -9.686 9.115 7.252 1.00 0.00 N ATOM 462 CA THR A 33 -10.929 9.724 6.972 1.00 0.00 C ATOM 463 C THR A 33 -12.030 8.712 6.696 1.00 0.00 C ATOM 464 O THR A 33 -12.131 8.155 5.611 1.00 0.00 O ATOM 465 CB THR A 33 -10.765 10.755 5.863 1.00 0.00 C ATOM 466 OG1 THR A 33 -10.007 10.197 4.779 1.00 0.00 O ATOM 467 CG2 THR A 33 -10.026 11.953 6.402 1.00 0.00 C ATOM 0 H THR A 33 -9.146 8.842 6.431 1.00 0.00 H new ATOM 0 HA THR A 33 -11.261 10.252 7.866 1.00 0.00 H new ATOM 0 HB THR A 33 -11.752 11.048 5.505 1.00 0.00 H new ATOM 0 HG1 THR A 33 -9.988 10.832 4.033 1.00 0.00 H new ATOM 0 HG21 THR A 33 -9.907 12.693 5.611 1.00 0.00 H new ATOM 0 HG22 THR A 33 -10.592 12.390 7.225 1.00 0.00 H new ATOM 0 HG23 THR A 33 -9.044 11.644 6.761 1.00 0.00 H new ATOM 475 N ALA A 34 -12.854 8.477 7.712 1.00 0.00 N ATOM 476 CA ALA A 34 -13.930 7.503 7.639 1.00 0.00 C ATOM 477 C ALA A 34 -15.087 8.035 6.819 1.00 0.00 C ATOM 478 O ALA A 34 -15.935 7.279 6.359 1.00 0.00 O ATOM 479 CB ALA A 34 -14.391 7.105 9.032 1.00 0.00 C ATOM 0 H ALA A 34 -12.792 8.959 8.609 1.00 0.00 H new ATOM 0 HA ALA A 34 -13.547 6.612 7.141 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -15.197 6.375 8.954 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -13.557 6.667 9.580 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -14.750 7.987 9.562 1.00 0.00 H new ATOM 485 N GLU A 35 -15.100 9.335 6.619 1.00 0.00 N ATOM 486 CA GLU A 35 -16.125 9.971 5.842 1.00 0.00 C ATOM 487 C GLU A 35 -15.952 9.644 4.396 1.00 0.00 C ATOM 488 O GLU A 35 -16.830 9.071 3.783 1.00 0.00 O ATOM 489 CB GLU A 35 -16.064 11.459 6.014 1.00 0.00 C ATOM 490 CG GLU A 35 -16.505 11.948 7.353 1.00 0.00 C ATOM 491 CD GLU A 35 -16.176 13.386 7.526 1.00 0.00 C ATOM 492 OE1 GLU A 35 -16.888 14.241 6.982 1.00 0.00 O ATOM 493 OE2 GLU A 35 -15.166 13.677 8.180 1.00 0.00 O ATOM 0 H GLU A 35 -14.399 9.974 6.993 1.00 0.00 H new ATOM 0 HA GLU A 35 -17.091 9.605 6.189 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -15.040 11.790 5.840 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -16.684 11.926 5.249 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -17.579 11.801 7.463 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -16.022 11.363 8.136 1.00 0.00 H new ATOM 500 N GLU A 36 -14.791 9.950 3.866 1.00 0.00 N ATOM 501 CA GLU A 36 -14.572 9.769 2.454 1.00 0.00 C ATOM 502 C GLU A 36 -14.009 8.394 2.149 1.00 0.00 C ATOM 503 O GLU A 36 -13.654 8.125 1.019 1.00 0.00 O ATOM 504 CB GLU A 36 -13.609 10.832 1.923 1.00 0.00 C ATOM 505 CG GLU A 36 -12.166 10.604 2.346 1.00 0.00 C ATOM 506 CD GLU A 36 -11.259 11.738 2.007 1.00 0.00 C ATOM 507 OE1 GLU A 36 -11.166 12.130 0.818 1.00 0.00 O ATOM 508 OE2 GLU A 36 -10.604 12.254 2.932 1.00 0.00 O ATOM 0 H GLU A 36 -13.995 10.320 4.384 1.00 0.00 H new ATOM 0 HA GLU A 36 -15.539 9.867 1.961 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -13.663 10.849 0.834 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -13.932 11.812 2.273 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -12.134 10.433 3.422 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -11.795 9.697 1.868 1.00 0.00 H new ATOM 515 N ARG A 37 -13.960 7.511 3.141 1.00 0.00 N ATOM 516 CA ARG A 37 -13.278 6.238 2.959 1.00 0.00 C ATOM 517 C ARG A 37 -13.855 5.386 1.831 1.00 0.00 C ATOM 518 O ARG A 37 -13.111 4.702 1.147 1.00 0.00 O ATOM 519 CB ARG A 37 -13.037 5.461 4.290 1.00 0.00 C ATOM 520 CG ARG A 37 -14.256 4.920 5.042 1.00 0.00 C ATOM 521 CD ARG A 37 -14.801 3.666 4.404 1.00 0.00 C ATOM 522 NE ARG A 37 -15.851 3.044 5.200 1.00 0.00 N ATOM 523 CZ ARG A 37 -15.823 1.769 5.603 1.00 0.00 C ATOM 524 NH1 ARG A 37 -14.816 0.979 5.245 1.00 0.00 N ATOM 525 NH2 ARG A 37 -16.811 1.282 6.339 1.00 0.00 N ATOM 0 H ARG A 37 -14.376 7.650 4.062 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.278 6.500 2.613 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -12.381 4.619 4.070 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -12.494 6.120 4.967 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -13.981 4.711 6.076 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -15.035 5.682 5.067 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -15.193 3.906 3.416 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.989 2.953 4.260 1.00 0.00 H new ATOM 0 HE ARG A 37 -16.654 3.614 5.465 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -14.063 1.345 4.662 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -14.796 0.007 5.553 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -17.595 1.880 6.600 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -16.787 0.309 6.645 1.00 0.00 H new ATOM 539 N LYS A 38 -15.158 5.463 1.595 1.00 0.00 N ATOM 540 CA LYS A 38 -15.728 4.713 0.490 1.00 0.00 C ATOM 541 C LYS A 38 -15.446 5.397 -0.822 1.00 0.00 C ATOM 542 O LYS A 38 -15.246 4.739 -1.805 1.00 0.00 O ATOM 543 CB LYS A 38 -17.225 4.407 0.638 1.00 0.00 C ATOM 544 CG LYS A 38 -17.593 3.459 1.786 1.00 0.00 C ATOM 545 CD LYS A 38 -16.827 2.119 1.738 1.00 0.00 C ATOM 546 CE LYS A 38 -17.035 1.332 0.438 1.00 0.00 C ATOM 547 NZ LYS A 38 -18.455 0.994 0.187 1.00 0.00 N ATOM 0 H LYS A 38 -15.820 6.019 2.136 1.00 0.00 H new ATOM 0 HA LYS A 38 -15.231 3.743 0.507 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -17.758 5.347 0.781 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -17.584 3.975 -0.296 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -17.389 3.953 2.736 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -18.664 3.259 1.754 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -15.763 2.315 1.866 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -17.141 1.502 2.580 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -16.653 1.916 -0.399 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -16.450 0.413 0.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -18.533 0.463 -0.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -18.817 0.412 0.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -19.013 1.869 0.119 1.00 0.00 H new ATOM 561 N GLU A 39 -15.407 6.723 -0.814 1.00 0.00 N ATOM 562 CA GLU A 39 -15.066 7.511 -2.001 1.00 0.00 C ATOM 563 C GLU A 39 -13.626 7.242 -2.372 1.00 0.00 C ATOM 564 O GLU A 39 -13.291 7.021 -3.535 1.00 0.00 O ATOM 565 CB GLU A 39 -15.244 9.031 -1.775 1.00 0.00 C ATOM 566 CG GLU A 39 -16.665 9.512 -1.502 1.00 0.00 C ATOM 567 CD GLU A 39 -17.198 9.144 -0.135 1.00 0.00 C ATOM 568 OE1 GLU A 39 -17.684 8.018 0.043 1.00 0.00 O ATOM 569 OE2 GLU A 39 -17.147 9.980 0.773 1.00 0.00 O ATOM 0 H GLU A 39 -15.610 7.286 0.012 1.00 0.00 H new ATOM 0 HA GLU A 39 -15.745 7.212 -2.799 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -14.615 9.328 -0.936 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -14.869 9.554 -2.655 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -16.696 10.596 -1.611 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -17.328 9.097 -2.261 1.00 0.00 H new ATOM 576 N LEU A 40 -12.794 7.229 -1.358 1.00 0.00 N ATOM 577 CA LEU A 40 -11.385 6.962 -1.457 1.00 0.00 C ATOM 578 C LEU A 40 -11.233 5.563 -2.129 1.00 0.00 C ATOM 579 O LEU A 40 -10.603 5.405 -3.207 1.00 0.00 O ATOM 580 CB LEU A 40 -10.835 7.015 0.018 1.00 0.00 C ATOM 581 CG LEU A 40 -9.360 7.368 0.270 1.00 0.00 C ATOM 582 CD1 LEU A 40 -8.450 6.276 -0.212 1.00 0.00 C ATOM 583 CD2 LEU A 40 -9.025 8.684 -0.407 1.00 0.00 C ATOM 0 H LEU A 40 -13.097 7.413 -0.402 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.824 7.675 -2.061 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -11.441 7.737 0.565 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -11.018 6.039 0.469 1.00 0.00 H new ATOM 0 HG LEU A 40 -9.207 7.472 1.344 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -7.414 6.555 -0.020 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.681 5.351 0.316 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -8.594 6.129 -1.282 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.979 8.930 -0.226 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -9.196 8.595 -1.480 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -9.659 9.473 -0.002 1.00 0.00 H new ATOM 595 N SER A 41 -11.971 4.611 -1.592 1.00 0.00 N ATOM 596 CA SER A 41 -11.958 3.244 -2.082 1.00 0.00 C ATOM 597 C SER A 41 -12.704 3.130 -3.418 1.00 0.00 C ATOM 598 O SER A 41 -12.599 2.152 -4.098 1.00 0.00 O ATOM 599 CB SER A 41 -12.615 2.325 -1.071 1.00 0.00 C ATOM 600 OG SER A 41 -12.069 2.501 0.227 1.00 0.00 O ATOM 0 H SER A 41 -12.598 4.763 -0.802 1.00 0.00 H new ATOM 0 HA SER A 41 -10.919 2.952 -2.232 1.00 0.00 H new ATOM 0 HB2 SER A 41 -13.687 2.519 -1.045 1.00 0.00 H new ATOM 0 HB3 SER A 41 -12.486 1.289 -1.383 1.00 0.00 H new ATOM 0 HG SER A 41 -12.663 3.072 0.757 1.00 0.00 H new ATOM 606 N ASP A 42 -13.441 4.145 -3.766 1.00 0.00 N ATOM 607 CA ASP A 42 -14.239 4.168 -4.980 1.00 0.00 C ATOM 608 C ASP A 42 -13.388 4.428 -6.176 1.00 0.00 C ATOM 609 O ASP A 42 -13.612 3.861 -7.223 1.00 0.00 O ATOM 610 CB ASP A 42 -15.282 5.214 -4.850 1.00 0.00 C ATOM 611 CG ASP A 42 -16.225 5.292 -6.012 1.00 0.00 C ATOM 612 OD1 ASP A 42 -17.206 4.519 -6.057 1.00 0.00 O ATOM 613 OD2 ASP A 42 -16.034 6.151 -6.877 1.00 0.00 O ATOM 0 H ASP A 42 -13.513 4.999 -3.212 1.00 0.00 H new ATOM 0 HA ASP A 42 -14.709 3.194 -5.116 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -15.856 5.027 -3.943 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -14.796 6.182 -4.726 1.00 0.00 H new ATOM 618 N LYS A 43 -12.409 5.295 -6.025 1.00 0.00 N ATOM 619 CA LYS A 43 -11.424 5.480 -7.084 1.00 0.00 C ATOM 620 C LYS A 43 -10.566 4.210 -7.159 1.00 0.00 C ATOM 621 O LYS A 43 -10.218 3.664 -8.259 1.00 0.00 O ATOM 622 CB LYS A 43 -10.534 6.736 -6.842 1.00 0.00 C ATOM 623 CG LYS A 43 -11.144 8.098 -7.272 1.00 0.00 C ATOM 624 CD LYS A 43 -12.299 8.593 -6.402 1.00 0.00 C ATOM 625 CE LYS A 43 -11.855 9.095 -5.018 1.00 0.00 C ATOM 626 NZ LYS A 43 -10.983 10.301 -5.052 1.00 0.00 N ATOM 0 H LYS A 43 -12.270 5.876 -5.198 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.940 5.649 -8.029 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -10.294 6.787 -5.780 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -9.593 6.598 -7.375 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -10.355 8.850 -7.265 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -11.494 8.013 -8.301 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -12.816 9.399 -6.923 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -13.018 7.784 -6.273 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -12.741 9.319 -4.425 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -11.324 8.292 -4.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -10.007 10.030 -4.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.007 10.720 -6.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -11.325 10.996 -4.359 1.00 0.00 H new ATOM 640 N LEU A 44 -10.331 3.668 -5.990 1.00 0.00 N ATOM 641 CA LEU A 44 -9.527 2.498 -5.843 1.00 0.00 C ATOM 642 C LEU A 44 -10.244 1.256 -6.322 1.00 0.00 C ATOM 643 O LEU A 44 -9.630 0.256 -6.612 1.00 0.00 O ATOM 644 CB LEU A 44 -9.231 2.351 -4.408 1.00 0.00 C ATOM 645 CG LEU A 44 -8.378 3.431 -3.783 1.00 0.00 C ATOM 646 CD1 LEU A 44 -8.130 3.114 -2.332 1.00 0.00 C ATOM 647 CD2 LEU A 44 -7.067 3.602 -4.538 1.00 0.00 C ATOM 0 H LEU A 44 -10.699 4.035 -5.112 1.00 0.00 H new ATOM 0 HA LEU A 44 -8.623 2.608 -6.442 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -10.176 2.307 -3.867 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.733 1.393 -4.258 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.915 4.377 -3.846 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -7.515 3.897 -1.889 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -9.082 3.058 -1.804 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.614 2.157 -2.252 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -6.475 4.385 -4.066 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -6.511 2.665 -4.518 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -7.276 3.878 -5.572 1.00 0.00 H new ATOM 659 N LYS A 45 -11.526 1.358 -6.422 1.00 0.00 N ATOM 660 CA LYS A 45 -12.391 0.257 -6.774 1.00 0.00 C ATOM 661 C LYS A 45 -12.079 -0.273 -8.186 1.00 0.00 C ATOM 662 O LYS A 45 -11.776 -1.462 -8.333 1.00 0.00 O ATOM 663 CB LYS A 45 -13.857 0.682 -6.561 1.00 0.00 C ATOM 664 CG LYS A 45 -14.937 -0.282 -6.992 1.00 0.00 C ATOM 665 CD LYS A 45 -16.310 0.364 -6.805 1.00 0.00 C ATOM 666 CE LYS A 45 -16.513 1.569 -7.741 1.00 0.00 C ATOM 667 NZ LYS A 45 -17.770 2.286 -7.463 1.00 0.00 N ATOM 0 H LYS A 45 -12.027 2.231 -6.258 1.00 0.00 H new ATOM 0 HA LYS A 45 -12.208 -0.594 -6.118 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -13.996 0.888 -5.500 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -14.014 1.621 -7.091 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -14.794 -0.559 -8.036 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -14.873 -1.199 -6.407 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -17.088 -0.376 -6.993 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -16.421 0.686 -5.770 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -15.674 2.256 -7.633 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -16.513 1.227 -8.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -18.054 2.827 -8.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -18.515 1.601 -7.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -17.629 2.937 -6.664 1.00 0.00 H new ATOM 681 N PRO A 46 -12.094 0.581 -9.236 1.00 0.00 N ATOM 682 CA PRO A 46 -11.732 0.170 -10.589 1.00 0.00 C ATOM 683 C PRO A 46 -10.265 -0.048 -10.673 1.00 0.00 C ATOM 684 O PRO A 46 -9.808 -0.988 -11.352 1.00 0.00 O ATOM 685 CB PRO A 46 -12.089 1.389 -11.405 1.00 0.00 C ATOM 686 CG PRO A 46 -13.090 2.034 -10.577 1.00 0.00 C ATOM 687 CD PRO A 46 -12.496 1.979 -9.254 1.00 0.00 C ATOM 0 HA PRO A 46 -12.223 -0.749 -10.911 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.225 2.032 -11.574 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.483 1.121 -12.385 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.277 3.060 -10.894 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.045 1.509 -10.614 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -11.652 2.660 -9.144 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -13.207 2.222 -8.464 1.00 0.00 H new ATOM 695 N ILE A 47 -9.486 0.813 -9.950 1.00 0.00 N ATOM 696 CA ILE A 47 -8.043 0.643 -9.937 1.00 0.00 C ATOM 697 C ILE A 47 -7.684 -0.761 -9.513 1.00 0.00 C ATOM 698 O ILE A 47 -6.847 -1.386 -10.115 1.00 0.00 O ATOM 699 CB ILE A 47 -7.321 1.680 -9.025 1.00 0.00 C ATOM 700 CG1 ILE A 47 -7.556 3.087 -9.550 1.00 0.00 C ATOM 701 CG2 ILE A 47 -5.821 1.397 -8.905 1.00 0.00 C ATOM 702 CD1 ILE A 47 -7.250 3.235 -11.016 1.00 0.00 C ATOM 0 H ILE A 47 -9.838 1.595 -9.397 1.00 0.00 H new ATOM 0 HA ILE A 47 -7.696 0.818 -10.955 1.00 0.00 H new ATOM 0 HB ILE A 47 -7.745 1.592 -8.025 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -8.595 3.364 -9.373 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -6.939 3.786 -8.985 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -5.360 2.145 -8.260 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -5.671 0.406 -8.476 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -5.363 1.438 -9.893 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -7.439 4.263 -11.325 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -6.204 2.989 -11.196 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -7.885 2.561 -11.590 1.00 0.00 H new ATOM 714 N ALA A 48 -8.444 -1.294 -8.594 1.00 0.00 N ATOM 715 CA ALA A 48 -8.115 -2.594 -8.029 1.00 0.00 C ATOM 716 C ALA A 48 -8.768 -3.691 -8.787 1.00 0.00 C ATOM 717 O ALA A 48 -8.355 -4.809 -8.707 1.00 0.00 O ATOM 718 CB ALA A 48 -8.501 -2.681 -6.584 1.00 0.00 C ATOM 0 H ALA A 48 -9.288 -0.862 -8.218 1.00 0.00 H new ATOM 0 HA ALA A 48 -7.034 -2.707 -8.106 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -8.240 -3.666 -6.196 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -7.969 -1.916 -6.019 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.575 -2.525 -6.484 1.00 0.00 H new ATOM 724 N GLU A 49 -9.799 -3.382 -9.514 1.00 0.00 N ATOM 725 CA GLU A 49 -10.437 -4.338 -10.336 1.00 0.00 C ATOM 726 C GLU A 49 -9.496 -4.675 -11.500 1.00 0.00 C ATOM 727 O GLU A 49 -9.543 -5.761 -12.077 1.00 0.00 O ATOM 728 CB GLU A 49 -11.717 -3.736 -10.844 1.00 0.00 C ATOM 729 CG GLU A 49 -12.794 -4.738 -10.974 1.00 0.00 C ATOM 730 CD GLU A 49 -14.070 -4.173 -11.523 1.00 0.00 C ATOM 731 OE1 GLU A 49 -14.875 -3.615 -10.744 1.00 0.00 O ATOM 732 OE2 GLU A 49 -14.293 -4.285 -12.736 1.00 0.00 O ATOM 0 H GLU A 49 -10.216 -2.452 -9.547 1.00 0.00 H new ATOM 0 HA GLU A 49 -10.664 -5.252 -9.787 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -12.039 -2.946 -10.166 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -11.538 -3.271 -11.813 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -12.453 -5.544 -11.623 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -12.991 -5.178 -9.996 1.00 0.00 H new ATOM 739 N ALA A 50 -8.591 -3.745 -11.772 1.00 0.00 N ATOM 740 CA ALA A 50 -7.613 -3.865 -12.832 1.00 0.00 C ATOM 741 C ALA A 50 -6.422 -4.691 -12.375 1.00 0.00 C ATOM 742 O ALA A 50 -5.553 -5.048 -13.165 1.00 0.00 O ATOM 743 CB ALA A 50 -7.125 -2.484 -13.175 1.00 0.00 C ATOM 0 H ALA A 50 -8.519 -2.872 -11.250 1.00 0.00 H new ATOM 0 HA ALA A 50 -8.074 -4.353 -13.691 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.385 -2.547 -13.973 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -7.965 -1.873 -13.506 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -6.671 -2.030 -12.295 1.00 0.00 H new ATOM 749 N GLN A 51 -6.385 -4.970 -11.101 1.00 0.00 N ATOM 750 CA GLN A 51 -5.267 -5.617 -10.470 1.00 0.00 C ATOM 751 C GLN A 51 -5.728 -6.466 -9.313 1.00 0.00 C ATOM 752 O GLN A 51 -5.009 -6.706 -8.349 1.00 0.00 O ATOM 753 CB GLN A 51 -4.287 -4.545 -10.066 1.00 0.00 C ATOM 754 CG GLN A 51 -4.857 -3.366 -9.368 1.00 0.00 C ATOM 755 CD GLN A 51 -3.806 -2.346 -9.052 1.00 0.00 C ATOM 756 OE1 GLN A 51 -3.901 -1.611 -8.100 1.00 0.00 O ATOM 757 NE2 GLN A 51 -2.787 -2.294 -9.858 1.00 0.00 N ATOM 0 H GLN A 51 -7.147 -4.750 -10.459 1.00 0.00 H new ATOM 0 HA GLN A 51 -4.769 -6.303 -11.155 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -3.534 -4.995 -9.419 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -3.771 -4.197 -10.961 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -5.628 -2.913 -9.991 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -5.340 -3.688 -8.446 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -2.734 -2.928 -10.655 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -2.040 -1.619 -9.693 1.00 0.00 H new ATOM 766 N ARG A 52 -6.887 -7.037 -9.522 1.00 0.00 N ATOM 767 CA ARG A 52 -7.627 -7.793 -8.536 1.00 0.00 C ATOM 768 C ARG A 52 -6.995 -9.146 -8.273 1.00 0.00 C ATOM 769 O ARG A 52 -7.273 -9.789 -7.271 1.00 0.00 O ATOM 770 CB ARG A 52 -9.068 -7.952 -9.026 1.00 0.00 C ATOM 771 CG ARG A 52 -9.203 -8.737 -10.323 1.00 0.00 C ATOM 772 CD ARG A 52 -10.643 -8.817 -10.769 1.00 0.00 C ATOM 773 NE ARG A 52 -10.782 -9.570 -12.021 1.00 0.00 N ATOM 774 CZ ARG A 52 -11.902 -9.652 -12.761 1.00 0.00 C ATOM 775 NH1 ARG A 52 -13.007 -9.003 -12.390 1.00 0.00 N ATOM 776 NH2 ARG A 52 -11.912 -10.388 -13.872 1.00 0.00 N ATOM 0 H ARG A 52 -7.364 -6.987 -10.422 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.612 -7.252 -7.590 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.651 -8.450 -8.251 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -9.503 -6.963 -9.166 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -8.605 -8.263 -11.101 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -8.807 -9.743 -10.185 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -11.239 -9.292 -9.990 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -11.039 -7.810 -10.904 1.00 0.00 H new ATOM 0 HE ARG A 52 -9.961 -10.073 -12.358 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -13.006 -8.440 -11.540 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -13.852 -9.070 -12.957 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -11.071 -10.888 -14.160 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -12.761 -10.451 -14.434 1.00 0.00 H new ATOM 790 N GLY A 53 -6.184 -9.572 -9.190 1.00 0.00 N ATOM 791 CA GLY A 53 -5.497 -10.810 -9.037 1.00 0.00 C ATOM 792 C GLY A 53 -4.013 -10.614 -8.961 1.00 0.00 C ATOM 793 O GLY A 53 -3.252 -11.526 -9.253 1.00 0.00 O ATOM 0 H GLY A 53 -5.982 -9.075 -10.057 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -5.845 -11.310 -8.133 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -5.735 -11.465 -9.875 1.00 0.00 H new ATOM 797 N VAL A 54 -3.584 -9.425 -8.605 1.00 0.00 N ATOM 798 CA VAL A 54 -2.163 -9.169 -8.488 1.00 0.00 C ATOM 799 C VAL A 54 -1.846 -8.317 -7.257 1.00 0.00 C ATOM 800 O VAL A 54 -0.799 -8.480 -6.644 1.00 0.00 O ATOM 801 CB VAL A 54 -1.536 -8.573 -9.801 1.00 0.00 C ATOM 802 CG1 VAL A 54 -2.096 -7.210 -10.145 1.00 0.00 C ATOM 803 CG2 VAL A 54 -0.010 -8.539 -9.734 1.00 0.00 C ATOM 0 H VAL A 54 -4.186 -8.629 -8.394 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.684 -10.138 -8.346 1.00 0.00 H new ATOM 0 HB VAL A 54 -1.821 -9.247 -10.609 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.629 -6.845 -11.060 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.173 -7.286 -10.293 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.890 -6.516 -9.330 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.386 -8.121 -10.660 1.00 0.00 H new ATOM 0 HG22 VAL A 54 0.304 -7.920 -8.893 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.371 -9.552 -9.601 1.00 0.00 H new ATOM 813 N ILE A 55 -2.739 -7.423 -6.880 1.00 0.00 N ATOM 814 CA ILE A 55 -2.506 -6.635 -5.678 1.00 0.00 C ATOM 815 C ILE A 55 -3.656 -6.811 -4.680 1.00 0.00 C ATOM 816 O ILE A 55 -4.825 -6.836 -5.071 1.00 0.00 O ATOM 817 CB ILE A 55 -2.265 -5.124 -6.003 1.00 0.00 C ATOM 818 CG1 ILE A 55 -1.006 -4.970 -6.847 1.00 0.00 C ATOM 819 CG2 ILE A 55 -2.093 -4.328 -4.724 1.00 0.00 C ATOM 820 CD1 ILE A 55 -0.755 -3.553 -7.357 1.00 0.00 C ATOM 0 H ILE A 55 -3.611 -7.224 -7.371 1.00 0.00 H new ATOM 0 HA ILE A 55 -1.592 -7.009 -5.216 1.00 0.00 H new ATOM 0 HB ILE A 55 -3.130 -4.750 -6.551 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -0.147 -5.287 -6.256 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -1.072 -5.644 -7.701 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -1.926 -3.279 -4.968 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -2.992 -4.420 -4.114 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -1.237 -4.712 -4.169 1.00 0.00 H new ATOM 0 HD11 ILE A 55 0.161 -3.536 -7.948 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.593 -3.236 -7.978 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -0.653 -2.874 -6.510 1.00 0.00 H new ATOM 832 N ASN A 56 -3.317 -6.954 -3.396 1.00 0.00 N ATOM 833 CA ASN A 56 -4.326 -7.128 -2.359 1.00 0.00 C ATOM 834 C ASN A 56 -4.814 -5.761 -1.958 1.00 0.00 C ATOM 835 O ASN A 56 -4.061 -4.994 -1.380 1.00 0.00 O ATOM 836 CB ASN A 56 -3.744 -7.784 -1.099 1.00 0.00 C ATOM 837 CG ASN A 56 -2.983 -9.077 -1.311 1.00 0.00 C ATOM 838 OD1 ASN A 56 -3.548 -10.159 -1.301 1.00 0.00 O ATOM 839 ND2 ASN A 56 -1.684 -8.979 -1.467 1.00 0.00 N ATOM 0 H ASN A 56 -2.356 -6.952 -3.055 1.00 0.00 H new ATOM 0 HA ASN A 56 -5.118 -7.763 -2.757 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -3.078 -7.069 -0.617 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -4.561 -7.977 -0.404 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -1.119 -9.820 -1.584 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -1.239 -8.061 -1.471 1.00 0.00 H new ATOM 846 N PHE A 57 -6.027 -5.441 -2.260 1.00 0.00 N ATOM 847 CA PHE A 57 -6.548 -4.129 -1.941 1.00 0.00 C ATOM 848 C PHE A 57 -7.351 -4.099 -0.667 1.00 0.00 C ATOM 849 O PHE A 57 -8.487 -4.559 -0.618 1.00 0.00 O ATOM 850 CB PHE A 57 -7.332 -3.554 -3.097 1.00 0.00 C ATOM 851 CG PHE A 57 -6.569 -2.529 -3.853 1.00 0.00 C ATOM 852 CD1 PHE A 57 -5.465 -2.877 -4.598 1.00 0.00 C ATOM 853 CD2 PHE A 57 -6.948 -1.205 -3.806 1.00 0.00 C ATOM 854 CE1 PHE A 57 -4.759 -1.924 -5.286 1.00 0.00 C ATOM 855 CE2 PHE A 57 -6.246 -0.247 -4.492 1.00 0.00 C ATOM 856 CZ PHE A 57 -5.147 -0.605 -5.233 1.00 0.00 C ATOM 0 H PHE A 57 -6.687 -6.062 -2.728 1.00 0.00 H new ATOM 0 HA PHE A 57 -5.680 -3.494 -1.765 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.618 -4.360 -3.773 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -8.254 -3.111 -2.721 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -5.152 -3.910 -4.641 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -7.809 -0.918 -3.221 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -3.897 -2.209 -5.871 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -6.557 0.786 -4.449 1.00 0.00 H new ATOM 0 HZ PHE A 57 -4.589 0.146 -5.772 1.00 0.00 H new ATOM 866 N GLY A 58 -6.767 -3.547 0.349 1.00 0.00 N ATOM 867 CA GLY A 58 -7.416 -3.458 1.603 1.00 0.00 C ATOM 868 C GLY A 58 -7.364 -2.080 2.189 1.00 0.00 C ATOM 869 O GLY A 58 -6.301 -1.452 2.247 1.00 0.00 O ATOM 0 H GLY A 58 -5.829 -3.148 0.325 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -8.457 -3.760 1.490 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -6.954 -4.160 2.297 1.00 0.00 H new ATOM 873 N THR A 59 -8.485 -1.600 2.603 1.00 0.00 N ATOM 874 CA THR A 59 -8.567 -0.346 3.273 1.00 0.00 C ATOM 875 C THR A 59 -8.474 -0.565 4.762 1.00 0.00 C ATOM 876 O THR A 59 -9.062 -1.508 5.294 1.00 0.00 O ATOM 877 CB THR A 59 -9.856 0.415 2.900 1.00 0.00 C ATOM 878 OG1 THR A 59 -11.010 -0.419 3.097 1.00 0.00 O ATOM 879 CG2 THR A 59 -9.810 0.854 1.461 1.00 0.00 C ATOM 0 H THR A 59 -9.382 -2.071 2.485 1.00 0.00 H new ATOM 0 HA THR A 59 -7.731 0.275 2.952 1.00 0.00 H new ATOM 0 HB THR A 59 -9.927 1.290 3.546 1.00 0.00 H new ATOM 0 HG1 THR A 59 -11.819 0.080 2.857 1.00 0.00 H new ATOM 0 HG21 THR A 59 -10.727 1.389 1.214 1.00 0.00 H new ATOM 0 HG22 THR A 59 -8.954 1.511 1.308 1.00 0.00 H new ATOM 0 HG23 THR A 59 -9.716 -0.020 0.817 1.00 0.00 H new ATOM 887 N ILE A 60 -7.723 0.257 5.418 1.00 0.00 N ATOM 888 CA ILE A 60 -7.521 0.145 6.820 1.00 0.00 C ATOM 889 C ILE A 60 -7.595 1.547 7.408 1.00 0.00 C ATOM 890 O ILE A 60 -7.410 2.534 6.685 1.00 0.00 O ATOM 891 CB ILE A 60 -6.140 -0.528 7.111 1.00 0.00 C ATOM 892 CG1 ILE A 60 -5.922 -0.752 8.616 1.00 0.00 C ATOM 893 CG2 ILE A 60 -4.997 0.269 6.501 1.00 0.00 C ATOM 894 CD1 ILE A 60 -4.569 -1.317 8.953 1.00 0.00 C ATOM 0 H ILE A 60 -7.226 1.036 4.986 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.285 -0.484 7.277 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.152 -1.509 6.636 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -6.050 0.196 9.138 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.691 -1.428 8.989 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -4.051 -0.225 6.721 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.132 0.330 5.421 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -4.988 1.274 6.923 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -4.488 -1.448 10.032 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -4.444 -2.281 8.460 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -3.793 -0.632 8.611 1.00 0.00 H new ATOM 906 N ASP A 61 -7.894 1.645 8.662 1.00 0.00 N ATOM 907 CA ASP A 61 -8.002 2.917 9.318 1.00 0.00 C ATOM 908 C ASP A 61 -6.621 3.495 9.570 1.00 0.00 C ATOM 909 O ASP A 61 -5.636 2.767 9.703 1.00 0.00 O ATOM 910 CB ASP A 61 -8.735 2.778 10.663 1.00 0.00 C ATOM 911 CG ASP A 61 -7.974 2.029 11.657 1.00 0.00 C ATOM 912 OD1 ASP A 61 -7.133 2.625 12.282 1.00 0.00 O ATOM 913 OD2 ASP A 61 -8.243 0.854 11.847 1.00 0.00 O ATOM 0 H ASP A 61 -8.072 0.844 9.268 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.569 3.582 8.667 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -8.953 3.771 11.055 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -9.692 2.283 10.499 1.00 0.00 H new ATOM 918 N ALA A 62 -6.538 4.797 9.570 1.00 0.00 N ATOM 919 CA ALA A 62 -5.326 5.450 10.020 1.00 0.00 C ATOM 920 C ALA A 62 -5.589 6.090 11.373 1.00 0.00 C ATOM 921 O ALA A 62 -4.803 6.884 11.878 1.00 0.00 O ATOM 922 CB ALA A 62 -4.852 6.472 9.023 1.00 0.00 C ATOM 0 H ALA A 62 -7.282 5.426 9.268 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.533 4.708 10.115 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -3.941 6.944 9.391 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.649 5.984 8.070 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -5.623 7.230 8.885 1.00 0.00 H new ATOM 928 N LYS A 63 -6.691 5.688 11.956 1.00 0.00 N ATOM 929 CA LYS A 63 -7.166 6.195 13.234 1.00 0.00 C ATOM 930 C LYS A 63 -6.489 5.433 14.349 1.00 0.00 C ATOM 931 O LYS A 63 -5.855 5.997 15.244 1.00 0.00 O ATOM 932 CB LYS A 63 -8.675 5.914 13.351 1.00 0.00 C ATOM 933 CG LYS A 63 -9.539 6.495 12.249 1.00 0.00 C ATOM 934 CD LYS A 63 -9.741 7.999 12.384 1.00 0.00 C ATOM 935 CE LYS A 63 -10.532 8.355 13.639 1.00 0.00 C ATOM 936 NZ LYS A 63 -10.885 9.786 13.682 1.00 0.00 N ATOM 0 H LYS A 63 -7.304 4.981 11.550 1.00 0.00 H new ATOM 0 HA LYS A 63 -6.954 7.262 13.300 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -8.824 4.834 13.374 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -9.026 6.304 14.306 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -9.081 6.280 11.284 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -10.511 6.001 12.257 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -8.771 8.495 12.413 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -10.265 8.376 11.505 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -11.442 7.756 13.676 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -9.946 8.100 14.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -11.422 9.985 14.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -10.017 10.358 13.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -11.466 10.025 12.853 1.00 0.00 H new ATOM 950 N ALA A 64 -6.614 4.155 14.249 1.00 0.00 N ATOM 951 CA ALA A 64 -6.200 3.219 15.257 1.00 0.00 C ATOM 952 C ALA A 64 -4.985 2.428 14.809 1.00 0.00 C ATOM 953 O ALA A 64 -4.008 2.326 15.540 1.00 0.00 O ATOM 954 CB ALA A 64 -7.352 2.275 15.553 1.00 0.00 C ATOM 0 H ALA A 64 -7.024 3.706 13.430 1.00 0.00 H new ATOM 0 HA ALA A 64 -5.924 3.770 16.156 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.049 1.559 16.317 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.208 2.847 15.910 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.627 1.740 14.644 1.00 0.00 H new ATOM 960 N PHE A 65 -5.023 1.881 13.597 1.00 0.00 N ATOM 961 CA PHE A 65 -3.926 1.075 13.121 1.00 0.00 C ATOM 962 C PHE A 65 -3.007 1.880 12.244 1.00 0.00 C ATOM 963 O PHE A 65 -2.072 1.342 11.652 1.00 0.00 O ATOM 964 CB PHE A 65 -4.430 -0.142 12.366 1.00 0.00 C ATOM 965 CG PHE A 65 -5.177 -1.134 13.212 1.00 0.00 C ATOM 966 CD1 PHE A 65 -6.542 -1.018 13.405 1.00 0.00 C ATOM 967 CD2 PHE A 65 -4.507 -2.188 13.812 1.00 0.00 C ATOM 968 CE1 PHE A 65 -7.225 -1.933 14.181 1.00 0.00 C ATOM 969 CE2 PHE A 65 -5.182 -3.108 14.587 1.00 0.00 C ATOM 970 CZ PHE A 65 -6.543 -2.981 14.772 1.00 0.00 C ATOM 0 H PHE A 65 -5.797 1.985 12.940 1.00 0.00 H new ATOM 0 HA PHE A 65 -3.367 0.735 13.993 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -5.082 0.191 11.558 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -3.581 -0.645 11.904 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -7.079 -0.203 12.944 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -3.441 -2.291 13.671 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -8.290 -1.831 14.326 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -4.647 -3.925 15.047 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.076 -3.699 15.378 1.00 0.00 H new ATOM 980 N GLY A 66 -3.227 3.176 12.243 1.00 0.00 N ATOM 981 CA GLY A 66 -2.512 4.092 11.382 1.00 0.00 C ATOM 982 C GLY A 66 -1.013 4.132 11.562 1.00 0.00 C ATOM 983 O GLY A 66 -0.304 4.454 10.613 1.00 0.00 O ATOM 0 H GLY A 66 -3.914 3.628 12.846 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -2.727 3.830 10.346 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -2.905 5.095 11.545 1.00 0.00 H new ATOM 987 N ALA A 67 -0.507 3.766 12.736 1.00 0.00 N ATOM 988 CA ALA A 67 0.938 3.781 12.969 1.00 0.00 C ATOM 989 C ALA A 67 1.625 2.726 12.107 1.00 0.00 C ATOM 990 O ALA A 67 2.819 2.830 11.798 1.00 0.00 O ATOM 991 CB ALA A 67 1.273 3.575 14.440 1.00 0.00 C ATOM 0 H ALA A 67 -1.065 3.459 13.533 1.00 0.00 H new ATOM 0 HA ALA A 67 1.311 4.765 12.685 1.00 0.00 H new ATOM 0 HB1 ALA A 67 2.355 3.592 14.573 1.00 0.00 H new ATOM 0 HB2 ALA A 67 0.822 4.372 15.031 1.00 0.00 H new ATOM 0 HB3 ALA A 67 0.882 2.613 14.771 1.00 0.00 H new ATOM 997 N HIS A 68 0.847 1.746 11.671 1.00 0.00 N ATOM 998 CA HIS A 68 1.345 0.682 10.832 1.00 0.00 C ATOM 999 C HIS A 68 1.667 1.181 9.425 1.00 0.00 C ATOM 1000 O HIS A 68 2.481 0.581 8.734 1.00 0.00 O ATOM 1001 CB HIS A 68 0.370 -0.512 10.787 1.00 0.00 C ATOM 1002 CG HIS A 68 0.247 -1.239 12.093 1.00 0.00 C ATOM 1003 ND1 HIS A 68 -0.829 -1.120 12.939 1.00 0.00 N ATOM 1004 CD2 HIS A 68 1.096 -2.107 12.689 1.00 0.00 C ATOM 1005 CE1 HIS A 68 -0.611 -1.896 14.003 1.00 0.00 C ATOM 1006 NE2 HIS A 68 0.551 -2.522 13.902 1.00 0.00 N ATOM 0 H HIS A 68 -0.146 1.672 11.892 1.00 0.00 H new ATOM 0 HA HIS A 68 2.275 0.331 11.280 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -0.615 -0.154 10.486 1.00 0.00 H new ATOM 0 HB3 HIS A 68 0.703 -1.213 10.021 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -1.652 -0.539 12.781 1.00 0.00 H new ATOM 0 HD2 HIS A 68 2.046 -2.428 12.288 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -1.292 -1.999 14.835 1.00 0.00 H new ATOM 1014 N ALA A 69 1.081 2.323 9.027 1.00 0.00 N ATOM 1015 CA ALA A 69 1.320 2.891 7.686 1.00 0.00 C ATOM 1016 C ALA A 69 2.766 3.211 7.528 1.00 0.00 C ATOM 1017 O ALA A 69 3.367 2.997 6.502 1.00 0.00 O ATOM 1018 CB ALA A 69 0.498 4.158 7.461 1.00 0.00 C ATOM 0 H ALA A 69 0.444 2.868 9.608 1.00 0.00 H new ATOM 0 HA ALA A 69 1.015 2.148 6.949 1.00 0.00 H new ATOM 0 HB1 ALA A 69 0.699 4.549 6.464 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -0.563 3.925 7.553 1.00 0.00 H new ATOM 0 HB3 ALA A 69 0.771 4.906 8.206 1.00 0.00 H new ATOM 1024 N GLY A 70 3.324 3.702 8.558 1.00 0.00 N ATOM 1025 CA GLY A 70 4.706 4.039 8.507 1.00 0.00 C ATOM 1026 C GLY A 70 5.556 3.203 9.377 1.00 0.00 C ATOM 1027 O GLY A 70 6.563 3.660 9.896 1.00 0.00 O ATOM 0 H GLY A 70 2.860 3.884 9.448 1.00 0.00 H new ATOM 0 HA2 GLY A 70 5.055 3.948 7.478 1.00 0.00 H new ATOM 0 HA3 GLY A 70 4.826 5.084 8.793 1.00 0.00 H new ATOM 1031 N ASN A 71 5.155 1.968 9.555 1.00 0.00 N ATOM 1032 CA ASN A 71 6.040 1.006 10.191 1.00 0.00 C ATOM 1033 C ASN A 71 6.920 0.479 9.067 1.00 0.00 C ATOM 1034 O ASN A 71 7.997 -0.069 9.279 1.00 0.00 O ATOM 1035 CB ASN A 71 5.248 -0.142 10.891 1.00 0.00 C ATOM 1036 CG ASN A 71 5.099 -1.436 10.079 1.00 0.00 C ATOM 1037 OD1 ASN A 71 5.902 -2.364 10.221 1.00 0.00 O ATOM 1038 ND2 ASN A 71 4.100 -1.509 9.237 1.00 0.00 N ATOM 0 H ASN A 71 4.243 1.605 9.278 1.00 0.00 H new ATOM 0 HA ASN A 71 6.628 1.465 10.986 1.00 0.00 H new ATOM 0 HB2 ASN A 71 5.744 -0.380 11.832 1.00 0.00 H new ATOM 0 HB3 ASN A 71 4.253 0.227 11.139 1.00 0.00 H new ATOM 0 HD21 ASN A 71 3.967 -2.350 8.675 1.00 0.00 H new ATOM 0 HD22 ASN A 71 3.454 -0.725 9.143 1.00 0.00 H new ATOM 1045 N LEU A 72 6.419 0.725 7.850 1.00 0.00 N ATOM 1046 CA LEU A 72 7.060 0.382 6.624 1.00 0.00 C ATOM 1047 C LEU A 72 7.701 1.610 5.979 1.00 0.00 C ATOM 1048 O LEU A 72 8.650 1.468 5.211 1.00 0.00 O ATOM 1049 CB LEU A 72 6.026 -0.298 5.673 1.00 0.00 C ATOM 1050 CG LEU A 72 4.725 0.460 5.280 1.00 0.00 C ATOM 1051 CD1 LEU A 72 4.979 1.560 4.277 1.00 0.00 C ATOM 1052 CD2 LEU A 72 3.691 -0.481 4.717 1.00 0.00 C ATOM 0 H LEU A 72 5.520 1.187 7.713 1.00 0.00 H new ATOM 0 HA LEU A 72 7.865 -0.325 6.823 1.00 0.00 H new ATOM 0 HB2 LEU A 72 6.548 -0.548 4.750 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.728 -1.239 6.136 1.00 0.00 H new ATOM 0 HG LEU A 72 4.352 0.909 6.200 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.039 2.057 4.037 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.675 2.284 4.700 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.406 1.133 3.370 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.794 0.080 4.452 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.089 -0.969 3.828 1.00 0.00 H new ATOM 0 HD23 LEU A 72 3.440 -1.235 5.463 1.00 0.00 H new ATOM 1064 N ASN A 73 7.177 2.838 6.295 1.00 0.00 N ATOM 1065 CA ASN A 73 7.703 4.063 5.621 1.00 0.00 C ATOM 1066 C ASN A 73 7.041 5.384 6.055 1.00 0.00 C ATOM 1067 O ASN A 73 7.715 6.291 6.520 1.00 0.00 O ATOM 1068 CB ASN A 73 7.433 3.943 4.152 1.00 0.00 C ATOM 1069 CG ASN A 73 8.461 4.613 3.282 1.00 0.00 C ATOM 1070 OD1 ASN A 73 8.364 5.788 2.956 1.00 0.00 O ATOM 1071 ND2 ASN A 73 9.432 3.848 2.870 1.00 0.00 N ATOM 0 H ASN A 73 6.433 2.999 6.974 1.00 0.00 H new ATOM 0 HA ASN A 73 8.758 4.109 5.892 1.00 0.00 H new ATOM 0 HB2 ASN A 73 7.382 2.887 3.888 1.00 0.00 H new ATOM 0 HB3 ASN A 73 6.455 4.373 3.937 1.00 0.00 H new ATOM 0 HD21 ASN A 73 10.150 4.224 2.251 1.00 0.00 H new ATOM 0 HD22 ASN A 73 9.474 2.873 3.167 1.00 0.00 H new ATOM 1078 N LEU A 74 5.710 5.481 5.855 1.00 0.00 N ATOM 1079 CA LEU A 74 4.957 6.760 5.989 1.00 0.00 C ATOM 1080 C LEU A 74 5.127 7.484 7.321 1.00 0.00 C ATOM 1081 O LEU A 74 5.447 6.895 8.346 1.00 0.00 O ATOM 1082 CB LEU A 74 3.449 6.636 5.636 1.00 0.00 C ATOM 1083 CG LEU A 74 3.082 6.228 4.193 1.00 0.00 C ATOM 1084 CD1 LEU A 74 3.880 7.008 3.164 1.00 0.00 C ATOM 1085 CD2 LEU A 74 3.215 4.747 4.000 1.00 0.00 C ATOM 0 H LEU A 74 5.125 4.686 5.598 1.00 0.00 H new ATOM 0 HA LEU A 74 5.436 7.387 5.237 1.00 0.00 H new ATOM 0 HB2 LEU A 74 3.004 5.907 6.314 1.00 0.00 H new ATOM 0 HB3 LEU A 74 2.976 7.596 5.844 1.00 0.00 H new ATOM 0 HG LEU A 74 2.035 6.486 4.036 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.591 6.690 2.162 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.679 8.073 3.279 1.00 0.00 H new ATOM 0 HD13 LEU A 74 4.944 6.822 3.311 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.950 4.488 2.975 1.00 0.00 H new ATOM 0 HD22 LEU A 74 4.244 4.445 4.196 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.548 4.229 4.689 1.00 0.00 H new ATOM 1097 N LYS A 75 4.847 8.765 7.290 1.00 0.00 N ATOM 1098 CA LYS A 75 5.042 9.643 8.425 1.00 0.00 C ATOM 1099 C LYS A 75 3.961 9.460 9.519 1.00 0.00 C ATOM 1100 O LYS A 75 4.154 9.828 10.675 1.00 0.00 O ATOM 1101 CB LYS A 75 5.139 11.084 7.921 1.00 0.00 C ATOM 1102 CG LYS A 75 5.259 12.111 9.000 1.00 0.00 C ATOM 1103 CD LYS A 75 6.510 11.917 9.814 1.00 0.00 C ATOM 1104 CE LYS A 75 6.617 12.922 10.933 1.00 0.00 C ATOM 1105 NZ LYS A 75 7.831 12.701 11.736 1.00 0.00 N ATOM 0 H LYS A 75 4.472 9.236 6.466 1.00 0.00 H new ATOM 0 HA LYS A 75 5.977 9.379 8.919 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.002 11.167 7.260 1.00 0.00 H new ATOM 0 HB3 LYS A 75 4.256 11.306 7.322 1.00 0.00 H new ATOM 0 HG2 LYS A 75 5.264 13.107 8.556 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.388 12.057 9.653 1.00 0.00 H new ATOM 0 HD2 LYS A 75 6.520 10.909 10.230 1.00 0.00 H new ATOM 0 HD3 LYS A 75 7.382 12.003 9.165 1.00 0.00 H new ATOM 0 HE2 LYS A 75 6.631 13.930 10.519 1.00 0.00 H new ATOM 0 HE3 LYS A 75 5.737 12.852 11.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 7.877 13.408 12.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 7.805 11.747 12.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 8.670 12.792 11.129 1.00 0.00 H new ATOM 1119 N THR A 76 2.867 8.846 9.136 1.00 0.00 N ATOM 1120 CA THR A 76 1.714 8.511 10.022 1.00 0.00 C ATOM 1121 C THR A 76 1.140 9.726 10.761 1.00 0.00 C ATOM 1122 O THR A 76 0.742 9.633 11.914 1.00 0.00 O ATOM 1123 CB THR A 76 2.073 7.374 11.037 1.00 0.00 C ATOM 1124 OG1 THR A 76 3.234 7.692 11.833 1.00 0.00 O ATOM 1125 CG2 THR A 76 2.333 6.105 10.301 1.00 0.00 C ATOM 0 H THR A 76 2.724 8.544 8.172 1.00 0.00 H new ATOM 0 HA THR A 76 0.932 8.149 9.354 1.00 0.00 H new ATOM 0 HB THR A 76 1.221 7.266 11.708 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.439 8.646 11.746 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.582 5.317 11.011 1.00 0.00 H new ATOM 0 HG22 THR A 76 1.442 5.820 9.741 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.165 6.248 9.611 1.00 0.00 H new ATOM 1133 N ASP A 77 1.054 10.825 10.076 1.00 0.00 N ATOM 1134 CA ASP A 77 0.625 12.074 10.677 1.00 0.00 C ATOM 1135 C ASP A 77 -0.548 12.672 9.923 1.00 0.00 C ATOM 1136 O ASP A 77 -1.334 13.445 10.475 1.00 0.00 O ATOM 1137 CB ASP A 77 1.790 13.065 10.607 1.00 0.00 C ATOM 1138 CG ASP A 77 2.214 13.360 9.169 1.00 0.00 C ATOM 1139 OD1 ASP A 77 2.253 12.395 8.326 1.00 0.00 O ATOM 1140 OD2 ASP A 77 2.533 14.527 8.851 1.00 0.00 O ATOM 0 H ASP A 77 1.277 10.893 9.083 1.00 0.00 H new ATOM 0 HA ASP A 77 0.320 11.880 11.705 1.00 0.00 H new ATOM 0 HB2 ASP A 77 1.503 13.995 11.097 1.00 0.00 H new ATOM 0 HB3 ASP A 77 2.640 12.663 11.159 1.00 0.00 H new ATOM 1145 N LYS A 78 -0.672 12.296 8.692 1.00 0.00 N ATOM 1146 CA LYS A 78 -1.584 12.896 7.782 1.00 0.00 C ATOM 1147 C LYS A 78 -2.770 12.009 7.444 1.00 0.00 C ATOM 1148 O LYS A 78 -2.940 10.928 8.013 1.00 0.00 O ATOM 1149 CB LYS A 78 -0.785 13.277 6.546 1.00 0.00 C ATOM 1150 CG LYS A 78 -0.137 14.658 6.628 1.00 0.00 C ATOM 1151 CD LYS A 78 0.926 14.885 5.550 1.00 0.00 C ATOM 1152 CE LYS A 78 2.118 13.962 5.764 1.00 0.00 C ATOM 1153 NZ LYS A 78 3.263 14.259 4.900 1.00 0.00 N ATOM 0 H LYS A 78 -0.124 11.540 8.282 1.00 0.00 H new ATOM 0 HA LYS A 78 -2.034 13.776 8.242 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -0.007 12.531 6.384 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -1.442 13.246 5.677 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -0.909 15.422 6.535 1.00 0.00 H new ATOM 0 HG3 LYS A 78 0.318 14.782 7.611 1.00 0.00 H new ATOM 0 HD2 LYS A 78 0.495 14.707 4.565 1.00 0.00 H new ATOM 0 HD3 LYS A 78 1.256 15.924 5.571 1.00 0.00 H new ATOM 0 HE2 LYS A 78 2.434 14.029 6.805 1.00 0.00 H new ATOM 0 HE3 LYS A 78 1.803 12.933 5.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 3.933 13.464 4.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 2.934 14.402 3.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 3.736 15.122 5.235 1.00 0.00 H new ATOM 1167 N PHE A 79 -3.575 12.505 6.512 1.00 0.00 N ATOM 1168 CA PHE A 79 -4.796 11.872 6.010 1.00 0.00 C ATOM 1169 C PHE A 79 -4.432 10.591 5.174 1.00 0.00 C ATOM 1170 O PHE A 79 -3.253 10.232 5.181 1.00 0.00 O ATOM 1171 CB PHE A 79 -5.567 12.943 5.224 1.00 0.00 C ATOM 1172 CG PHE A 79 -5.988 14.118 6.074 1.00 0.00 C ATOM 1173 CD1 PHE A 79 -5.160 15.217 6.251 1.00 0.00 C ATOM 1174 CD2 PHE A 79 -7.214 14.109 6.702 1.00 0.00 C ATOM 1175 CE1 PHE A 79 -5.556 16.276 7.038 1.00 0.00 C ATOM 1176 CE2 PHE A 79 -7.617 15.164 7.490 1.00 0.00 C ATOM 1177 CZ PHE A 79 -6.786 16.248 7.657 1.00 0.00 C ATOM 0 H PHE A 79 -3.388 13.401 6.062 1.00 0.00 H new ATOM 0 HA PHE A 79 -5.441 11.512 6.812 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.945 13.301 4.404 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -6.452 12.490 4.778 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -4.195 15.243 5.767 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -7.870 13.261 6.574 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -4.903 17.126 7.169 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -8.582 15.141 7.975 1.00 0.00 H new ATOM 0 HZ PHE A 79 -7.099 17.077 8.274 1.00 0.00 H new ATOM 1187 N PRO A 80 -5.408 9.859 4.430 1.00 0.00 N ATOM 1188 CA PRO A 80 -5.095 8.565 3.831 1.00 0.00 C ATOM 1189 C PRO A 80 -3.755 8.455 3.119 1.00 0.00 C ATOM 1190 O PRO A 80 -3.380 9.293 2.285 1.00 0.00 O ATOM 1191 CB PRO A 80 -6.268 8.214 2.917 1.00 0.00 C ATOM 1192 CG PRO A 80 -7.176 9.360 2.928 1.00 0.00 C ATOM 1193 CD PRO A 80 -6.827 10.228 4.101 1.00 0.00 C ATOM 0 HA PRO A 80 -4.970 7.845 4.639 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -5.920 8.007 1.905 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -6.776 7.316 3.269 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -7.087 9.924 1.999 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -8.210 9.024 2.999 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -6.915 11.286 3.853 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -7.492 10.042 4.945 1.00 0.00 H new ATOM 1201 N ALA A 81 -3.074 7.406 3.473 1.00 0.00 N ATOM 1202 CA ALA A 81 -1.761 7.106 3.043 1.00 0.00 C ATOM 1203 C ALA A 81 -1.766 5.695 2.471 1.00 0.00 C ATOM 1204 O ALA A 81 -2.056 4.720 3.175 1.00 0.00 O ATOM 1205 CB ALA A 81 -0.814 7.223 4.235 1.00 0.00 C ATOM 0 H ALA A 81 -3.452 6.702 4.107 1.00 0.00 H new ATOM 0 HA ALA A 81 -1.422 7.799 2.273 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.203 6.994 3.916 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -0.850 8.238 4.630 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -1.118 6.521 5.011 1.00 0.00 H new ATOM 1211 N PHE A 82 -1.491 5.595 1.213 1.00 0.00 N ATOM 1212 CA PHE A 82 -1.566 4.340 0.497 1.00 0.00 C ATOM 1213 C PHE A 82 -0.196 3.661 0.437 1.00 0.00 C ATOM 1214 O PHE A 82 0.694 4.129 -0.235 1.00 0.00 O ATOM 1215 CB PHE A 82 -2.126 4.635 -0.895 1.00 0.00 C ATOM 1216 CG PHE A 82 -2.221 3.480 -1.829 1.00 0.00 C ATOM 1217 CD1 PHE A 82 -3.108 2.464 -1.592 1.00 0.00 C ATOM 1218 CD2 PHE A 82 -1.458 3.447 -2.980 1.00 0.00 C ATOM 1219 CE1 PHE A 82 -3.241 1.429 -2.477 1.00 0.00 C ATOM 1220 CE2 PHE A 82 -1.574 2.411 -3.868 1.00 0.00 C ATOM 1221 CZ PHE A 82 -2.469 1.397 -3.620 1.00 0.00 C ATOM 0 H PHE A 82 -1.203 6.385 0.636 1.00 0.00 H new ATOM 0 HA PHE A 82 -2.225 3.641 1.012 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -3.122 5.063 -0.779 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -1.503 5.399 -1.359 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -3.710 2.480 -0.695 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -0.762 4.248 -3.182 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -3.950 0.638 -2.281 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -0.965 2.390 -4.760 1.00 0.00 H new ATOM 0 HZ PHE A 82 -2.567 0.578 -4.318 1.00 0.00 H new ATOM 1231 N ALA A 83 -0.035 2.574 1.147 1.00 0.00 N ATOM 1232 CA ALA A 83 1.239 1.900 1.209 1.00 0.00 C ATOM 1233 C ALA A 83 1.213 0.543 0.525 1.00 0.00 C ATOM 1234 O ALA A 83 0.492 -0.340 0.946 1.00 0.00 O ATOM 1235 CB ALA A 83 1.647 1.735 2.646 1.00 0.00 C ATOM 0 H ALA A 83 -0.775 2.133 1.694 1.00 0.00 H new ATOM 0 HA ALA A 83 1.963 2.516 0.676 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.610 1.226 2.695 1.00 0.00 H new ATOM 0 HB2 ALA A 83 1.731 2.715 3.115 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.897 1.144 3.172 1.00 0.00 H new ATOM 1241 N ILE A 84 1.990 0.369 -0.518 1.00 0.00 N ATOM 1242 CA ILE A 84 2.056 -0.922 -1.169 1.00 0.00 C ATOM 1243 C ILE A 84 3.170 -1.740 -0.563 1.00 0.00 C ATOM 1244 O ILE A 84 4.345 -1.493 -0.803 1.00 0.00 O ATOM 1245 CB ILE A 84 2.269 -0.828 -2.696 1.00 0.00 C ATOM 1246 CG1 ILE A 84 1.215 0.078 -3.335 1.00 0.00 C ATOM 1247 CG2 ILE A 84 2.210 -2.228 -3.315 1.00 0.00 C ATOM 1248 CD1 ILE A 84 1.431 0.317 -4.811 1.00 0.00 C ATOM 0 H ILE A 84 2.578 1.093 -0.931 1.00 0.00 H new ATOM 0 HA ILE A 84 1.090 -1.400 -1.009 1.00 0.00 H new ATOM 0 HB ILE A 84 3.251 -0.394 -2.885 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.230 -0.366 -3.189 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.212 1.037 -2.818 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.361 -2.156 -4.392 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.991 -2.851 -2.880 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.236 -2.674 -3.114 1.00 0.00 H new ATOM 0 HD11 ILE A 84 0.645 0.968 -5.193 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.401 0.790 -4.965 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.404 -0.635 -5.342 1.00 0.00 H new ATOM 1260 N GLN A 85 2.816 -2.688 0.224 1.00 0.00 N ATOM 1261 CA GLN A 85 3.774 -3.531 0.818 1.00 0.00 C ATOM 1262 C GLN A 85 3.992 -4.699 -0.101 1.00 0.00 C ATOM 1263 O GLN A 85 3.048 -5.371 -0.485 1.00 0.00 O ATOM 1264 CB GLN A 85 3.307 -4.026 2.164 1.00 0.00 C ATOM 1265 CG GLN A 85 4.329 -4.910 2.809 1.00 0.00 C ATOM 1266 CD GLN A 85 3.887 -5.543 4.085 1.00 0.00 C ATOM 1267 OE1 GLN A 85 3.077 -5.006 4.840 1.00 0.00 O ATOM 1268 NE2 GLN A 85 4.429 -6.679 4.334 1.00 0.00 N ATOM 0 H GLN A 85 1.849 -2.898 0.472 1.00 0.00 H new ATOM 0 HA GLN A 85 4.699 -2.976 0.973 1.00 0.00 H new ATOM 0 HB2 GLN A 85 3.098 -3.176 2.813 1.00 0.00 H new ATOM 0 HB3 GLN A 85 2.372 -4.574 2.047 1.00 0.00 H new ATOM 0 HG2 GLN A 85 4.606 -5.696 2.106 1.00 0.00 H new ATOM 0 HG3 GLN A 85 5.227 -4.324 3.002 1.00 0.00 H new ATOM 0 HE21 GLN A 85 5.095 -7.082 3.675 1.00 0.00 H new ATOM 0 HE22 GLN A 85 4.194 -7.180 5.191 1.00 0.00 H new ATOM 1277 N GLU A 86 5.198 -4.946 -0.450 1.00 0.00 N ATOM 1278 CA GLU A 86 5.466 -6.049 -1.356 1.00 0.00 C ATOM 1279 C GLU A 86 5.654 -7.325 -0.621 1.00 0.00 C ATOM 1280 O GLU A 86 6.494 -7.415 0.254 1.00 0.00 O ATOM 1281 CB GLU A 86 6.666 -5.794 -2.237 1.00 0.00 C ATOM 1282 CG GLU A 86 6.335 -5.347 -3.631 1.00 0.00 C ATOM 1283 CD GLU A 86 5.865 -6.518 -4.440 1.00 0.00 C ATOM 1284 OE1 GLU A 86 5.911 -7.652 -3.905 1.00 0.00 O ATOM 1285 OE2 GLU A 86 5.515 -6.343 -5.613 1.00 0.00 O ATOM 0 H GLU A 86 6.017 -4.423 -0.141 1.00 0.00 H new ATOM 0 HA GLU A 86 4.587 -6.131 -1.995 1.00 0.00 H new ATOM 0 HB2 GLU A 86 7.292 -5.036 -1.766 1.00 0.00 H new ATOM 0 HB3 GLU A 86 7.259 -6.707 -2.294 1.00 0.00 H new ATOM 0 HG2 GLU A 86 5.562 -4.579 -3.603 1.00 0.00 H new ATOM 0 HG3 GLU A 86 7.213 -4.899 -4.098 1.00 0.00 H new ATOM 1292 N VAL A 87 4.900 -8.310 -0.988 1.00 0.00 N ATOM 1293 CA VAL A 87 5.028 -9.610 -0.383 1.00 0.00 C ATOM 1294 C VAL A 87 5.890 -10.481 -1.304 1.00 0.00 C ATOM 1295 O VAL A 87 6.187 -11.651 -1.018 1.00 0.00 O ATOM 1296 CB VAL A 87 3.625 -10.264 -0.120 1.00 0.00 C ATOM 1297 CG1 VAL A 87 3.740 -11.509 0.743 1.00 0.00 C ATOM 1298 CG2 VAL A 87 2.690 -9.252 0.527 1.00 0.00 C ATOM 0 H VAL A 87 4.181 -8.245 -1.709 1.00 0.00 H new ATOM 0 HA VAL A 87 5.508 -9.517 0.591 1.00 0.00 H new ATOM 0 HB VAL A 87 3.212 -10.569 -1.081 1.00 0.00 H new ATOM 0 HG11 VAL A 87 2.749 -11.933 0.903 1.00 0.00 H new ATOM 0 HG12 VAL A 87 4.372 -12.242 0.242 1.00 0.00 H new ATOM 0 HG13 VAL A 87 4.182 -11.246 1.704 1.00 0.00 H new ATOM 0 HG21 VAL A 87 1.720 -9.715 0.705 1.00 0.00 H new ATOM 0 HG22 VAL A 87 3.113 -8.920 1.475 1.00 0.00 H new ATOM 0 HG23 VAL A 87 2.567 -8.395 -0.135 1.00 0.00 H new ATOM 1308 N ALA A 88 6.341 -9.884 -2.400 1.00 0.00 N ATOM 1309 CA ALA A 88 7.149 -10.612 -3.354 1.00 0.00 C ATOM 1310 C ALA A 88 8.503 -9.966 -3.488 1.00 0.00 C ATOM 1311 O ALA A 88 9.509 -10.639 -3.711 1.00 0.00 O ATOM 1312 CB ALA A 88 6.456 -10.713 -4.705 1.00 0.00 C ATOM 0 H ALA A 88 6.161 -8.910 -2.643 1.00 0.00 H new ATOM 0 HA ALA A 88 7.284 -11.628 -2.982 1.00 0.00 H new ATOM 0 HB1 ALA A 88 7.090 -11.266 -5.399 1.00 0.00 H new ATOM 0 HB2 ALA A 88 5.505 -11.234 -4.588 1.00 0.00 H new ATOM 0 HB3 ALA A 88 6.276 -9.712 -5.097 1.00 0.00 H new ATOM 1318 N LYS A 89 8.534 -8.658 -3.393 1.00 0.00 N ATOM 1319 CA LYS A 89 9.799 -7.947 -3.436 1.00 0.00 C ATOM 1320 C LYS A 89 10.256 -7.690 -1.984 1.00 0.00 C ATOM 1321 O LYS A 89 11.438 -7.486 -1.717 1.00 0.00 O ATOM 1322 CB LYS A 89 9.630 -6.630 -4.235 1.00 0.00 C ATOM 1323 CG LYS A 89 10.866 -6.154 -5.021 1.00 0.00 C ATOM 1324 CD LYS A 89 12.029 -5.746 -4.135 1.00 0.00 C ATOM 1325 CE LYS A 89 13.264 -5.385 -4.951 1.00 0.00 C ATOM 1326 NZ LYS A 89 13.794 -6.539 -5.704 1.00 0.00 N ATOM 0 H LYS A 89 7.710 -8.066 -3.286 1.00 0.00 H new ATOM 0 HA LYS A 89 10.563 -8.535 -3.944 1.00 0.00 H new ATOM 0 HB2 LYS A 89 8.805 -6.757 -4.936 1.00 0.00 H new ATOM 0 HB3 LYS A 89 9.340 -5.842 -3.541 1.00 0.00 H new ATOM 0 HG2 LYS A 89 11.191 -6.952 -5.689 1.00 0.00 H new ATOM 0 HG3 LYS A 89 10.584 -5.308 -5.648 1.00 0.00 H new ATOM 0 HD2 LYS A 89 11.737 -4.894 -3.522 1.00 0.00 H new ATOM 0 HD3 LYS A 89 12.270 -6.562 -3.453 1.00 0.00 H new ATOM 0 HE2 LYS A 89 13.016 -4.583 -5.646 1.00 0.00 H new ATOM 0 HE3 LYS A 89 14.037 -5.002 -4.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 14.750 -6.319 -6.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 13.833 -7.371 -5.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 13.172 -6.741 -6.513 1.00 0.00 H new ATOM 1340 N ASN A 90 9.278 -7.755 -1.046 1.00 0.00 N ATOM 1341 CA ASN A 90 9.495 -7.570 0.382 1.00 0.00 C ATOM 1342 C ASN A 90 9.887 -6.143 0.672 1.00 0.00 C ATOM 1343 O ASN A 90 10.578 -5.826 1.632 1.00 0.00 O ATOM 1344 CB ASN A 90 10.493 -8.574 0.909 1.00 0.00 C ATOM 1345 CG ASN A 90 10.020 -9.995 0.740 1.00 0.00 C ATOM 1346 OD1 ASN A 90 10.249 -10.619 -0.291 1.00 0.00 O ATOM 1347 ND2 ASN A 90 9.385 -10.527 1.734 1.00 0.00 N ATOM 0 H ASN A 90 8.303 -7.942 -1.282 1.00 0.00 H new ATOM 0 HA ASN A 90 8.562 -7.757 0.913 1.00 0.00 H new ATOM 0 HB2 ASN A 90 11.443 -8.446 0.390 1.00 0.00 H new ATOM 0 HB3 ASN A 90 10.678 -8.378 1.965 1.00 0.00 H new ATOM 0 HD21 ASN A 90 9.059 -11.492 1.674 1.00 0.00 H new ATOM 0 HD22 ASN A 90 9.210 -9.982 2.578 1.00 0.00 H new ATOM 1354 N GLN A 91 9.272 -5.293 -0.079 1.00 0.00 N ATOM 1355 CA GLN A 91 9.574 -3.883 -0.115 1.00 0.00 C ATOM 1356 C GLN A 91 8.349 -3.154 0.251 1.00 0.00 C ATOM 1357 O GLN A 91 7.328 -3.761 0.514 1.00 0.00 O ATOM 1358 CB GLN A 91 9.939 -3.454 -1.516 1.00 0.00 C ATOM 1359 CG GLN A 91 11.057 -2.428 -1.582 1.00 0.00 C ATOM 1360 CD GLN A 91 12.423 -3.024 -1.297 1.00 0.00 C ATOM 1361 OE1 GLN A 91 13.108 -3.445 -2.212 1.00 0.00 O ATOM 1362 NE2 GLN A 91 12.824 -3.062 -0.052 1.00 0.00 N ATOM 0 H GLN A 91 8.517 -5.560 -0.711 1.00 0.00 H new ATOM 0 HA GLN A 91 10.403 -3.678 0.563 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.234 -4.334 -2.088 1.00 0.00 H new ATOM 0 HB3 GLN A 91 9.054 -3.042 -2.000 1.00 0.00 H new ATOM 0 HG2 GLN A 91 11.065 -1.970 -2.571 1.00 0.00 H new ATOM 0 HG3 GLN A 91 10.856 -1.633 -0.864 1.00 0.00 H new ATOM 0 HE21 GLN A 91 12.223 -2.700 0.689 1.00 0.00 H new ATOM 0 HE22 GLN A 91 13.737 -3.454 0.178 1.00 0.00 H new ATOM 1371 N LYS A 92 8.430 -1.861 0.266 1.00 0.00 N ATOM 1372 CA LYS A 92 7.319 -1.049 0.609 1.00 0.00 C ATOM 1373 C LYS A 92 7.303 0.128 -0.367 1.00 0.00 C ATOM 1374 O LYS A 92 8.198 0.984 -0.315 1.00 0.00 O ATOM 1375 CB LYS A 92 7.497 -0.518 2.039 1.00 0.00 C ATOM 1376 CG LYS A 92 8.134 -1.509 3.039 1.00 0.00 C ATOM 1377 CD LYS A 92 7.311 -2.737 3.399 1.00 0.00 C ATOM 1378 CE LYS A 92 8.126 -3.607 4.357 1.00 0.00 C ATOM 1379 NZ LYS A 92 7.434 -4.839 4.768 1.00 0.00 N ATOM 0 H LYS A 92 9.277 -1.341 0.038 1.00 0.00 H new ATOM 0 HA LYS A 92 6.390 -1.617 0.556 1.00 0.00 H new ATOM 0 HB2 LYS A 92 8.113 0.380 2.001 1.00 0.00 H new ATOM 0 HB3 LYS A 92 6.521 -0.219 2.422 1.00 0.00 H new ATOM 0 HG2 LYS A 92 9.085 -1.845 2.626 1.00 0.00 H new ATOM 0 HG3 LYS A 92 8.359 -0.968 3.958 1.00 0.00 H new ATOM 0 HD2 LYS A 92 6.371 -2.439 3.865 1.00 0.00 H new ATOM 0 HD3 LYS A 92 7.057 -3.299 2.500 1.00 0.00 H new ATOM 0 HE2 LYS A 92 9.070 -3.872 3.880 1.00 0.00 H new ATOM 0 HE3 LYS A 92 8.370 -3.024 5.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 8.043 -5.379 5.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 6.546 -4.594 5.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 7.224 -5.416 3.928 1.00 0.00 H new ATOM 1393 N PHE A 93 6.380 0.105 -1.298 1.00 0.00 N ATOM 1394 CA PHE A 93 6.174 1.205 -2.267 1.00 0.00 C ATOM 1395 C PHE A 93 4.950 2.037 -1.836 1.00 0.00 C ATOM 1396 O PHE A 93 3.834 1.738 -2.216 1.00 0.00 O ATOM 1397 CB PHE A 93 5.969 0.643 -3.712 1.00 0.00 C ATOM 1398 CG PHE A 93 7.136 -0.165 -4.206 1.00 0.00 C ATOM 1399 CD1 PHE A 93 7.249 -1.513 -3.894 1.00 0.00 C ATOM 1400 CD2 PHE A 93 8.109 0.416 -4.985 1.00 0.00 C ATOM 1401 CE1 PHE A 93 8.311 -2.258 -4.353 1.00 0.00 C ATOM 1402 CE2 PHE A 93 9.174 -0.322 -5.445 1.00 0.00 C ATOM 1403 CZ PHE A 93 9.278 -1.662 -5.132 1.00 0.00 C ATOM 0 H PHE A 93 5.735 -0.675 -1.423 1.00 0.00 H new ATOM 0 HA PHE A 93 7.060 1.839 -2.279 1.00 0.00 H new ATOM 0 HB2 PHE A 93 5.073 0.023 -3.729 1.00 0.00 H new ATOM 0 HB3 PHE A 93 5.795 1.473 -4.396 1.00 0.00 H new ATOM 0 HD1 PHE A 93 6.493 -1.983 -3.283 1.00 0.00 H new ATOM 0 HD2 PHE A 93 8.036 1.463 -5.238 1.00 0.00 H new ATOM 0 HE1 PHE A 93 8.386 -3.306 -4.103 1.00 0.00 H new ATOM 0 HE2 PHE A 93 9.932 0.149 -6.054 1.00 0.00 H new ATOM 0 HZ PHE A 93 10.114 -2.241 -5.496 1.00 0.00 H new ATOM 1413 N PRO A 94 5.130 3.040 -0.974 1.00 0.00 N ATOM 1414 CA PRO A 94 4.039 3.820 -0.455 1.00 0.00 C ATOM 1415 C PRO A 94 3.872 5.214 -1.111 1.00 0.00 C ATOM 1416 O PRO A 94 4.846 5.914 -1.445 1.00 0.00 O ATOM 1417 CB PRO A 94 4.446 3.908 0.992 1.00 0.00 C ATOM 1418 CG PRO A 94 5.935 4.115 0.933 1.00 0.00 C ATOM 1419 CD PRO A 94 6.398 3.492 -0.377 1.00 0.00 C ATOM 0 HA PRO A 94 3.060 3.378 -0.643 1.00 0.00 H new ATOM 0 HB2 PRO A 94 3.947 4.734 1.499 1.00 0.00 H new ATOM 0 HB3 PRO A 94 4.190 2.999 1.536 1.00 0.00 H new ATOM 0 HG2 PRO A 94 6.182 5.176 0.969 1.00 0.00 H new ATOM 0 HG3 PRO A 94 6.428 3.644 1.784 1.00 0.00 H new ATOM 0 HD2 PRO A 94 6.912 4.214 -1.012 1.00 0.00 H new ATOM 0 HD3 PRO A 94 7.088 2.664 -0.212 1.00 0.00 H new ATOM 1427 N PHE A 95 2.629 5.579 -1.281 1.00 0.00 N ATOM 1428 CA PHE A 95 2.206 6.800 -1.913 1.00 0.00 C ATOM 1429 C PHE A 95 2.209 7.931 -0.883 1.00 0.00 C ATOM 1430 O PHE A 95 2.351 7.694 0.323 1.00 0.00 O ATOM 1431 CB PHE A 95 0.785 6.575 -2.521 1.00 0.00 C ATOM 1432 CG PHE A 95 0.166 7.731 -3.295 1.00 0.00 C ATOM 1433 CD1 PHE A 95 0.549 8.005 -4.593 1.00 0.00 C ATOM 1434 CD2 PHE A 95 -0.810 8.527 -2.716 1.00 0.00 C ATOM 1435 CE1 PHE A 95 -0.020 9.047 -5.295 1.00 0.00 C ATOM 1436 CE2 PHE A 95 -1.379 9.572 -3.411 1.00 0.00 C ATOM 1437 CZ PHE A 95 -0.982 9.832 -4.699 1.00 0.00 C ATOM 0 H PHE A 95 1.846 5.005 -0.967 1.00 0.00 H new ATOM 0 HA PHE A 95 2.887 7.081 -2.716 1.00 0.00 H new ATOM 0 HB2 PHE A 95 0.835 5.712 -3.186 1.00 0.00 H new ATOM 0 HB3 PHE A 95 0.108 6.312 -1.708 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.305 7.395 -5.065 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -1.129 8.325 -1.704 1.00 0.00 H new ATOM 0 HE1 PHE A 95 0.288 9.247 -6.311 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -2.135 10.185 -2.943 1.00 0.00 H new ATOM 0 HZ PHE A 95 -1.424 10.652 -5.245 1.00 0.00 H new ATOM 1447 N ASP A 96 2.032 9.126 -1.370 1.00 0.00 N ATOM 1448 CA ASP A 96 2.052 10.333 -0.580 1.00 0.00 C ATOM 1449 C ASP A 96 0.814 10.426 0.258 1.00 0.00 C ATOM 1450 O ASP A 96 -0.218 9.845 -0.058 1.00 0.00 O ATOM 1451 CB ASP A 96 2.160 11.543 -1.503 1.00 0.00 C ATOM 1452 CG ASP A 96 3.400 11.458 -2.362 1.00 0.00 C ATOM 1453 OD1 ASP A 96 3.338 10.884 -3.469 1.00 0.00 O ATOM 1454 OD2 ASP A 96 4.464 11.954 -1.948 1.00 0.00 O ATOM 0 H ASP A 96 1.864 9.297 -2.361 1.00 0.00 H new ATOM 0 HA ASP A 96 2.915 10.312 0.085 1.00 0.00 H new ATOM 0 HB2 ASP A 96 1.276 11.601 -2.138 1.00 0.00 H new ATOM 0 HB3 ASP A 96 2.186 12.457 -0.909 1.00 0.00 H new ATOM 1459 N GLN A 97 0.891 11.202 1.274 1.00 0.00 N ATOM 1460 CA GLN A 97 -0.172 11.300 2.236 1.00 0.00 C ATOM 1461 C GLN A 97 -0.977 12.554 1.953 1.00 0.00 C ATOM 1462 O GLN A 97 -2.070 12.765 2.496 1.00 0.00 O ATOM 1463 CB GLN A 97 0.442 11.396 3.630 1.00 0.00 C ATOM 1464 CG GLN A 97 1.370 10.242 4.007 1.00 0.00 C ATOM 1465 CD GLN A 97 2.207 10.582 5.218 1.00 0.00 C ATOM 1466 OE1 GLN A 97 3.302 11.095 5.094 1.00 0.00 O ATOM 1467 NE2 GLN A 97 1.708 10.304 6.391 1.00 0.00 N ATOM 0 H GLN A 97 1.695 11.797 1.474 1.00 0.00 H new ATOM 0 HA GLN A 97 -0.822 10.427 2.175 1.00 0.00 H new ATOM 0 HB2 GLN A 97 1.000 12.330 3.701 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -0.363 11.449 4.363 1.00 0.00 H new ATOM 0 HG2 GLN A 97 0.779 9.349 4.210 1.00 0.00 H new ATOM 0 HG3 GLN A 97 2.022 10.008 3.166 1.00 0.00 H new ATOM 0 HE21 GLN A 97 0.786 9.873 6.464 1.00 0.00 H new ATOM 0 HE22 GLN A 97 2.240 10.517 7.235 1.00 0.00 H new ATOM 1476 N GLU A 98 -0.435 13.394 1.095 1.00 0.00 N ATOM 1477 CA GLU A 98 -1.014 14.669 0.832 1.00 0.00 C ATOM 1478 C GLU A 98 -1.318 14.868 -0.623 1.00 0.00 C ATOM 1479 O GLU A 98 -1.848 15.901 -1.016 1.00 0.00 O ATOM 1480 CB GLU A 98 -0.056 15.731 1.274 1.00 0.00 C ATOM 1481 CG GLU A 98 1.323 15.568 0.698 1.00 0.00 C ATOM 1482 CD GLU A 98 2.227 14.653 1.481 1.00 0.00 C ATOM 1483 OE1 GLU A 98 2.820 15.105 2.471 1.00 0.00 O ATOM 1484 OE2 GLU A 98 2.369 13.474 1.112 1.00 0.00 O ATOM 0 H GLU A 98 0.417 13.201 0.568 1.00 0.00 H new ATOM 0 HA GLU A 98 -1.955 14.728 1.379 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -0.449 16.706 0.987 1.00 0.00 H new ATOM 0 HB3 GLU A 98 0.009 15.721 2.362 1.00 0.00 H new ATOM 0 HG2 GLU A 98 1.235 15.186 -0.319 1.00 0.00 H new ATOM 0 HG3 GLU A 98 1.792 16.550 0.630 1.00 0.00 H new ATOM 1491 N LYS A 99 -1.015 13.878 -1.415 1.00 0.00 N ATOM 1492 CA LYS A 99 -1.113 14.025 -2.841 1.00 0.00 C ATOM 1493 C LYS A 99 -2.512 13.692 -3.352 1.00 0.00 C ATOM 1494 O LYS A 99 -2.802 13.842 -4.545 1.00 0.00 O ATOM 1495 CB LYS A 99 -0.054 13.164 -3.486 1.00 0.00 C ATOM 1496 CG LYS A 99 0.159 13.455 -4.935 1.00 0.00 C ATOM 1497 CD LYS A 99 1.364 12.756 -5.503 1.00 0.00 C ATOM 1498 CE LYS A 99 2.635 13.444 -5.048 1.00 0.00 C ATOM 1499 NZ LYS A 99 3.831 12.689 -5.438 1.00 0.00 N ATOM 0 H LYS A 99 -0.698 12.961 -1.099 1.00 0.00 H new ATOM 0 HA LYS A 99 -0.941 15.067 -3.110 1.00 0.00 H new ATOM 0 HB2 LYS A 99 0.888 13.303 -2.955 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -0.332 12.116 -3.372 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -0.727 13.154 -5.495 1.00 0.00 H new ATOM 0 HG3 LYS A 99 0.272 14.531 -5.071 1.00 0.00 H new ATOM 0 HD2 LYS A 99 1.372 11.714 -5.184 1.00 0.00 H new ATOM 0 HD3 LYS A 99 1.313 12.755 -6.592 1.00 0.00 H new ATOM 0 HE2 LYS A 99 2.681 14.445 -5.477 1.00 0.00 H new ATOM 0 HE3 LYS A 99 2.617 13.562 -3.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 4.676 13.278 -5.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 3.905 11.831 -4.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 3.761 12.422 -6.441 1.00 0.00 H new ATOM 1513 N GLU A 100 -3.364 13.268 -2.427 1.00 0.00 N ATOM 1514 CA GLU A 100 -4.758 12.910 -2.696 1.00 0.00 C ATOM 1515 C GLU A 100 -4.866 11.583 -3.443 1.00 0.00 C ATOM 1516 O GLU A 100 -4.148 11.320 -4.410 1.00 0.00 O ATOM 1517 CB GLU A 100 -5.510 14.031 -3.442 1.00 0.00 C ATOM 1518 CG GLU A 100 -6.907 13.664 -3.890 1.00 0.00 C ATOM 1519 CD GLU A 100 -7.484 14.697 -4.801 1.00 0.00 C ATOM 1520 OE1 GLU A 100 -6.894 14.951 -5.865 1.00 0.00 O ATOM 1521 OE2 GLU A 100 -8.540 15.272 -4.478 1.00 0.00 O ATOM 0 H GLU A 100 -3.103 13.160 -1.447 1.00 0.00 H new ATOM 0 HA GLU A 100 -5.241 12.785 -1.727 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -5.569 14.905 -2.793 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -4.927 14.322 -4.316 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -6.884 12.701 -4.400 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -7.550 13.548 -3.018 1.00 0.00 H new ATOM 1528 N ILE A 101 -5.749 10.756 -2.987 1.00 0.00 N ATOM 1529 CA ILE A 101 -5.972 9.491 -3.598 1.00 0.00 C ATOM 1530 C ILE A 101 -7.047 9.618 -4.676 1.00 0.00 C ATOM 1531 O ILE A 101 -8.253 9.736 -4.394 1.00 0.00 O ATOM 1532 CB ILE A 101 -6.340 8.362 -2.568 1.00 0.00 C ATOM 1533 CG1 ILE A 101 -5.158 7.990 -1.630 1.00 0.00 C ATOM 1534 CG2 ILE A 101 -6.869 7.122 -3.265 1.00 0.00 C ATOM 1535 CD1 ILE A 101 -4.796 9.024 -0.580 1.00 0.00 C ATOM 0 H ILE A 101 -6.338 10.942 -2.175 1.00 0.00 H new ATOM 0 HA ILE A 101 -5.031 9.185 -4.055 1.00 0.00 H new ATOM 0 HB ILE A 101 -7.131 8.776 -1.943 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -5.401 7.056 -1.124 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -4.278 7.800 -2.244 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -7.113 6.363 -2.522 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -7.765 7.377 -3.831 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -6.109 6.734 -3.944 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -3.960 8.659 0.016 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -4.514 9.956 -1.069 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -5.654 9.200 0.068 1.00 0.00 H new ATOM 1547 N THR A 102 -6.614 9.675 -5.892 1.00 0.00 N ATOM 1548 CA THR A 102 -7.513 9.700 -6.997 1.00 0.00 C ATOM 1549 C THR A 102 -7.425 8.381 -7.725 1.00 0.00 C ATOM 1550 O THR A 102 -6.727 7.469 -7.281 1.00 0.00 O ATOM 1551 CB THR A 102 -7.214 10.870 -7.963 1.00 0.00 C ATOM 1552 OG1 THR A 102 -5.848 10.885 -8.313 1.00 0.00 O ATOM 1553 CG2 THR A 102 -7.609 12.191 -7.366 1.00 0.00 C ATOM 0 H THR A 102 -5.627 9.706 -6.147 1.00 0.00 H new ATOM 0 HA THR A 102 -8.523 9.854 -6.618 1.00 0.00 H new ATOM 0 HB THR A 102 -7.810 10.715 -8.863 1.00 0.00 H new ATOM 0 HG1 THR A 102 -5.676 11.630 -8.926 1.00 0.00 H new ATOM 0 HG21 THR A 102 -7.385 12.991 -8.072 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.677 12.187 -7.149 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.052 12.355 -6.443 1.00 0.00 H new ATOM 1561 N PHE A 103 -8.096 8.283 -8.832 1.00 0.00 N ATOM 1562 CA PHE A 103 -8.101 7.086 -9.621 1.00 0.00 C ATOM 1563 C PHE A 103 -6.803 7.104 -10.326 1.00 0.00 C ATOM 1564 O PHE A 103 -6.005 6.205 -10.222 1.00 0.00 O ATOM 1565 CB PHE A 103 -9.266 7.193 -10.618 1.00 0.00 C ATOM 1566 CG PHE A 103 -9.445 6.084 -11.631 1.00 0.00 C ATOM 1567 CD1 PHE A 103 -8.629 6.025 -12.766 1.00 0.00 C ATOM 1568 CD2 PHE A 103 -10.483 5.152 -11.510 1.00 0.00 C ATOM 1569 CE1 PHE A 103 -8.838 5.077 -13.742 1.00 0.00 C ATOM 1570 CE2 PHE A 103 -10.672 4.202 -12.492 1.00 0.00 C ATOM 1571 CZ PHE A 103 -9.858 4.169 -13.607 1.00 0.00 C ATOM 0 H PHE A 103 -8.662 9.039 -9.218 1.00 0.00 H new ATOM 0 HA PHE A 103 -8.225 6.169 -9.045 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -10.189 7.271 -10.044 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -9.151 8.128 -11.166 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -7.822 6.734 -12.878 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -11.135 5.177 -10.649 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -8.200 5.048 -14.613 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -11.465 3.476 -12.388 1.00 0.00 H new ATOM 0 HZ PHE A 103 -10.024 3.427 -14.374 1.00 0.00 H new ATOM 1581 N GLU A 104 -6.586 8.221 -10.931 1.00 0.00 N ATOM 1582 CA GLU A 104 -5.471 8.532 -11.681 1.00 0.00 C ATOM 1583 C GLU A 104 -4.177 8.464 -10.893 1.00 0.00 C ATOM 1584 O GLU A 104 -3.267 7.786 -11.311 1.00 0.00 O ATOM 1585 CB GLU A 104 -5.706 9.889 -12.195 1.00 0.00 C ATOM 1586 CG GLU A 104 -6.677 9.947 -13.350 1.00 0.00 C ATOM 1587 CD GLU A 104 -6.242 9.033 -14.468 1.00 0.00 C ATOM 1588 OE1 GLU A 104 -5.152 9.242 -15.031 1.00 0.00 O ATOM 1589 OE2 GLU A 104 -6.968 8.069 -14.793 1.00 0.00 O ATOM 0 H GLU A 104 -7.256 8.989 -10.895 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.342 7.801 -12.480 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.083 10.513 -11.385 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -4.755 10.317 -12.511 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -7.672 9.661 -13.008 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.748 10.970 -13.719 1.00 0.00 H new ATOM 1596 N ALA A 105 -4.114 9.146 -9.751 1.00 0.00 N ATOM 1597 CA ALA A 105 -2.897 9.173 -8.925 1.00 0.00 C ATOM 1598 C ALA A 105 -2.474 7.786 -8.526 1.00 0.00 C ATOM 1599 O ALA A 105 -1.315 7.416 -8.657 1.00 0.00 O ATOM 1600 CB ALA A 105 -3.110 10.010 -7.679 1.00 0.00 C ATOM 0 H ALA A 105 -4.889 9.689 -9.372 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.108 9.620 -9.529 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -2.197 10.015 -7.084 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -3.363 11.031 -7.965 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -3.924 9.586 -7.091 1.00 0.00 H new ATOM 1606 N ILE A 106 -3.421 7.009 -8.074 1.00 0.00 N ATOM 1607 CA ILE A 106 -3.137 5.674 -7.619 1.00 0.00 C ATOM 1608 C ILE A 106 -2.846 4.769 -8.767 1.00 0.00 C ATOM 1609 O ILE A 106 -1.929 3.993 -8.699 1.00 0.00 O ATOM 1610 CB ILE A 106 -4.272 5.112 -6.763 1.00 0.00 C ATOM 1611 CG1 ILE A 106 -4.493 6.013 -5.568 1.00 0.00 C ATOM 1612 CG2 ILE A 106 -3.995 3.680 -6.311 1.00 0.00 C ATOM 1613 CD1 ILE A 106 -3.252 6.282 -4.740 1.00 0.00 C ATOM 0 H ILE A 106 -4.402 7.279 -8.011 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.248 5.730 -6.991 1.00 0.00 H new ATOM 0 HB ILE A 106 -5.175 5.083 -7.373 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -4.894 6.965 -5.917 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -5.251 5.564 -4.926 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -4.828 3.322 -5.706 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -3.879 3.039 -7.185 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.080 3.656 -5.719 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -3.506 6.936 -3.906 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -2.860 5.340 -4.356 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.497 6.763 -5.362 1.00 0.00 H new ATOM 1625 N LYS A 107 -3.616 4.900 -9.822 1.00 0.00 N ATOM 1626 CA LYS A 107 -3.419 4.117 -11.040 1.00 0.00 C ATOM 1627 C LYS A 107 -2.012 4.336 -11.538 1.00 0.00 C ATOM 1628 O LYS A 107 -1.280 3.395 -11.809 1.00 0.00 O ATOM 1629 CB LYS A 107 -4.358 4.606 -12.135 1.00 0.00 C ATOM 1630 CG LYS A 107 -4.309 3.819 -13.443 1.00 0.00 C ATOM 1631 CD LYS A 107 -5.015 4.572 -14.567 1.00 0.00 C ATOM 1632 CE LYS A 107 -4.247 5.837 -14.945 1.00 0.00 C ATOM 1633 NZ LYS A 107 -4.923 6.627 -15.985 1.00 0.00 N ATOM 0 H LYS A 107 -4.400 5.551 -9.869 1.00 0.00 H new ATOM 0 HA LYS A 107 -3.609 3.068 -10.814 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -5.379 4.579 -11.753 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -4.125 5.649 -12.350 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -3.271 3.635 -13.721 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -4.779 2.846 -13.303 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -5.110 3.925 -15.439 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -6.025 4.835 -14.254 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -4.113 6.454 -14.056 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -3.252 5.561 -15.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -4.402 7.514 -16.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -4.952 6.082 -16.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -5.893 6.845 -15.680 1.00 0.00 H new ATOM 1647 N ALA A 108 -1.661 5.601 -11.641 1.00 0.00 N ATOM 1648 CA ALA A 108 -0.347 6.007 -12.110 1.00 0.00 C ATOM 1649 C ALA A 108 0.723 5.437 -11.214 1.00 0.00 C ATOM 1650 O ALA A 108 1.703 4.884 -11.697 1.00 0.00 O ATOM 1651 CB ALA A 108 -0.233 7.524 -12.170 1.00 0.00 C ATOM 0 H ALA A 108 -2.276 6.379 -11.403 1.00 0.00 H new ATOM 0 HA ALA A 108 -0.210 5.618 -13.119 1.00 0.00 H new ATOM 0 HB1 ALA A 108 0.760 7.801 -12.524 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -0.985 7.919 -12.853 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -0.393 7.940 -11.175 1.00 0.00 H new ATOM 1657 N PHE A 109 0.491 5.529 -9.918 1.00 0.00 N ATOM 1658 CA PHE A 109 1.409 5.043 -8.917 1.00 0.00 C ATOM 1659 C PHE A 109 1.576 3.517 -9.014 1.00 0.00 C ATOM 1660 O PHE A 109 2.651 3.038 -9.269 1.00 0.00 O ATOM 1661 CB PHE A 109 0.920 5.450 -7.517 1.00 0.00 C ATOM 1662 CG PHE A 109 1.891 5.169 -6.411 1.00 0.00 C ATOM 1663 CD1 PHE A 109 2.880 6.087 -6.107 1.00 0.00 C ATOM 1664 CD2 PHE A 109 1.821 3.999 -5.675 1.00 0.00 C ATOM 1665 CE1 PHE A 109 3.781 5.848 -5.099 1.00 0.00 C ATOM 1666 CE2 PHE A 109 2.722 3.753 -4.664 1.00 0.00 C ATOM 1667 CZ PHE A 109 3.703 4.678 -4.377 1.00 0.00 C ATOM 0 H PHE A 109 -0.353 5.950 -9.530 1.00 0.00 H new ATOM 0 HA PHE A 109 2.385 5.494 -9.094 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.693 6.516 -7.521 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -0.012 4.927 -7.306 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.944 7.006 -6.671 1.00 0.00 H new ATOM 0 HD2 PHE A 109 1.053 3.273 -5.896 1.00 0.00 H new ATOM 0 HE1 PHE A 109 4.548 6.574 -4.873 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.660 2.836 -4.096 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.411 4.485 -3.585 1.00 0.00 H new ATOM 1677 N VAL A 110 0.499 2.773 -8.858 1.00 0.00 N ATOM 1678 CA VAL A 110 0.557 1.309 -8.865 1.00 0.00 C ATOM 1679 C VAL A 110 1.132 0.777 -10.176 1.00 0.00 C ATOM 1680 O VAL A 110 1.848 -0.201 -10.164 1.00 0.00 O ATOM 1681 CB VAL A 110 -0.815 0.651 -8.600 1.00 0.00 C ATOM 1682 CG1 VAL A 110 -1.351 0.986 -7.231 1.00 0.00 C ATOM 1683 CG2 VAL A 110 -1.772 1.062 -9.640 1.00 0.00 C ATOM 0 H VAL A 110 -0.438 3.154 -8.723 1.00 0.00 H new ATOM 0 HA VAL A 110 1.221 1.038 -8.044 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.678 -0.430 -8.635 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.317 0.501 -7.090 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.654 0.633 -6.471 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.470 2.066 -7.141 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.739 0.596 -9.450 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.883 2.146 -9.625 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.404 0.749 -10.617 1.00 0.00 H new ATOM 1693 N ASP A 111 0.822 1.449 -11.291 1.00 0.00 N ATOM 1694 CA ASP A 111 1.362 1.091 -12.615 1.00 0.00 C ATOM 1695 C ASP A 111 2.845 1.231 -12.589 1.00 0.00 C ATOM 1696 O ASP A 111 3.576 0.318 -12.901 1.00 0.00 O ATOM 1697 CB ASP A 111 0.844 2.037 -13.673 1.00 0.00 C ATOM 1698 CG ASP A 111 1.289 1.653 -15.070 1.00 0.00 C ATOM 1699 OD1 ASP A 111 0.743 0.690 -15.642 1.00 0.00 O ATOM 1700 OD2 ASP A 111 2.165 2.336 -15.633 1.00 0.00 O ATOM 0 H ASP A 111 0.194 2.252 -11.305 1.00 0.00 H new ATOM 0 HA ASP A 111 1.058 0.069 -12.844 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -0.245 2.056 -13.636 1.00 0.00 H new ATOM 0 HB3 ASP A 111 1.188 3.047 -13.451 1.00 0.00 H new ATOM 1705 N ASP A 112 3.248 2.387 -12.151 1.00 0.00 N ATOM 1706 CA ASP A 112 4.654 2.788 -11.991 1.00 0.00 C ATOM 1707 C ASP A 112 5.359 1.819 -11.073 1.00 0.00 C ATOM 1708 O ASP A 112 6.467 1.431 -11.304 1.00 0.00 O ATOM 1709 CB ASP A 112 4.672 4.297 -11.540 1.00 0.00 C ATOM 1710 CG ASP A 112 5.885 4.975 -10.979 1.00 0.00 C ATOM 1711 OD1 ASP A 112 6.987 4.716 -11.396 1.00 0.00 O ATOM 1712 OD2 ASP A 112 5.715 5.891 -10.129 1.00 0.00 O ATOM 0 H ASP A 112 2.595 3.122 -11.878 1.00 0.00 H new ATOM 0 HA ASP A 112 5.219 2.736 -12.921 1.00 0.00 H new ATOM 0 HB2 ASP A 112 4.367 4.881 -12.408 1.00 0.00 H new ATOM 0 HB3 ASP A 112 3.886 4.404 -10.792 1.00 0.00 H new ATOM 1717 N PHE A 113 4.667 1.355 -10.102 1.00 0.00 N ATOM 1718 CA PHE A 113 5.190 0.380 -9.175 1.00 0.00 C ATOM 1719 C PHE A 113 5.348 -0.990 -9.821 1.00 0.00 C ATOM 1720 O PHE A 113 6.447 -1.530 -9.891 1.00 0.00 O ATOM 1721 CB PHE A 113 4.269 0.316 -7.953 1.00 0.00 C ATOM 1722 CG PHE A 113 4.104 -1.027 -7.303 1.00 0.00 C ATOM 1723 CD1 PHE A 113 5.142 -1.621 -6.628 1.00 0.00 C ATOM 1724 CD2 PHE A 113 2.907 -1.713 -7.421 1.00 0.00 C ATOM 1725 CE1 PHE A 113 4.995 -2.869 -6.087 1.00 0.00 C ATOM 1726 CE2 PHE A 113 2.759 -2.953 -6.874 1.00 0.00 C ATOM 1727 CZ PHE A 113 3.803 -3.531 -6.213 1.00 0.00 C ATOM 0 H PHE A 113 3.705 1.635 -9.911 1.00 0.00 H new ATOM 0 HA PHE A 113 6.188 0.689 -8.863 1.00 0.00 H new ATOM 0 HB2 PHE A 113 4.648 1.012 -7.205 1.00 0.00 H new ATOM 0 HB3 PHE A 113 3.283 0.673 -8.251 1.00 0.00 H new ATOM 0 HD1 PHE A 113 6.082 -1.099 -6.523 1.00 0.00 H new ATOM 0 HD2 PHE A 113 2.082 -1.261 -7.952 1.00 0.00 H new ATOM 0 HE1 PHE A 113 5.818 -3.331 -5.562 1.00 0.00 H new ATOM 0 HE2 PHE A 113 1.818 -3.476 -6.964 1.00 0.00 H new ATOM 0 HZ PHE A 113 3.689 -4.517 -5.787 1.00 0.00 H new ATOM 1737 N VAL A 114 4.250 -1.528 -10.261 1.00 0.00 N ATOM 1738 CA VAL A 114 4.182 -2.863 -10.827 1.00 0.00 C ATOM 1739 C VAL A 114 5.003 -2.969 -12.127 1.00 0.00 C ATOM 1740 O VAL A 114 5.444 -4.047 -12.502 1.00 0.00 O ATOM 1741 CB VAL A 114 2.694 -3.313 -11.022 1.00 0.00 C ATOM 1742 CG1 VAL A 114 1.998 -2.578 -12.147 1.00 0.00 C ATOM 1743 CG2 VAL A 114 2.548 -4.817 -11.150 1.00 0.00 C ATOM 0 H VAL A 114 3.350 -1.048 -10.241 1.00 0.00 H new ATOM 0 HA VAL A 114 4.636 -3.555 -10.118 1.00 0.00 H new ATOM 0 HB VAL A 114 2.180 -3.027 -10.104 1.00 0.00 H new ATOM 0 HG11 VAL A 114 0.971 -2.933 -12.233 1.00 0.00 H new ATOM 0 HG12 VAL A 114 1.996 -1.509 -11.936 1.00 0.00 H new ATOM 0 HG13 VAL A 114 2.525 -2.762 -13.083 1.00 0.00 H new ATOM 0 HG21 VAL A 114 1.496 -5.070 -11.283 1.00 0.00 H new ATOM 0 HG22 VAL A 114 3.117 -5.166 -12.012 1.00 0.00 H new ATOM 0 HG23 VAL A 114 2.926 -5.297 -10.247 1.00 0.00 H new ATOM 1753 N ALA A 115 5.228 -1.838 -12.792 1.00 0.00 N ATOM 1754 CA ALA A 115 6.069 -1.819 -13.992 1.00 0.00 C ATOM 1755 C ALA A 115 7.536 -1.825 -13.588 1.00 0.00 C ATOM 1756 O ALA A 115 8.421 -2.189 -14.369 1.00 0.00 O ATOM 1757 CB ALA A 115 5.764 -0.609 -14.862 1.00 0.00 C ATOM 0 H ALA A 115 4.846 -0.931 -12.526 1.00 0.00 H new ATOM 0 HA ALA A 115 5.852 -2.711 -14.579 1.00 0.00 H new ATOM 0 HB1 ALA A 115 6.404 -0.624 -15.744 1.00 0.00 H new ATOM 0 HB2 ALA A 115 4.719 -0.638 -15.172 1.00 0.00 H new ATOM 0 HB3 ALA A 115 5.949 0.303 -14.295 1.00 0.00 H new ATOM 1763 N GLY A 116 7.792 -1.395 -12.369 1.00 0.00 N ATOM 1764 CA GLY A 116 9.123 -1.432 -11.827 1.00 0.00 C ATOM 1765 C GLY A 116 9.742 -0.103 -11.832 1.00 0.00 C ATOM 1766 O GLY A 116 10.958 0.037 -11.681 1.00 0.00 O ATOM 0 H GLY A 116 7.087 -1.015 -11.737 1.00 0.00 H new ATOM 0 HA2 GLY A 116 9.091 -1.816 -10.807 1.00 0.00 H new ATOM 0 HA3 GLY A 116 9.735 -2.122 -12.408 1.00 0.00 H new ATOM 1770 N LYS A 117 8.933 0.882 -11.950 1.00 0.00 N ATOM 1771 CA LYS A 117 9.403 2.172 -12.124 1.00 0.00 C ATOM 1772 C LYS A 117 9.531 2.876 -10.792 1.00 0.00 C ATOM 1773 O LYS A 117 10.489 3.648 -10.584 1.00 0.00 O ATOM 1774 CB LYS A 117 8.519 2.927 -13.085 1.00 0.00 C ATOM 1775 CG LYS A 117 9.301 3.940 -13.863 1.00 0.00 C ATOM 1776 CD LYS A 117 8.492 4.673 -14.937 1.00 0.00 C ATOM 1777 CE LYS A 117 7.310 5.462 -14.380 1.00 0.00 C ATOM 1778 NZ LYS A 117 7.707 6.412 -13.316 1.00 0.00 N ATOM 0 H LYS A 117 7.917 0.797 -11.926 1.00 0.00 H new ATOM 0 HA LYS A 117 10.400 2.132 -12.562 1.00 0.00 H new ATOM 0 HB2 LYS A 117 8.043 2.227 -13.771 1.00 0.00 H new ATOM 0 HB3 LYS A 117 7.721 3.425 -12.534 1.00 0.00 H new ATOM 0 HG2 LYS A 117 9.712 4.674 -13.170 1.00 0.00 H new ATOM 0 HG3 LYS A 117 10.146 3.442 -14.338 1.00 0.00 H new ATOM 0 HD2 LYS A 117 9.151 5.354 -15.475 1.00 0.00 H new ATOM 0 HD3 LYS A 117 8.124 3.947 -15.662 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.830 6.011 -15.191 1.00 0.00 H new ATOM 0 HE3 LYS A 117 6.569 4.767 -13.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 7.065 7.230 -13.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 7.654 5.939 -12.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 8.681 6.735 -13.485 1.00 0.00 H new ATOM 1792 N ILE A 118 8.583 2.639 -9.884 1.00 0.00 N ATOM 1793 CA ILE A 118 8.704 3.202 -8.560 1.00 0.00 C ATOM 1794 C ILE A 118 9.854 2.549 -7.877 1.00 0.00 C ATOM 1795 O ILE A 118 10.108 1.349 -8.049 1.00 0.00 O ATOM 1796 CB ILE A 118 7.442 3.030 -7.675 1.00 0.00 C ATOM 1797 CG1 ILE A 118 6.277 3.484 -8.411 1.00 0.00 C ATOM 1798 CG2 ILE A 118 7.514 3.859 -6.436 1.00 0.00 C ATOM 1799 CD1 ILE A 118 5.014 3.620 -7.627 1.00 0.00 C ATOM 0 H ILE A 118 7.748 2.075 -10.044 1.00 0.00 H new ATOM 0 HA ILE A 118 8.847 4.275 -8.688 1.00 0.00 H new ATOM 0 HB ILE A 118 7.378 1.975 -7.408 1.00 0.00 H new ATOM 0 HG12 ILE A 118 6.509 4.451 -8.857 1.00 0.00 H new ATOM 0 HG13 ILE A 118 6.098 2.789 -9.231 1.00 0.00 H new ATOM 0 HG21 ILE A 118 6.611 3.709 -5.845 1.00 0.00 H new ATOM 0 HG22 ILE A 118 8.384 3.563 -5.850 1.00 0.00 H new ATOM 0 HG23 ILE A 118 7.600 4.911 -6.707 1.00 0.00 H new ATOM 0 HD11 ILE A 118 4.214 3.965 -8.282 1.00 0.00 H new ATOM 0 HD12 ILE A 118 4.743 2.653 -7.203 1.00 0.00 H new ATOM 0 HD13 ILE A 118 5.161 4.341 -6.823 1.00 0.00 H new ATOM 1811 N GLU A 119 10.544 3.310 -7.154 1.00 0.00 N ATOM 1812 CA GLU A 119 11.661 2.852 -6.463 1.00 0.00 C ATOM 1813 C GLU A 119 11.396 3.053 -4.985 1.00 0.00 C ATOM 1814 O GLU A 119 10.807 4.073 -4.600 1.00 0.00 O ATOM 1815 CB GLU A 119 12.903 3.567 -6.994 1.00 0.00 C ATOM 1816 CG GLU A 119 12.880 5.089 -6.882 1.00 0.00 C ATOM 1817 CD GLU A 119 14.030 5.730 -7.615 1.00 0.00 C ATOM 1818 OE1 GLU A 119 15.136 5.845 -7.051 1.00 0.00 O ATOM 1819 OE2 GLU A 119 13.861 6.117 -8.788 1.00 0.00 O ATOM 0 H GLU A 119 10.344 4.301 -7.020 1.00 0.00 H new ATOM 0 HA GLU A 119 11.850 1.789 -6.613 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.774 3.193 -6.456 1.00 0.00 H new ATOM 0 HB3 GLU A 119 13.036 3.299 -8.042 1.00 0.00 H new ATOM 0 HG2 GLU A 119 11.940 5.467 -7.283 1.00 0.00 H new ATOM 0 HG3 GLU A 119 12.916 5.375 -5.831 1.00 0.00 H new ATOM 1826 N PRO A 120 11.713 2.049 -4.158 1.00 0.00 N ATOM 1827 CA PRO A 120 11.453 2.089 -2.731 1.00 0.00 C ATOM 1828 C PRO A 120 12.047 3.325 -2.068 1.00 0.00 C ATOM 1829 O PRO A 120 13.247 3.571 -2.164 1.00 0.00 O ATOM 1830 CB PRO A 120 12.113 0.825 -2.187 1.00 0.00 C ATOM 1831 CG PRO A 120 12.955 0.292 -3.292 1.00 0.00 C ATOM 1832 CD PRO A 120 12.357 0.796 -4.561 1.00 0.00 C ATOM 0 HA PRO A 120 10.383 2.136 -2.526 1.00 0.00 H new ATOM 0 HB2 PRO A 120 12.718 1.048 -1.309 1.00 0.00 H new ATOM 0 HB3 PRO A 120 11.364 0.095 -1.881 1.00 0.00 H new ATOM 0 HG2 PRO A 120 13.987 0.627 -3.190 1.00 0.00 H new ATOM 0 HG3 PRO A 120 12.971 -0.798 -3.277 1.00 0.00 H new ATOM 0 HD2 PRO A 120 13.116 0.962 -5.325 1.00 0.00 H new ATOM 0 HD3 PRO A 120 11.638 0.089 -4.975 1.00 0.00 H new ATOM 1840 N SER A 121 11.196 4.079 -1.394 1.00 0.00 N ATOM 1841 CA SER A 121 11.566 5.322 -0.746 1.00 0.00 C ATOM 1842 C SER A 121 12.702 5.139 0.285 1.00 0.00 C ATOM 1843 O SER A 121 13.504 6.040 0.504 1.00 0.00 O ATOM 1844 CB SER A 121 10.317 5.919 -0.115 1.00 0.00 C ATOM 1845 OG SER A 121 9.267 5.980 -1.082 1.00 0.00 O ATOM 0 H SER A 121 10.211 3.839 -1.281 1.00 0.00 H new ATOM 0 HA SER A 121 11.967 6.008 -1.493 1.00 0.00 H new ATOM 0 HB2 SER A 121 10.005 5.315 0.737 1.00 0.00 H new ATOM 0 HB3 SER A 121 10.532 6.918 0.265 1.00 0.00 H new ATOM 0 HG SER A 121 8.465 6.364 -0.670 1.00 0.00 H new ATOM 1851 N ILE A 122 12.778 3.967 0.898 1.00 0.00 N ATOM 1852 CA ILE A 122 13.867 3.683 1.825 1.00 0.00 C ATOM 1853 C ILE A 122 14.664 2.482 1.394 1.00 0.00 C ATOM 1854 O ILE A 122 15.884 2.460 1.534 1.00 0.00 O ATOM 1855 CB ILE A 122 13.425 3.470 3.288 1.00 0.00 C ATOM 1856 CG1 ILE A 122 12.270 2.465 3.423 1.00 0.00 C ATOM 1857 CG2 ILE A 122 13.116 4.788 3.980 1.00 0.00 C ATOM 1858 CD1 ILE A 122 11.900 2.135 4.857 1.00 0.00 C ATOM 0 H ILE A 122 12.110 3.206 0.774 1.00 0.00 H new ATOM 0 HA ILE A 122 14.479 4.584 1.794 1.00 0.00 H new ATOM 0 HB ILE A 122 14.275 3.023 3.803 1.00 0.00 H new ATOM 0 HG12 ILE A 122 11.393 2.866 2.916 1.00 0.00 H new ATOM 0 HG13 ILE A 122 12.542 1.544 2.908 1.00 0.00 H new ATOM 0 HG21 ILE A 122 12.808 4.596 5.008 1.00 0.00 H new ATOM 0 HG22 ILE A 122 14.006 5.417 3.979 1.00 0.00 H new ATOM 0 HG23 ILE A 122 12.311 5.297 3.450 1.00 0.00 H new ATOM 0 HD11 ILE A 122 11.077 1.420 4.865 1.00 0.00 H new ATOM 0 HD12 ILE A 122 12.762 1.702 5.365 1.00 0.00 H new ATOM 0 HD13 ILE A 122 11.594 3.045 5.373 1.00 0.00 H new ATOM 1870 N LYS A 123 13.939 1.489 0.906 1.00 0.00 N ATOM 1871 CA LYS A 123 14.466 0.189 0.465 1.00 0.00 C ATOM 1872 C LYS A 123 14.809 -0.567 1.754 1.00 0.00 C ATOM 1873 O LYS A 123 14.219 -0.233 2.790 1.00 0.00 O ATOM 1874 CB LYS A 123 15.679 0.358 -0.496 1.00 0.00 C ATOM 1875 CG LYS A 123 15.953 -0.820 -1.434 1.00 0.00 C ATOM 1876 CD LYS A 123 17.184 -0.559 -2.287 1.00 0.00 C ATOM 1877 CE LYS A 123 17.462 -1.699 -3.243 1.00 0.00 C ATOM 1878 NZ LYS A 123 18.644 -1.427 -4.083 1.00 0.00 N ATOM 0 H LYS A 123 12.927 1.560 0.798 1.00 0.00 H new ATOM 0 HA LYS A 123 13.741 -0.373 -0.124 1.00 0.00 H new ATOM 0 HB2 LYS A 123 15.518 1.250 -1.101 1.00 0.00 H new ATOM 0 HB3 LYS A 123 16.572 0.536 0.104 1.00 0.00 H new ATOM 0 HG2 LYS A 123 16.096 -1.729 -0.850 1.00 0.00 H new ATOM 0 HG3 LYS A 123 15.089 -0.987 -2.077 1.00 0.00 H new ATOM 0 HD2 LYS A 123 17.045 0.363 -2.852 1.00 0.00 H new ATOM 0 HD3 LYS A 123 18.048 -0.409 -1.640 1.00 0.00 H new ATOM 0 HE2 LYS A 123 17.620 -2.618 -2.678 1.00 0.00 H new ATOM 0 HE3 LYS A 123 16.592 -1.861 -3.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 18.805 -2.229 -4.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 18.483 -0.564 -4.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 19.479 -1.297 -3.476 1.00 0.00 H new ATOM 1892 N SER A 124 15.695 -1.560 1.703 1.00 0.00 N ATOM 1893 CA SER A 124 16.080 -2.365 2.866 1.00 0.00 C ATOM 1894 C SER A 124 14.937 -3.274 3.341 1.00 0.00 C ATOM 1895 O SER A 124 13.810 -2.834 3.588 1.00 0.00 O ATOM 1896 CB SER A 124 16.608 -1.485 4.015 1.00 0.00 C ATOM 1897 OG SER A 124 17.688 -0.664 3.568 1.00 0.00 O ATOM 0 H SER A 124 16.173 -1.833 0.844 1.00 0.00 H new ATOM 0 HA SER A 124 16.895 -3.014 2.545 1.00 0.00 H new ATOM 0 HB2 SER A 124 15.803 -0.858 4.399 1.00 0.00 H new ATOM 0 HB3 SER A 124 16.941 -2.116 4.839 1.00 0.00 H new ATOM 0 HG SER A 124 18.008 -0.112 4.311 1.00 0.00 H new ATOM 1903 N GLU A 125 15.224 -4.531 3.461 1.00 0.00 N ATOM 1904 CA GLU A 125 14.263 -5.478 3.917 1.00 0.00 C ATOM 1905 C GLU A 125 14.820 -6.013 5.191 1.00 0.00 C ATOM 1906 O GLU A 125 15.712 -6.878 5.176 1.00 0.00 O ATOM 1907 CB GLU A 125 14.019 -6.616 2.916 1.00 0.00 C ATOM 1908 CG GLU A 125 13.640 -6.186 1.499 1.00 0.00 C ATOM 1909 CD GLU A 125 14.828 -5.825 0.636 1.00 0.00 C ATOM 1910 OE1 GLU A 125 15.544 -6.753 0.197 1.00 0.00 O ATOM 1911 OE2 GLU A 125 15.067 -4.620 0.370 1.00 0.00 O ATOM 0 H GLU A 125 16.137 -4.929 3.244 1.00 0.00 H new ATOM 0 HA GLU A 125 13.291 -5.002 4.045 1.00 0.00 H new ATOM 0 HB2 GLU A 125 14.921 -7.226 2.861 1.00 0.00 H new ATOM 0 HB3 GLU A 125 13.226 -7.254 3.306 1.00 0.00 H new ATOM 0 HG2 GLU A 125 13.086 -6.993 1.020 1.00 0.00 H new ATOM 0 HG3 GLU A 125 12.969 -5.329 1.556 1.00 0.00 H new ATOM 1918 N PRO A 126 14.403 -5.462 6.306 1.00 0.00 N ATOM 1919 CA PRO A 126 15.010 -5.759 7.561 1.00 0.00 C ATOM 1920 C PRO A 126 14.577 -7.067 8.157 1.00 0.00 C ATOM 1921 O PRO A 126 13.416 -7.477 8.064 1.00 0.00 O ATOM 1922 CB PRO A 126 14.621 -4.589 8.413 1.00 0.00 C ATOM 1923 CG PRO A 126 13.258 -4.224 7.935 1.00 0.00 C ATOM 1924 CD PRO A 126 13.268 -4.512 6.456 1.00 0.00 C ATOM 0 HA PRO A 126 16.088 -5.889 7.467 1.00 0.00 H new ATOM 0 HB2 PRO A 126 14.615 -4.852 9.471 1.00 0.00 H new ATOM 0 HB3 PRO A 126 15.319 -3.761 8.294 1.00 0.00 H new ATOM 0 HG2 PRO A 126 12.492 -4.809 8.445 1.00 0.00 H new ATOM 0 HG3 PRO A 126 13.040 -3.174 8.130 1.00 0.00 H new ATOM 0 HD2 PRO A 126 12.327 -4.952 6.124 1.00 0.00 H new ATOM 0 HD3 PRO A 126 13.420 -3.606 5.870 1.00 0.00 H new ATOM 1932 N ILE A 127 15.521 -7.718 8.730 1.00 0.00 N ATOM 1933 CA ILE A 127 15.327 -8.974 9.354 1.00 0.00 C ATOM 1934 C ILE A 127 16.280 -9.093 10.567 1.00 0.00 C ATOM 1935 O ILE A 127 17.404 -9.599 10.471 1.00 0.00 O ATOM 1936 CB ILE A 127 15.480 -10.152 8.325 1.00 0.00 C ATOM 1937 CG1 ILE A 127 15.230 -11.517 8.970 1.00 0.00 C ATOM 1938 CG2 ILE A 127 16.819 -10.113 7.579 1.00 0.00 C ATOM 1939 CD1 ILE A 127 13.824 -11.687 9.505 1.00 0.00 C ATOM 0 H ILE A 127 16.482 -7.380 8.779 1.00 0.00 H new ATOM 0 HA ILE A 127 14.306 -9.047 9.728 1.00 0.00 H new ATOM 0 HB ILE A 127 14.702 -10.003 7.576 1.00 0.00 H new ATOM 0 HG12 ILE A 127 15.427 -12.298 8.236 1.00 0.00 H new ATOM 0 HG13 ILE A 127 15.940 -11.660 9.785 1.00 0.00 H new ATOM 0 HG21 ILE A 127 16.871 -10.949 6.881 1.00 0.00 H new ATOM 0 HG22 ILE A 127 16.902 -9.176 7.029 1.00 0.00 H new ATOM 0 HG23 ILE A 127 17.637 -10.187 8.296 1.00 0.00 H new ATOM 0 HD11 ILE A 127 13.720 -12.678 9.947 1.00 0.00 H new ATOM 0 HD12 ILE A 127 13.629 -10.929 10.263 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.109 -11.577 8.690 1.00 0.00 H new ATOM 1951 N PRO A 128 15.874 -8.544 11.713 1.00 0.00 N ATOM 1952 CA PRO A 128 16.693 -8.565 12.911 1.00 0.00 C ATOM 1953 C PRO A 128 16.572 -9.907 13.624 1.00 0.00 C ATOM 1954 O PRO A 128 15.918 -10.838 13.114 1.00 0.00 O ATOM 1955 CB PRO A 128 16.086 -7.442 13.751 1.00 0.00 C ATOM 1956 CG PRO A 128 14.640 -7.442 13.386 1.00 0.00 C ATOM 1957 CD PRO A 128 14.572 -7.871 11.944 1.00 0.00 C ATOM 0 HA PRO A 128 17.757 -8.431 12.715 1.00 0.00 H new ATOM 0 HB2 PRO A 128 16.226 -7.623 14.817 1.00 0.00 H new ATOM 0 HB3 PRO A 128 16.552 -6.482 13.527 1.00 0.00 H new ATOM 0 HG2 PRO A 128 14.078 -8.125 14.023 1.00 0.00 H new ATOM 0 HG3 PRO A 128 14.205 -6.451 13.519 1.00 0.00 H new ATOM 0 HD2 PRO A 128 13.735 -8.547 11.767 1.00 0.00 H new ATOM 0 HD3 PRO A 128 14.439 -7.018 11.279 1.00 0.00 H new ATOM 1965 N GLU A 129 17.192 -10.031 14.776 1.00 0.00 N ATOM 1966 CA GLU A 129 17.077 -11.249 15.532 1.00 0.00 C ATOM 1967 C GLU A 129 15.679 -11.299 16.095 1.00 0.00 C ATOM 1968 O GLU A 129 15.181 -10.285 16.607 1.00 0.00 O ATOM 1969 CB GLU A 129 18.143 -11.328 16.634 1.00 0.00 C ATOM 1970 CG GLU A 129 18.149 -12.647 17.401 1.00 0.00 C ATOM 1971 CD GLU A 129 19.358 -12.803 18.290 1.00 0.00 C ATOM 1972 OE1 GLU A 129 20.454 -13.050 17.757 1.00 0.00 O ATOM 1973 OE2 GLU A 129 19.233 -12.719 19.537 1.00 0.00 O ATOM 0 H GLU A 129 17.774 -9.310 15.203 1.00 0.00 H new ATOM 0 HA GLU A 129 17.250 -12.113 14.891 1.00 0.00 H new ATOM 0 HB2 GLU A 129 19.125 -11.176 16.186 1.00 0.00 H new ATOM 0 HB3 GLU A 129 17.984 -10.511 17.338 1.00 0.00 H new ATOM 0 HG2 GLU A 129 17.246 -12.712 18.009 1.00 0.00 H new ATOM 0 HG3 GLU A 129 18.116 -13.474 16.692 1.00 0.00 H new ATOM 1980 N LYS A 130 15.025 -12.435 15.952 1.00 0.00 N ATOM 1981 CA LYS A 130 13.652 -12.565 16.381 1.00 0.00 C ATOM 1982 C LYS A 130 13.530 -12.529 17.895 1.00 0.00 C ATOM 1983 O LYS A 130 13.741 -13.542 18.583 1.00 0.00 O ATOM 1984 CB LYS A 130 12.940 -13.829 15.824 1.00 0.00 C ATOM 1985 CG LYS A 130 12.690 -13.892 14.303 1.00 0.00 C ATOM 1986 CD LYS A 130 13.951 -14.191 13.495 1.00 0.00 C ATOM 1987 CE LYS A 130 13.621 -14.419 12.019 1.00 0.00 C ATOM 1988 NZ LYS A 130 14.813 -14.836 11.229 1.00 0.00 N ATOM 0 H LYS A 130 15.425 -13.279 15.542 1.00 0.00 H new ATOM 0 HA LYS A 130 13.142 -11.699 15.959 1.00 0.00 H new ATOM 0 HB2 LYS A 130 13.532 -14.700 16.104 1.00 0.00 H new ATOM 0 HB3 LYS A 130 11.978 -13.923 16.327 1.00 0.00 H new ATOM 0 HG2 LYS A 130 11.944 -14.659 14.096 1.00 0.00 H new ATOM 0 HG3 LYS A 130 12.271 -12.942 13.971 1.00 0.00 H new ATOM 0 HD2 LYS A 130 14.652 -13.362 13.590 1.00 0.00 H new ATOM 0 HD3 LYS A 130 14.445 -15.074 13.900 1.00 0.00 H new ATOM 0 HE2 LYS A 130 12.848 -15.183 11.936 1.00 0.00 H new ATOM 0 HE3 LYS A 130 13.210 -13.503 11.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 14.539 -14.978 10.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 15.542 -14.097 11.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 15.191 -15.725 11.614 1.00 0.00 H new ATOM 2002 N GLN A 131 13.256 -11.359 18.411 1.00 0.00 N ATOM 2003 CA GLN A 131 12.975 -11.190 19.809 1.00 0.00 C ATOM 2004 C GLN A 131 11.530 -11.539 19.985 1.00 0.00 C ATOM 2005 O GLN A 131 10.747 -11.407 19.032 1.00 0.00 O ATOM 2006 CB GLN A 131 13.233 -9.748 20.243 1.00 0.00 C ATOM 2007 CG GLN A 131 14.680 -9.317 20.105 1.00 0.00 C ATOM 2008 CD GLN A 131 14.901 -7.867 20.485 1.00 0.00 C ATOM 2009 OE1 GLN A 131 14.018 -7.022 20.327 1.00 0.00 O ATOM 2010 NE2 GLN A 131 16.060 -7.573 21.014 1.00 0.00 N ATOM 0 H GLN A 131 13.222 -10.495 17.870 1.00 0.00 H new ATOM 0 HA GLN A 131 13.617 -11.824 20.420 1.00 0.00 H new ATOM 0 HB2 GLN A 131 12.607 -9.082 19.649 1.00 0.00 H new ATOM 0 HB3 GLN A 131 12.926 -9.631 21.282 1.00 0.00 H new ATOM 0 HG2 GLN A 131 15.305 -9.952 20.734 1.00 0.00 H new ATOM 0 HG3 GLN A 131 15.003 -9.471 19.076 1.00 0.00 H new ATOM 0 HE21 GLN A 131 16.767 -8.299 21.129 1.00 0.00 H new ATOM 0 HE22 GLN A 131 16.257 -6.617 21.312 1.00 0.00 H new ATOM 2019 N GLU A 132 11.144 -11.989 21.130 1.00 0.00 N ATOM 2020 CA GLU A 132 9.793 -12.400 21.269 1.00 0.00 C ATOM 2021 C GLU A 132 8.926 -11.222 21.671 1.00 0.00 C ATOM 2022 O GLU A 132 9.392 -10.259 22.305 1.00 0.00 O ATOM 2023 CB GLU A 132 9.649 -13.555 22.229 1.00 0.00 C ATOM 2024 CG GLU A 132 8.392 -14.355 21.989 1.00 0.00 C ATOM 2025 CD GLU A 132 8.273 -15.532 22.884 1.00 0.00 C ATOM 2026 OE1 GLU A 132 8.937 -16.545 22.633 1.00 0.00 O ATOM 2027 OE2 GLU A 132 7.504 -15.464 23.856 1.00 0.00 O ATOM 0 H GLU A 132 11.728 -12.080 21.962 1.00 0.00 H new ATOM 0 HA GLU A 132 9.449 -12.763 20.300 1.00 0.00 H new ATOM 0 HB2 GLU A 132 10.515 -14.210 22.136 1.00 0.00 H new ATOM 0 HB3 GLU A 132 9.644 -13.175 23.251 1.00 0.00 H new ATOM 0 HG2 GLU A 132 7.525 -13.710 22.130 1.00 0.00 H new ATOM 0 HG3 GLU A 132 8.374 -14.691 20.952 1.00 0.00 H new ATOM 2034 N GLY A 133 7.694 -11.306 21.310 1.00 0.00 N ATOM 2035 CA GLY A 133 6.766 -10.255 21.520 1.00 0.00 C ATOM 2036 C GLY A 133 5.999 -10.027 20.260 1.00 0.00 C ATOM 2037 O GLY A 133 5.798 -11.001 19.500 1.00 0.00 O ATOM 2038 OXT GLY A 133 5.645 -8.885 19.958 1.00 0.00 O ATOM 0 H GLY A 133 7.296 -12.125 20.851 1.00 0.00 H new ATOM 0 HA2 GLY A 133 6.087 -10.509 22.334 1.00 0.00 H new ATOM 0 HA3 GLY A 133 7.288 -9.344 21.813 1.00 0.00 H new TER 2042 GLY A 133