USER MOD reduce.3.24.130724 H: found=0, std=0, add=1099, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1094 hydrogens (26 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 NoAdj-H: B 502 BB9 HN2 : B 502 BB9 N : B 501 SER C :(H bumps) USER MOD NoAdj-H: B 504 DBU H2 : B 504 DBU N : B 503 THR C :(H bumps) USER MOD NoAdj-H: B 505 BB9 HN2 : B 505 BB9 N : B 504 DBU C :(H bumps) USER MOD NoAdj-H: B 506 3GL HN2 : B 506 3GL N : B 505 BB9 C :(H bumps) USER MOD NoAdj-H: B 506 3GL HN1 : B 506 3GL N : B 505 BB9 C :(H bumps) USER MOD NoAdj-H: B 507 BB9 HN2 : B 507 BB9 N : B 506 3GL C :(H bumps) USER MOD NoAdj-H: B 509 BB9 HN2 : B 509 BB9 N : B 508 CYS C :(H bumps) USER MOD NoAdj-H: B 510 MH6 HB3 : B 510 MH6 CB : B 501 SER CB :(H bumps) USER MOD NoAdj-H: B 510 MH6 HB2 : B 510 MH6 CB : B 501 SER CB :(H bumps) USER MOD NoAdj-H: B 511 BB9 HN2 : B 511 BB9 N : B 510 MH6 C :(H bumps) USER MOD Set 1.1: A 196 HIS : no HD1:sc= -1.74 X(o=-8,f=-8.5!) USER MOD Set 1.2: A 212 HIS : no HE2:sc= -6.26! C(o=-8!,f=-12!) USER MOD Set 2.1: A 204 HIS : no HD1:sc= -17.9! C(o=-19!,f=-30!) USER MOD Set 2.2: A 207 CYS SG : rot 180:sc= -0.658 USER MOD Set 3.1: A 190 MET CE :methyl 155:sc= -1.7 (180deg=-3.05!) USER MOD Set 3.2: A 247 ASN : amide:sc= -6.3! C(o=-17!,f=-21!) USER MOD Set 3.3: A 251 HIS : no HE2:sc= -9.2! C(o=-17!,f=-24!) USER MOD Set 4.1: A 178 MET CE :methyl 149:sc= -4.07! (180deg=-2.07!) USER MOD Set 4.2: A 233 LYS NZ :NH3+ -120:sc= -8.9! (180deg=-8.98!) USER MOD Set 5.1: A 151 LYS NZ :NH3+ -119:sc= 0.416 (180deg=-0.387) USER MOD Set 5.2: A 155 TYR OH : rot 180:sc= -1.97! USER MOD Single : A 113 ASN : amide:sc= -3.74! K(o=-3.7!,f=-0.32) USER MOD Single : A 115 THR OG1 : rot 140:sc= -0.771 USER MOD Single : A 119 LYS NZ :NH3+ -135:sc= -2.5! (180deg=-4.18!) USER MOD Single : A 130 GLN : amide:sc= -11.8! C(o=-12!,f=-15!) USER MOD Single : A 131 TYR OH : rot 180:sc= -0.354 USER MOD Single : A 141 ASN : amide:sc= -6.22! C(o=-6.2!,f=-11!) USER MOD Single : A 142 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 TYR OH : rot 70:sc= 1.11 USER MOD Single : A 147 GLN : amide:sc= -8.48! C(o=-8.5!,f=-3.1!) USER MOD Single : A 148 SER OG : rot 35:sc= 0.0524 USER MOD Single : A 149 LYS NZ :NH3+ 140:sc= -0.0914 (180deg=-0.441) USER MOD Single : A 152 THR OG1 : rot -170:sc= -0.359 USER MOD Single : A 154 SER OG : rot -13:sc= 0.857 USER MOD Single : A 156 THR OG1 : rot 180:sc= 0.0461 USER MOD Single : A 157 LYS NZ :NH3+ 136:sc= -0.0677 (180deg=-0.79) USER MOD Single : A 161 GLN : amide:sc= -10.7! C(o=-11!,f=-5.2!) USER MOD Single : A 164 GLN : amide:sc= -3.46 X(o=-3.5,f=-3.1) USER MOD Single : A 171 THR OG1 : rot 86:sc= 1.26 USER MOD Single : A 186 SER OG : rot -113:sc= -2.51! USER MOD Single : A 198 GLN : amide:sc= -10.2! C(o=-10!,f=-15!) USER MOD Single : A 203 ASN : amide:sc= -8.39! C(o=-8.4!,f=-4.1!) USER MOD Single : A 205 TYR OH : rot 95:sc= -6.11! USER MOD Single : A 209 TYR OH : rot 180:sc= 0 USER MOD Single : A 211 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 213 THR OG1 : rot -140:sc= -1.79! USER MOD Single : A 218 MET CE :methyl 160:sc= -4.27 (180deg=-6.57!) USER MOD Single : A 219 TYR OH : rot 180:sc= -2.39! USER MOD Single : A 221 SER OG : rot 180:sc= 0 USER MOD Single : A 226 THR OG1 : rot 90:sc= -0.0385 USER MOD Single : A 228 ASN : amide:sc= -3.23! C(o=-3.2!,f=-8.3!) USER MOD Single : A 239 TYR OH : rot 30:sc= 0.0778 USER MOD Single : A 240 MET CE :methyl -138:sc= -1.43 (180deg=-5.84!) USER MOD Single : A 252 THR OG1 : rot 180:sc= -0.554 USER MOD Single : B 503 THR OG1 : rot -37:sc= 0.399 USER MOD Single : B 506 3GL OH : rot 135:sc= -5.74! USER MOD Single : B 510 MH6 OG : rot -117:sc= 1.98 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 111 110.467 18.354 -3.029 1.00 0.00 N ATOM 2 CA GLY A 111 111.768 18.965 -2.644 1.00 0.00 C ATOM 3 C GLY A 111 112.289 18.439 -1.319 1.00 0.00 C ATOM 4 O GLY A 111 111.524 18.247 -0.375 1.00 0.00 O ATOM 0 HA2 GLY A 111 112.503 18.767 -3.424 1.00 0.00 H new ATOM 0 HA3 GLY A 111 111.653 20.047 -2.581 1.00 0.00 H new ATOM 8 N ILE A 112 113.601 18.228 -1.247 1.00 0.00 N ATOM 9 CA ILE A 112 114.243 17.746 -0.027 1.00 0.00 C ATOM 10 C ILE A 112 115.059 18.861 0.630 1.00 0.00 C ATOM 11 O ILE A 112 115.983 19.410 0.029 1.00 0.00 O ATOM 12 CB ILE A 112 115.146 16.524 -0.305 1.00 0.00 C ATOM 13 CG1 ILE A 112 114.298 15.283 -0.617 1.00 0.00 C ATOM 14 CG2 ILE A 112 116.072 16.259 0.872 1.00 0.00 C ATOM 15 CD1 ILE A 112 113.640 14.662 0.598 1.00 0.00 C ATOM 0 H ILE A 112 114.243 18.384 -2.024 1.00 0.00 H new ATOM 0 HA ILE A 112 113.453 17.434 0.656 1.00 0.00 H new ATOM 0 HB ILE A 112 115.760 16.747 -1.178 1.00 0.00 H new ATOM 0 HG12 ILE A 112 113.525 15.556 -1.336 1.00 0.00 H new ATOM 0 HG13 ILE A 112 114.930 14.535 -1.096 1.00 0.00 H new ATOM 0 HG21 ILE A 112 116.699 15.394 0.654 1.00 0.00 H new ATOM 0 HG22 ILE A 112 116.703 17.131 1.042 1.00 0.00 H new ATOM 0 HG23 ILE A 112 115.478 16.061 1.765 1.00 0.00 H new ATOM 0 HD11 ILE A 112 113.060 13.791 0.292 1.00 0.00 H new ATOM 0 HD12 ILE A 112 114.406 14.356 1.310 1.00 0.00 H new ATOM 0 HD13 ILE A 112 112.980 15.392 1.067 1.00 0.00 H new ATOM 27 N ASN A 113 114.698 19.185 1.867 1.00 0.00 N ATOM 28 CA ASN A 113 115.375 20.231 2.633 1.00 0.00 C ATOM 29 C ASN A 113 116.428 19.639 3.564 1.00 0.00 C ATOM 30 O ASN A 113 116.154 19.386 4.737 1.00 0.00 O ATOM 31 CB ASN A 113 114.351 21.017 3.454 1.00 0.00 C ATOM 32 CG ASN A 113 113.299 21.680 2.586 1.00 0.00 C ATOM 33 OD1 ASN A 113 112.399 22.353 3.086 1.00 0.00 O ATOM 34 ND2 ASN A 113 113.408 21.491 1.276 1.00 0.00 N ATOM 0 H ASN A 113 113.932 18.734 2.367 1.00 0.00 H new ATOM 0 HA ASN A 113 115.874 20.897 1.929 1.00 0.00 H new ATOM 0 HB2 ASN A 113 113.864 20.345 4.161 1.00 0.00 H new ATOM 0 HB3 ASN A 113 114.866 21.778 4.040 1.00 0.00 H new ATOM 0 HD21 ASN A 113 112.729 21.912 0.642 1.00 0.00 H new ATOM 0 HD22 ASN A 113 114.171 20.925 0.904 1.00 0.00 H new ATOM 41 N LEU A 114 117.631 19.418 3.039 1.00 0.00 N ATOM 42 CA LEU A 114 118.722 18.852 3.834 1.00 0.00 C ATOM 43 C LEU A 114 120.077 19.380 3.377 1.00 0.00 C ATOM 44 O LEU A 114 120.309 19.586 2.186 1.00 0.00 O ATOM 45 CB LEU A 114 118.737 17.325 3.710 1.00 0.00 C ATOM 46 CG LEU A 114 117.439 16.601 4.075 1.00 0.00 C ATOM 47 CD1 LEU A 114 117.494 15.154 3.594 1.00 0.00 C ATOM 48 CD2 LEU A 114 117.206 16.650 5.580 1.00 0.00 C ATOM 0 H LEU A 114 117.876 19.621 2.070 1.00 0.00 H new ATOM 0 HA LEU A 114 118.550 19.147 4.869 1.00 0.00 H new ATOM 0 HB2 LEU A 114 118.995 17.068 2.683 1.00 0.00 H new ATOM 0 HB3 LEU A 114 119.534 16.938 4.345 1.00 0.00 H new ATOM 0 HG LEU A 114 116.608 17.105 3.582 1.00 0.00 H new ATOM 0 HD11 LEU A 114 116.566 14.647 3.858 1.00 0.00 H new ATOM 0 HD12 LEU A 114 117.622 15.135 2.512 1.00 0.00 H new ATOM 0 HD13 LEU A 114 118.333 14.645 4.068 1.00 0.00 H new ATOM 0 HD21 LEU A 114 116.279 16.130 5.822 1.00 0.00 H new ATOM 0 HD22 LEU A 114 118.037 16.166 6.093 1.00 0.00 H new ATOM 0 HD23 LEU A 114 117.135 17.688 5.904 1.00 0.00 H new ATOM 60 N THR A 115 120.979 19.569 4.338 1.00 0.00 N ATOM 61 CA THR A 115 122.328 20.038 4.050 1.00 0.00 C ATOM 62 C THR A 115 123.234 18.833 3.818 1.00 0.00 C ATOM 63 O THR A 115 123.007 17.773 4.399 1.00 0.00 O ATOM 64 CB THR A 115 122.872 20.850 5.228 1.00 0.00 C ATOM 65 OG1 THR A 115 123.125 20.006 6.334 1.00 0.00 O ATOM 66 CG2 THR A 115 121.934 21.937 5.701 1.00 0.00 C ATOM 0 H THR A 115 120.796 19.403 5.328 1.00 0.00 H new ATOM 0 HA THR A 115 122.302 20.671 3.163 1.00 0.00 H new ATOM 0 HB THR A 115 123.784 21.317 4.856 1.00 0.00 H new ATOM 0 HG1 THR A 115 123.960 20.279 6.769 1.00 0.00 H new ATOM 0 HG21 THR A 115 122.387 22.470 6.537 1.00 0.00 H new ATOM 0 HG22 THR A 115 121.745 22.635 4.885 1.00 0.00 H new ATOM 0 HG23 THR A 115 120.993 21.491 6.022 1.00 0.00 H new ATOM 74 N PRO A 116 124.281 18.959 2.990 1.00 0.00 N ATOM 75 CA PRO A 116 125.194 17.848 2.742 1.00 0.00 C ATOM 76 C PRO A 116 125.607 17.180 4.049 1.00 0.00 C ATOM 77 O PRO A 116 125.722 15.956 4.133 1.00 0.00 O ATOM 78 CB PRO A 116 126.402 18.506 2.043 1.00 0.00 C ATOM 79 CG PRO A 116 126.163 19.983 2.121 1.00 0.00 C ATOM 80 CD PRO A 116 124.677 20.164 2.256 1.00 0.00 C ATOM 0 HA PRO A 116 124.744 17.060 2.138 1.00 0.00 H new ATOM 0 HB2 PRO A 116 127.335 18.234 2.536 1.00 0.00 H new ATOM 0 HB3 PRO A 116 126.481 18.177 1.007 1.00 0.00 H new ATOM 0 HG2 PRO A 116 126.686 20.417 2.973 1.00 0.00 H new ATOM 0 HG3 PRO A 116 126.536 20.485 1.228 1.00 0.00 H new ATOM 0 HD2 PRO A 116 124.426 21.073 2.802 1.00 0.00 H new ATOM 0 HD3 PRO A 116 124.185 20.229 1.285 1.00 0.00 H new ATOM 88 N GLU A 117 125.831 18.007 5.062 1.00 0.00 N ATOM 89 CA GLU A 117 126.243 17.545 6.386 1.00 0.00 C ATOM 90 C GLU A 117 125.094 16.903 7.169 1.00 0.00 C ATOM 91 O GLU A 117 125.285 15.900 7.858 1.00 0.00 O ATOM 92 CB GLU A 117 126.822 18.722 7.176 1.00 0.00 C ATOM 93 CG GLU A 117 126.902 18.482 8.675 1.00 0.00 C ATOM 94 CD GLU A 117 127.643 19.587 9.402 1.00 0.00 C ATOM 95 OE1 GLU A 117 128.833 19.808 9.091 1.00 0.00 O ATOM 96 OE2 GLU A 117 127.035 20.229 10.283 1.00 0.00 O ATOM 0 H GLU A 117 125.733 19.020 4.991 1.00 0.00 H new ATOM 0 HA GLU A 117 127.001 16.774 6.245 1.00 0.00 H new ATOM 0 HB2 GLU A 117 127.821 18.942 6.800 1.00 0.00 H new ATOM 0 HB3 GLU A 117 126.211 19.605 6.992 1.00 0.00 H new ATOM 0 HG2 GLU A 117 125.894 18.398 9.080 1.00 0.00 H new ATOM 0 HG3 GLU A 117 127.401 17.531 8.861 1.00 0.00 H new ATOM 103 N GLU A 118 123.905 17.476 7.062 1.00 0.00 N ATOM 104 CA GLU A 118 122.742 16.950 7.768 1.00 0.00 C ATOM 105 C GLU A 118 122.244 15.660 7.137 1.00 0.00 C ATOM 106 O GLU A 118 121.699 14.797 7.824 1.00 0.00 O ATOM 107 CB GLU A 118 121.612 17.983 7.796 1.00 0.00 C ATOM 108 CG GLU A 118 121.845 19.136 8.763 1.00 0.00 C ATOM 109 CD GLU A 118 121.818 18.707 10.218 1.00 0.00 C ATOM 110 OE1 GLU A 118 122.696 17.917 10.625 1.00 0.00 O ATOM 111 OE2 GLU A 118 120.916 19.162 10.953 1.00 0.00 O ATOM 0 H GLU A 118 123.718 18.303 6.495 1.00 0.00 H new ATOM 0 HA GLU A 118 123.053 16.734 8.790 1.00 0.00 H new ATOM 0 HB2 GLU A 118 121.479 18.387 6.792 1.00 0.00 H new ATOM 0 HB3 GLU A 118 120.682 17.481 8.064 1.00 0.00 H new ATOM 0 HG2 GLU A 118 122.808 19.597 8.544 1.00 0.00 H new ATOM 0 HG3 GLU A 118 121.083 19.898 8.601 1.00 0.00 H new ATOM 118 N LYS A 119 122.393 15.538 5.826 1.00 0.00 N ATOM 119 CA LYS A 119 121.903 14.348 5.156 1.00 0.00 C ATOM 120 C LYS A 119 122.429 13.117 5.885 1.00 0.00 C ATOM 121 O LYS A 119 121.698 12.172 6.178 1.00 0.00 O ATOM 122 CB LYS A 119 122.328 14.326 3.688 1.00 0.00 C ATOM 123 CG LYS A 119 121.581 15.326 2.825 1.00 0.00 C ATOM 124 CD LYS A 119 122.220 15.455 1.455 1.00 0.00 C ATOM 125 CE LYS A 119 121.513 16.496 0.605 1.00 0.00 C ATOM 126 NZ LYS A 119 121.580 17.851 1.218 1.00 0.00 N ATOM 0 H LYS A 119 122.837 16.229 5.221 1.00 0.00 H new ATOM 0 HA LYS A 119 120.813 14.350 5.179 1.00 0.00 H new ATOM 0 HB2 LYS A 119 123.397 14.531 3.625 1.00 0.00 H new ATOM 0 HB3 LYS A 119 122.171 13.324 3.288 1.00 0.00 H new ATOM 0 HG2 LYS A 119 120.543 15.012 2.717 1.00 0.00 H new ATOM 0 HG3 LYS A 119 121.571 16.299 3.317 1.00 0.00 H new ATOM 0 HD2 LYS A 119 123.270 15.727 1.566 1.00 0.00 H new ATOM 0 HD3 LYS A 119 122.193 14.491 0.948 1.00 0.00 H new ATOM 0 HE2 LYS A 119 121.965 16.523 -0.386 1.00 0.00 H new ATOM 0 HE3 LYS A 119 120.470 16.209 0.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 120.644 18.301 1.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 121.871 17.768 2.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 122.272 18.432 0.702 1.00 0.00 H new ATOM 140 N PHE A 120 123.735 13.160 6.163 1.00 0.00 N ATOM 141 CA PHE A 120 124.438 12.082 6.852 1.00 0.00 C ATOM 142 C PHE A 120 123.816 11.760 8.212 1.00 0.00 C ATOM 143 O PHE A 120 123.866 10.619 8.670 1.00 0.00 O ATOM 144 CB PHE A 120 125.905 12.465 7.066 1.00 0.00 C ATOM 145 CG PHE A 120 126.725 12.522 5.809 1.00 0.00 C ATOM 146 CD1 PHE A 120 127.196 11.361 5.219 1.00 0.00 C ATOM 147 CD2 PHE A 120 127.030 13.738 5.223 1.00 0.00 C ATOM 148 CE1 PHE A 120 127.957 11.414 4.068 1.00 0.00 C ATOM 149 CE2 PHE A 120 127.789 13.798 4.071 1.00 0.00 C ATOM 150 CZ PHE A 120 128.255 12.634 3.492 1.00 0.00 C ATOM 0 H PHE A 120 124.334 13.948 5.914 1.00 0.00 H new ATOM 0 HA PHE A 120 124.359 11.198 6.219 1.00 0.00 H new ATOM 0 HB2 PHE A 120 125.945 13.438 7.555 1.00 0.00 H new ATOM 0 HB3 PHE A 120 126.359 11.746 7.748 1.00 0.00 H new ATOM 0 HD1 PHE A 120 126.966 10.404 5.664 1.00 0.00 H new ATOM 0 HD2 PHE A 120 126.670 14.652 5.672 1.00 0.00 H new ATOM 0 HE1 PHE A 120 128.319 10.502 3.618 1.00 0.00 H new ATOM 0 HE2 PHE A 120 128.018 14.754 3.623 1.00 0.00 H new ATOM 0 HZ PHE A 120 128.850 12.677 2.592 1.00 0.00 H new ATOM 160 N GLU A 121 123.244 12.773 8.857 1.00 0.00 N ATOM 161 CA GLU A 121 122.629 12.590 10.172 1.00 0.00 C ATOM 162 C GLU A 121 121.353 11.753 10.097 1.00 0.00 C ATOM 163 O GLU A 121 120.998 11.063 11.053 1.00 0.00 O ATOM 164 CB GLU A 121 122.329 13.945 10.826 1.00 0.00 C ATOM 165 CG GLU A 121 123.561 14.655 11.366 1.00 0.00 C ATOM 166 CD GLU A 121 124.570 15.000 10.290 1.00 0.00 C ATOM 167 OE1 GLU A 121 125.066 14.072 9.618 1.00 0.00 O ATOM 168 OE2 GLU A 121 124.872 16.200 10.124 1.00 0.00 O ATOM 0 H GLU A 121 123.193 13.725 8.494 1.00 0.00 H new ATOM 0 HA GLU A 121 123.348 12.048 10.786 1.00 0.00 H new ATOM 0 HB2 GLU A 121 121.841 14.590 10.095 1.00 0.00 H new ATOM 0 HB3 GLU A 121 121.621 13.795 11.641 1.00 0.00 H new ATOM 0 HG2 GLU A 121 123.253 15.570 11.873 1.00 0.00 H new ATOM 0 HG3 GLU A 121 124.039 14.022 12.114 1.00 0.00 H new ATOM 175 N VAL A 122 120.655 11.830 8.971 1.00 0.00 N ATOM 176 CA VAL A 122 119.406 11.095 8.783 1.00 0.00 C ATOM 177 C VAL A 122 119.586 9.806 7.961 1.00 0.00 C ATOM 178 O VAL A 122 119.033 8.774 8.345 1.00 0.00 O ATOM 179 CB VAL A 122 118.318 12.013 8.181 1.00 0.00 C ATOM 180 CG1 VAL A 122 118.773 12.604 6.854 1.00 0.00 C ATOM 181 CG2 VAL A 122 116.989 11.280 8.036 1.00 0.00 C ATOM 0 H VAL A 122 120.933 12.396 8.169 1.00 0.00 H new ATOM 0 HA VAL A 122 119.074 10.773 9.770 1.00 0.00 H new ATOM 0 HB VAL A 122 118.160 12.838 8.875 1.00 0.00 H new ATOM 0 HG11 VAL A 122 117.988 13.245 6.453 1.00 0.00 H new ATOM 0 HG12 VAL A 122 119.678 13.191 7.009 1.00 0.00 H new ATOM 0 HG13 VAL A 122 118.979 11.799 6.149 1.00 0.00 H new ATOM 0 HG21 VAL A 122 116.246 11.954 7.610 1.00 0.00 H new ATOM 0 HG22 VAL A 122 117.118 10.420 7.379 1.00 0.00 H new ATOM 0 HG23 VAL A 122 116.652 10.941 9.015 1.00 0.00 H new ATOM 191 N PHE A 123 120.353 9.814 6.865 1.00 0.00 N ATOM 192 CA PHE A 123 120.553 8.572 6.090 1.00 0.00 C ATOM 193 C PHE A 123 121.977 8.056 6.247 1.00 0.00 C ATOM 194 O PHE A 123 122.208 6.856 6.397 1.00 0.00 O ATOM 195 CB PHE A 123 120.287 8.798 4.606 1.00 0.00 C ATOM 196 CG PHE A 123 118.979 9.458 4.320 1.00 0.00 C ATOM 197 CD1 PHE A 123 117.828 8.708 4.177 1.00 0.00 C ATOM 198 CD2 PHE A 123 118.902 10.830 4.211 1.00 0.00 C ATOM 199 CE1 PHE A 123 116.616 9.319 3.924 1.00 0.00 C ATOM 200 CE2 PHE A 123 117.695 11.451 3.958 1.00 0.00 C ATOM 201 CZ PHE A 123 116.550 10.693 3.815 1.00 0.00 C ATOM 0 H PHE A 123 120.834 10.635 6.499 1.00 0.00 H new ATOM 0 HA PHE A 123 119.847 7.839 6.480 1.00 0.00 H new ATOM 0 HB2 PHE A 123 121.089 9.409 4.192 1.00 0.00 H new ATOM 0 HB3 PHE A 123 120.319 7.838 4.091 1.00 0.00 H new ATOM 0 HD1 PHE A 123 117.877 7.633 4.264 1.00 0.00 H new ATOM 0 HD2 PHE A 123 119.796 11.426 4.325 1.00 0.00 H new ATOM 0 HE1 PHE A 123 115.722 8.723 3.812 1.00 0.00 H new ATOM 0 HE2 PHE A 123 117.647 12.527 3.872 1.00 0.00 H new ATOM 0 HZ PHE A 123 115.604 11.175 3.618 1.00 0.00 H new ATOM 211 N GLY A 124 122.921 8.981 6.225 1.00 0.00 N ATOM 212 CA GLY A 124 124.316 8.620 6.383 1.00 0.00 C ATOM 213 C GLY A 124 124.991 8.133 5.105 1.00 0.00 C ATOM 214 O GLY A 124 125.321 6.954 4.997 1.00 0.00 O ATOM 0 H GLY A 124 122.748 9.978 6.100 1.00 0.00 H new ATOM 0 HA2 GLY A 124 124.862 9.485 6.760 1.00 0.00 H new ATOM 0 HA3 GLY A 124 124.393 7.839 7.140 1.00 0.00 H new ATOM 218 N ASP A 125 125.227 9.054 4.163 1.00 0.00 N ATOM 219 CA ASP A 125 125.913 8.748 2.894 1.00 0.00 C ATOM 220 C ASP A 125 124.962 8.688 1.700 1.00 0.00 C ATOM 221 O ASP A 125 125.346 8.219 0.628 1.00 0.00 O ATOM 222 CB ASP A 125 126.709 7.439 2.975 1.00 0.00 C ATOM 223 CG ASP A 125 127.651 7.270 1.799 1.00 0.00 C ATOM 224 OD1 ASP A 125 128.541 8.128 1.622 1.00 0.00 O ATOM 225 OD2 ASP A 125 127.499 6.280 1.053 1.00 0.00 O ATOM 0 H ASP A 125 124.950 10.031 4.255 1.00 0.00 H new ATOM 0 HA ASP A 125 126.602 9.578 2.734 1.00 0.00 H new ATOM 0 HB2 ASP A 125 127.281 7.420 3.903 1.00 0.00 H new ATOM 0 HB3 ASP A 125 126.018 6.597 3.009 1.00 0.00 H new ATOM 230 N PHE A 126 123.731 9.157 1.873 1.00 0.00 N ATOM 231 CA PHE A 126 122.752 9.144 0.784 1.00 0.00 C ATOM 232 C PHE A 126 122.361 10.562 0.372 1.00 0.00 C ATOM 233 O PHE A 126 121.832 11.337 1.168 1.00 0.00 O ATOM 234 CB PHE A 126 121.518 8.346 1.202 1.00 0.00 C ATOM 235 CG PHE A 126 120.262 8.745 0.487 1.00 0.00 C ATOM 236 CD1 PHE A 126 119.495 9.793 0.965 1.00 0.00 C ATOM 237 CD2 PHE A 126 119.851 8.082 -0.656 1.00 0.00 C ATOM 238 CE1 PHE A 126 118.338 10.176 0.320 1.00 0.00 C ATOM 239 CE2 PHE A 126 118.692 8.457 -1.308 1.00 0.00 C ATOM 240 CZ PHE A 126 117.934 9.507 -0.818 1.00 0.00 C ATOM 0 H PHE A 126 123.386 9.549 2.749 1.00 0.00 H new ATOM 0 HA PHE A 126 123.209 8.664 -0.081 1.00 0.00 H new ATOM 0 HB2 PHE A 126 121.705 7.287 1.023 1.00 0.00 H new ATOM 0 HB3 PHE A 126 121.367 8.466 2.275 1.00 0.00 H new ATOM 0 HD1 PHE A 126 119.807 10.318 1.856 1.00 0.00 H new ATOM 0 HD2 PHE A 126 120.441 7.264 -1.042 1.00 0.00 H new ATOM 0 HE1 PHE A 126 117.750 10.997 0.704 1.00 0.00 H new ATOM 0 HE2 PHE A 126 118.378 7.932 -2.198 1.00 0.00 H new ATOM 0 HZ PHE A 126 117.028 9.802 -1.326 1.00 0.00 H new ATOM 250 N ASP A 127 122.630 10.880 -0.892 1.00 0.00 N ATOM 251 CA ASP A 127 122.324 12.188 -1.462 1.00 0.00 C ATOM 252 C ASP A 127 121.239 12.056 -2.538 1.00 0.00 C ATOM 253 O ASP A 127 121.496 11.511 -3.608 1.00 0.00 O ATOM 254 CB ASP A 127 123.595 12.782 -2.073 1.00 0.00 C ATOM 255 CG ASP A 127 123.379 14.178 -2.626 1.00 0.00 C ATOM 256 OD1 ASP A 127 122.931 15.055 -1.861 1.00 0.00 O ATOM 257 OD2 ASP A 127 123.667 14.397 -3.821 1.00 0.00 O ATOM 0 H ASP A 127 123.067 10.236 -1.551 1.00 0.00 H new ATOM 0 HA ASP A 127 121.955 12.846 -0.675 1.00 0.00 H new ATOM 0 HB2 ASP A 127 124.378 12.812 -1.315 1.00 0.00 H new ATOM 0 HB3 ASP A 127 123.949 12.130 -2.871 1.00 0.00 H new ATOM 262 N PRO A 128 120.006 12.526 -2.279 1.00 0.00 N ATOM 263 CA PRO A 128 118.911 12.411 -3.253 1.00 0.00 C ATOM 264 C PRO A 128 119.093 13.288 -4.488 1.00 0.00 C ATOM 265 O PRO A 128 118.582 12.961 -5.557 1.00 0.00 O ATOM 266 CB PRO A 128 117.675 12.844 -2.457 1.00 0.00 C ATOM 267 CG PRO A 128 118.204 13.716 -1.371 1.00 0.00 C ATOM 268 CD PRO A 128 119.570 13.182 -1.030 1.00 0.00 C ATOM 0 HA PRO A 128 118.849 11.400 -3.655 1.00 0.00 H new ATOM 0 HB2 PRO A 128 116.968 13.383 -3.088 1.00 0.00 H new ATOM 0 HB3 PRO A 128 117.146 11.983 -2.049 1.00 0.00 H new ATOM 0 HG2 PRO A 128 118.263 14.754 -1.699 1.00 0.00 H new ATOM 0 HG3 PRO A 128 117.549 13.694 -0.500 1.00 0.00 H new ATOM 0 HD2 PRO A 128 120.251 13.981 -0.737 1.00 0.00 H new ATOM 0 HD3 PRO A 128 119.529 12.477 -0.200 1.00 0.00 H new ATOM 276 N ASP A 129 119.800 14.406 -4.349 1.00 0.00 N ATOM 277 CA ASP A 129 119.998 15.300 -5.484 1.00 0.00 C ATOM 278 C ASP A 129 120.729 14.595 -6.625 1.00 0.00 C ATOM 279 O ASP A 129 120.250 14.580 -7.758 1.00 0.00 O ATOM 280 CB ASP A 129 120.777 16.544 -5.053 1.00 0.00 C ATOM 281 CG ASP A 129 121.006 17.509 -6.199 1.00 0.00 C ATOM 282 OD1 ASP A 129 121.645 17.108 -7.194 1.00 0.00 O ATOM 283 OD2 ASP A 129 120.546 18.666 -6.102 1.00 0.00 O ATOM 0 H ASP A 129 120.238 14.710 -3.479 1.00 0.00 H new ATOM 0 HA ASP A 129 119.015 15.602 -5.845 1.00 0.00 H new ATOM 0 HB2 ASP A 129 120.233 17.052 -4.257 1.00 0.00 H new ATOM 0 HB3 ASP A 129 121.739 16.242 -4.639 1.00 0.00 H new ATOM 288 N GLN A 130 121.894 14.027 -6.333 1.00 0.00 N ATOM 289 CA GLN A 130 122.668 13.346 -7.364 1.00 0.00 C ATOM 290 C GLN A 130 121.888 12.178 -7.964 1.00 0.00 C ATOM 291 O GLN A 130 122.087 11.836 -9.129 1.00 0.00 O ATOM 292 CB GLN A 130 124.032 12.900 -6.833 1.00 0.00 C ATOM 293 CG GLN A 130 123.974 12.095 -5.551 1.00 0.00 C ATOM 294 CD GLN A 130 123.661 10.635 -5.777 1.00 0.00 C ATOM 295 OE1 GLN A 130 124.146 10.020 -6.728 1.00 0.00 O ATOM 296 NE2 GLN A 130 122.880 10.061 -4.875 1.00 0.00 N ATOM 0 H GLN A 130 122.318 14.024 -5.405 1.00 0.00 H new ATOM 0 HA GLN A 130 122.850 14.061 -8.166 1.00 0.00 H new ATOM 0 HB2 GLN A 130 124.529 12.305 -7.599 1.00 0.00 H new ATOM 0 HB3 GLN A 130 124.649 13.783 -6.665 1.00 0.00 H new ATOM 0 HG2 GLN A 130 124.930 12.179 -5.034 1.00 0.00 H new ATOM 0 HG3 GLN A 130 123.217 12.524 -4.894 1.00 0.00 H new ATOM 0 HE21 GLN A 130 122.501 10.611 -4.104 1.00 0.00 H new ATOM 0 HE22 GLN A 130 122.657 9.069 -4.951 1.00 0.00 H new ATOM 305 N TYR A 131 120.972 11.587 -7.193 1.00 0.00 N ATOM 306 CA TYR A 131 120.146 10.493 -7.700 1.00 0.00 C ATOM 307 C TYR A 131 118.864 11.054 -8.299 1.00 0.00 C ATOM 308 O TYR A 131 118.211 10.399 -9.111 1.00 0.00 O ATOM 309 CB TYR A 131 119.777 9.501 -6.587 1.00 0.00 C ATOM 310 CG TYR A 131 120.932 8.703 -6.012 1.00 0.00 C ATOM 311 CD1 TYR A 131 122.067 8.404 -6.764 1.00 0.00 C ATOM 312 CD2 TYR A 131 120.870 8.224 -4.707 1.00 0.00 C ATOM 313 CE1 TYR A 131 123.102 7.659 -6.228 1.00 0.00 C ATOM 314 CE2 TYR A 131 121.898 7.479 -4.168 1.00 0.00 C ATOM 315 CZ TYR A 131 123.012 7.199 -4.930 1.00 0.00 C ATOM 316 OH TYR A 131 124.039 6.456 -4.395 1.00 0.00 O ATOM 0 H TYR A 131 120.786 11.846 -6.224 1.00 0.00 H new ATOM 0 HA TYR A 131 120.725 9.966 -8.459 1.00 0.00 H new ATOM 0 HB2 TYR A 131 119.301 10.052 -5.776 1.00 0.00 H new ATOM 0 HB3 TYR A 131 119.036 8.804 -6.977 1.00 0.00 H new ATOM 0 HD1 TYR A 131 122.139 8.760 -7.781 1.00 0.00 H new ATOM 0 HD2 TYR A 131 120.000 8.440 -4.105 1.00 0.00 H new ATOM 0 HE1 TYR A 131 123.976 7.438 -6.822 1.00 0.00 H new ATOM 0 HE2 TYR A 131 121.830 7.116 -3.153 1.00 0.00 H new ATOM 0 HH TYR A 131 123.819 6.211 -3.472 1.00 0.00 H new ATOM 326 N GLU A 132 118.508 12.278 -7.904 1.00 0.00 N ATOM 327 CA GLU A 132 117.305 12.911 -8.427 1.00 0.00 C ATOM 328 C GLU A 132 117.388 12.956 -9.943 1.00 0.00 C ATOM 329 O GLU A 132 116.437 12.620 -10.649 1.00 0.00 O ATOM 330 CB GLU A 132 117.130 14.321 -7.856 1.00 0.00 C ATOM 331 CG GLU A 132 115.900 15.048 -8.379 1.00 0.00 C ATOM 332 CD GLU A 132 114.603 14.348 -8.017 1.00 0.00 C ATOM 333 OE1 GLU A 132 114.398 13.202 -8.467 1.00 0.00 O ATOM 334 OE2 GLU A 132 113.791 14.950 -7.282 1.00 0.00 O ATOM 0 H GLU A 132 119.030 12.841 -7.233 1.00 0.00 H new ATOM 0 HA GLU A 132 116.436 12.326 -8.125 1.00 0.00 H new ATOM 0 HB2 GLU A 132 117.068 14.258 -6.770 1.00 0.00 H new ATOM 0 HB3 GLU A 132 118.016 14.911 -8.091 1.00 0.00 H new ATOM 0 HG2 GLU A 132 115.885 16.061 -7.977 1.00 0.00 H new ATOM 0 HG3 GLU A 132 115.969 15.136 -9.463 1.00 0.00 H new ATOM 341 N GLU A 133 118.551 13.358 -10.431 1.00 0.00 N ATOM 342 CA GLU A 133 118.810 13.438 -11.857 1.00 0.00 C ATOM 343 C GLU A 133 118.786 12.051 -12.493 1.00 0.00 C ATOM 344 O GLU A 133 118.234 11.856 -13.576 1.00 0.00 O ATOM 345 CB GLU A 133 120.178 14.078 -12.087 1.00 0.00 C ATOM 346 CG GLU A 133 121.288 13.469 -11.246 1.00 0.00 C ATOM 347 CD GLU A 133 122.637 14.108 -11.511 1.00 0.00 C ATOM 348 OE1 GLU A 133 122.767 15.331 -11.295 1.00 0.00 O ATOM 349 OE2 GLU A 133 123.565 13.386 -11.933 1.00 0.00 O ATOM 0 H GLU A 133 119.340 13.637 -9.849 1.00 0.00 H new ATOM 0 HA GLU A 133 118.030 14.044 -12.318 1.00 0.00 H new ATOM 0 HB2 GLU A 133 120.440 13.985 -13.141 1.00 0.00 H new ATOM 0 HB3 GLU A 133 120.112 15.144 -11.868 1.00 0.00 H new ATOM 0 HG2 GLU A 133 121.040 13.577 -10.190 1.00 0.00 H new ATOM 0 HG3 GLU A 133 121.350 12.400 -11.451 1.00 0.00 H new ATOM 356 N GLU A 134 119.423 11.100 -11.815 1.00 0.00 N ATOM 357 CA GLU A 134 119.519 9.730 -12.305 1.00 0.00 C ATOM 358 C GLU A 134 118.147 9.090 -12.496 1.00 0.00 C ATOM 359 O GLU A 134 117.929 8.367 -13.468 1.00 0.00 O ATOM 360 CB GLU A 134 120.360 8.886 -11.346 1.00 0.00 C ATOM 361 CG GLU A 134 120.538 7.445 -11.798 1.00 0.00 C ATOM 362 CD GLU A 134 121.228 7.339 -13.144 1.00 0.00 C ATOM 363 OE1 GLU A 134 122.376 7.816 -13.262 1.00 0.00 O ATOM 364 OE2 GLU A 134 120.619 6.780 -14.081 1.00 0.00 O ATOM 0 H GLU A 134 119.883 11.256 -10.918 1.00 0.00 H new ATOM 0 HA GLU A 134 120.003 9.767 -13.281 1.00 0.00 H new ATOM 0 HB2 GLU A 134 121.342 9.347 -11.235 1.00 0.00 H new ATOM 0 HB3 GLU A 134 119.891 8.894 -10.362 1.00 0.00 H new ATOM 0 HG2 GLU A 134 121.119 6.903 -11.052 1.00 0.00 H new ATOM 0 HG3 GLU A 134 119.562 6.962 -11.855 1.00 0.00 H new ATOM 371 N VAL A 135 117.222 9.350 -11.574 1.00 0.00 N ATOM 372 CA VAL A 135 115.882 8.781 -11.673 1.00 0.00 C ATOM 373 C VAL A 135 115.089 9.453 -12.782 1.00 0.00 C ATOM 374 O VAL A 135 114.242 8.830 -13.423 1.00 0.00 O ATOM 375 CB VAL A 135 115.089 8.854 -10.345 1.00 0.00 C ATOM 376 CG1 VAL A 135 115.742 7.987 -9.279 1.00 0.00 C ATOM 377 CG2 VAL A 135 114.953 10.283 -9.852 1.00 0.00 C ATOM 0 H VAL A 135 117.374 9.944 -10.759 1.00 0.00 H new ATOM 0 HA VAL A 135 116.021 7.726 -11.908 1.00 0.00 H new ATOM 0 HB VAL A 135 114.087 8.472 -10.542 1.00 0.00 H new ATOM 0 HG11 VAL A 135 115.168 8.053 -8.354 1.00 0.00 H new ATOM 0 HG12 VAL A 135 115.767 6.951 -9.617 1.00 0.00 H new ATOM 0 HG13 VAL A 135 116.760 8.335 -9.100 1.00 0.00 H new ATOM 0 HG21 VAL A 135 114.391 10.294 -8.918 1.00 0.00 H new ATOM 0 HG22 VAL A 135 115.944 10.706 -9.684 1.00 0.00 H new ATOM 0 HG23 VAL A 135 114.427 10.877 -10.599 1.00 0.00 H new ATOM 387 N ARG A 136 115.361 10.733 -12.994 1.00 0.00 N ATOM 388 CA ARG A 136 114.662 11.497 -14.018 1.00 0.00 C ATOM 389 C ARG A 136 114.897 10.916 -15.416 1.00 0.00 C ATOM 390 O ARG A 136 113.965 10.773 -16.190 1.00 0.00 O ATOM 391 CB ARG A 136 115.078 12.971 -13.967 1.00 0.00 C ATOM 392 CG ARG A 136 114.480 13.830 -15.074 1.00 0.00 C ATOM 393 CD ARG A 136 112.964 13.900 -14.983 1.00 0.00 C ATOM 394 NE ARG A 136 112.516 14.402 -13.687 1.00 0.00 N ATOM 395 CZ ARG A 136 111.237 14.557 -13.361 1.00 0.00 C ATOM 396 NH1 ARG A 136 110.287 14.253 -14.233 1.00 0.00 N ATOM 397 NH2 ARG A 136 110.909 15.017 -12.162 1.00 0.00 N ATOM 0 H ARG A 136 116.059 11.263 -12.472 1.00 0.00 H new ATOM 0 HA ARG A 136 113.594 11.429 -13.810 1.00 0.00 H new ATOM 0 HB2 ARG A 136 114.785 13.386 -13.003 1.00 0.00 H new ATOM 0 HB3 ARG A 136 116.165 13.032 -14.023 1.00 0.00 H new ATOM 0 HG2 ARG A 136 114.894 14.837 -15.016 1.00 0.00 H new ATOM 0 HG3 ARG A 136 114.767 13.423 -16.044 1.00 0.00 H new ATOM 0 HD2 ARG A 136 112.583 14.546 -15.774 1.00 0.00 H new ATOM 0 HD3 ARG A 136 112.545 12.908 -15.152 1.00 0.00 H new ATOM 0 HE ARG A 136 113.223 14.647 -12.994 1.00 0.00 H new ATOM 0 HH11 ARG A 136 110.537 13.899 -15.157 1.00 0.00 H new ATOM 0 HH12 ARG A 136 109.306 14.373 -13.981 1.00 0.00 H new ATOM 0 HH21 ARG A 136 111.638 15.252 -11.489 1.00 0.00 H new ATOM 0 HH22 ARG A 136 109.927 15.136 -11.912 1.00 0.00 H new ATOM 411 N GLU A 137 116.137 10.618 -15.762 1.00 0.00 N ATOM 412 CA GLU A 137 116.438 10.091 -17.095 1.00 0.00 C ATOM 413 C GLU A 137 115.967 8.640 -17.279 1.00 0.00 C ATOM 414 O GLU A 137 115.257 8.324 -18.234 1.00 0.00 O ATOM 415 CB GLU A 137 117.940 10.184 -17.369 1.00 0.00 C ATOM 416 CG GLU A 137 118.342 9.683 -18.746 1.00 0.00 C ATOM 417 CD GLU A 137 119.833 9.801 -18.996 1.00 0.00 C ATOM 418 OE1 GLU A 137 120.550 10.276 -18.091 1.00 0.00 O ATOM 419 OE2 GLU A 137 120.282 9.420 -20.097 1.00 0.00 O ATOM 0 H GLU A 137 116.947 10.728 -15.152 1.00 0.00 H new ATOM 0 HA GLU A 137 115.888 10.703 -17.810 1.00 0.00 H new ATOM 0 HB2 GLU A 137 118.256 11.222 -17.263 1.00 0.00 H new ATOM 0 HB3 GLU A 137 118.475 9.609 -16.613 1.00 0.00 H new ATOM 0 HG2 GLU A 137 118.041 8.641 -18.852 1.00 0.00 H new ATOM 0 HG3 GLU A 137 117.804 10.249 -19.506 1.00 0.00 H new ATOM 426 N ARG A 138 116.407 7.763 -16.387 1.00 0.00 N ATOM 427 CA ARG A 138 116.070 6.338 -16.482 1.00 0.00 C ATOM 428 C ARG A 138 114.556 6.084 -16.554 1.00 0.00 C ATOM 429 O ARG A 138 114.082 5.464 -17.506 1.00 0.00 O ATOM 430 CB ARG A 138 116.693 5.546 -15.333 1.00 0.00 C ATOM 431 CG ARG A 138 116.145 5.895 -13.967 1.00 0.00 C ATOM 432 CD ARG A 138 116.976 5.243 -12.874 1.00 0.00 C ATOM 433 NE ARG A 138 117.025 3.791 -13.026 1.00 0.00 N ATOM 434 CZ ARG A 138 117.846 3.004 -12.338 1.00 0.00 C ATOM 435 NH1 ARG A 138 118.714 3.530 -11.486 1.00 0.00 N ATOM 436 NH2 ARG A 138 117.810 1.690 -12.514 1.00 0.00 N ATOM 0 H ARG A 138 116.996 8.006 -15.590 1.00 0.00 H new ATOM 0 HA ARG A 138 116.495 5.987 -17.422 1.00 0.00 H new ATOM 0 HB2 ARG A 138 116.536 4.483 -15.513 1.00 0.00 H new ATOM 0 HB3 ARG A 138 117.770 5.714 -15.333 1.00 0.00 H new ATOM 0 HG2 ARG A 138 116.145 6.977 -13.835 1.00 0.00 H new ATOM 0 HG3 ARG A 138 115.109 5.565 -13.890 1.00 0.00 H new ATOM 0 HD2 ARG A 138 117.989 5.646 -12.898 1.00 0.00 H new ATOM 0 HD3 ARG A 138 116.556 5.493 -11.900 1.00 0.00 H new ATOM 0 HE ARG A 138 116.393 3.356 -13.698 1.00 0.00 H new ATOM 0 HH11 ARG A 138 118.753 4.541 -11.357 1.00 0.00 H new ATOM 0 HH12 ARG A 138 119.343 2.924 -10.959 1.00 0.00 H new ATOM 0 HH21 ARG A 138 117.152 1.282 -13.178 1.00 0.00 H new ATOM 0 HH22 ARG A 138 118.441 1.087 -11.985 1.00 0.00 H new ATOM 450 N TRP A 139 113.794 6.548 -15.559 1.00 0.00 N ATOM 451 CA TRP A 139 112.338 6.337 -15.553 1.00 0.00 C ATOM 452 C TRP A 139 111.599 7.588 -16.039 1.00 0.00 C ATOM 453 O TRP A 139 110.544 7.504 -16.665 1.00 0.00 O ATOM 454 CB TRP A 139 111.880 5.965 -14.137 1.00 0.00 C ATOM 455 CG TRP A 139 112.528 4.712 -13.615 1.00 0.00 C ATOM 456 CD1 TRP A 139 112.538 3.486 -14.220 1.00 0.00 C ATOM 457 CD2 TRP A 139 113.253 4.554 -12.384 1.00 0.00 C ATOM 458 NE1 TRP A 139 113.228 2.582 -13.449 1.00 0.00 N ATOM 459 CE2 TRP A 139 113.676 3.211 -12.317 1.00 0.00 C ATOM 460 CE3 TRP A 139 113.590 5.414 -11.333 1.00 0.00 C ATOM 461 CZ2 TRP A 139 114.415 2.712 -11.243 1.00 0.00 C ATOM 462 CZ3 TRP A 139 114.323 4.914 -10.269 1.00 0.00 C ATOM 463 CH2 TRP A 139 114.728 3.576 -10.233 1.00 0.00 C ATOM 0 H TRP A 139 114.152 7.066 -14.756 1.00 0.00 H new ATOM 0 HA TRP A 139 112.101 5.522 -16.237 1.00 0.00 H new ATOM 0 HB2 TRP A 139 112.103 6.791 -13.461 1.00 0.00 H new ATOM 0 HB3 TRP A 139 110.798 5.835 -14.135 1.00 0.00 H new ATOM 0 HD1 TRP A 139 112.071 3.261 -15.167 1.00 0.00 H new ATOM 0 HE1 TRP A 139 113.382 1.601 -13.682 1.00 0.00 H new ATOM 0 HE3 TRP A 139 113.284 6.450 -11.351 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 114.728 1.679 -11.212 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 114.586 5.570 -9.452 1.00 0.00 H new ATOM 0 HH2 TRP A 139 115.300 3.219 -9.389 1.00 0.00 H new ATOM 474 N GLY A 140 112.206 8.730 -15.771 1.00 0.00 N ATOM 475 CA GLY A 140 111.686 10.025 -16.197 1.00 0.00 C ATOM 476 C GLY A 140 110.202 10.088 -16.526 1.00 0.00 C ATOM 477 O GLY A 140 109.830 10.790 -17.464 1.00 0.00 O ATOM 0 H GLY A 140 113.080 8.790 -15.248 1.00 0.00 H new ATOM 0 HA2 GLY A 140 111.892 10.750 -15.410 1.00 0.00 H new ATOM 0 HA3 GLY A 140 112.244 10.343 -17.078 1.00 0.00 H new ATOM 481 N ASN A 141 109.345 9.400 -15.779 1.00 0.00 N ATOM 482 CA ASN A 141 107.904 9.460 -16.062 1.00 0.00 C ATOM 483 C ASN A 141 107.098 8.374 -15.357 1.00 0.00 C ATOM 484 O ASN A 141 105.978 8.076 -15.773 1.00 0.00 O ATOM 485 CB ASN A 141 107.625 9.398 -17.572 1.00 0.00 C ATOM 486 CG ASN A 141 108.403 8.306 -18.281 1.00 0.00 C ATOM 487 OD1 ASN A 141 109.620 8.398 -18.439 1.00 0.00 O ATOM 488 ND2 ASN A 141 107.701 7.264 -18.711 1.00 0.00 N ATOM 0 H ASN A 141 109.607 8.807 -14.991 1.00 0.00 H new ATOM 0 HA ASN A 141 107.576 10.421 -15.665 1.00 0.00 H new ATOM 0 HB2 ASN A 141 106.559 9.237 -17.731 1.00 0.00 H new ATOM 0 HB3 ASN A 141 107.872 10.360 -18.020 1.00 0.00 H new ATOM 0 HD21 ASN A 141 108.170 6.498 -19.194 1.00 0.00 H new ATOM 0 HD22 ASN A 141 106.693 7.230 -18.558 1.00 0.00 H new ATOM 495 N THR A 142 107.624 7.791 -14.286 1.00 0.00 N ATOM 496 CA THR A 142 106.868 6.770 -13.570 1.00 0.00 C ATOM 497 C THR A 142 105.952 7.429 -12.539 1.00 0.00 C ATOM 498 O THR A 142 106.282 8.477 -11.985 1.00 0.00 O ATOM 499 CB THR A 142 107.814 5.771 -12.901 1.00 0.00 C ATOM 500 OG1 THR A 142 107.091 4.856 -12.097 1.00 0.00 O ATOM 501 CG2 THR A 142 108.864 6.428 -12.027 1.00 0.00 C ATOM 0 H THR A 142 108.546 8.000 -13.902 1.00 0.00 H new ATOM 0 HA THR A 142 106.251 6.221 -14.282 1.00 0.00 H new ATOM 0 HB THR A 142 108.320 5.260 -13.721 1.00 0.00 H new ATOM 0 HG1 THR A 142 107.713 4.225 -11.679 1.00 0.00 H new ATOM 0 HG21 THR A 142 109.500 5.662 -11.584 1.00 0.00 H new ATOM 0 HG22 THR A 142 109.473 7.100 -12.632 1.00 0.00 H new ATOM 0 HG23 THR A 142 108.375 6.996 -11.235 1.00 0.00 H new ATOM 509 N ASP A 143 104.789 6.827 -12.312 1.00 0.00 N ATOM 510 CA ASP A 143 103.813 7.384 -11.376 1.00 0.00 C ATOM 511 C ASP A 143 104.364 7.457 -9.955 1.00 0.00 C ATOM 512 O ASP A 143 104.274 8.497 -9.306 1.00 0.00 O ATOM 513 CB ASP A 143 102.510 6.583 -11.405 1.00 0.00 C ATOM 514 CG ASP A 143 101.868 6.573 -12.778 1.00 0.00 C ATOM 515 OD1 ASP A 143 102.518 6.097 -13.733 1.00 0.00 O ATOM 516 OD2 ASP A 143 100.716 7.039 -12.898 1.00 0.00 O ATOM 0 H ASP A 143 104.498 5.958 -12.760 1.00 0.00 H new ATOM 0 HA ASP A 143 103.603 8.403 -11.700 1.00 0.00 H new ATOM 0 HB2 ASP A 143 102.710 5.558 -11.093 1.00 0.00 H new ATOM 0 HB3 ASP A 143 101.811 7.005 -10.683 1.00 0.00 H new ATOM 521 N ALA A 144 104.923 6.360 -9.466 1.00 0.00 N ATOM 522 CA ALA A 144 105.462 6.327 -8.114 1.00 0.00 C ATOM 523 C ALA A 144 106.375 7.525 -7.858 1.00 0.00 C ATOM 524 O ALA A 144 106.210 8.251 -6.879 1.00 0.00 O ATOM 525 CB ALA A 144 106.228 5.028 -7.906 1.00 0.00 C ATOM 0 H ALA A 144 105.015 5.485 -9.982 1.00 0.00 H new ATOM 0 HA ALA A 144 104.634 6.380 -7.407 1.00 0.00 H new ATOM 0 HB1 ALA A 144 106.632 5.002 -6.894 1.00 0.00 H new ATOM 0 HB2 ALA A 144 105.556 4.182 -8.050 1.00 0.00 H new ATOM 0 HB3 ALA A 144 107.045 4.968 -8.625 1.00 0.00 H new ATOM 531 N TYR A 145 107.334 7.726 -8.751 1.00 0.00 N ATOM 532 CA TYR A 145 108.277 8.833 -8.635 1.00 0.00 C ATOM 533 C TYR A 145 107.557 10.171 -8.460 1.00 0.00 C ATOM 534 O TYR A 145 107.937 10.989 -7.623 1.00 0.00 O ATOM 535 CB TYR A 145 109.152 8.893 -9.885 1.00 0.00 C ATOM 536 CG TYR A 145 110.080 10.088 -9.951 1.00 0.00 C ATOM 537 CD1 TYR A 145 110.504 10.751 -8.802 1.00 0.00 C ATOM 538 CD2 TYR A 145 110.540 10.548 -11.177 1.00 0.00 C ATOM 539 CE1 TYR A 145 111.355 11.836 -8.879 1.00 0.00 C ATOM 540 CE2 TYR A 145 111.390 11.632 -11.261 1.00 0.00 C ATOM 541 CZ TYR A 145 111.795 12.273 -10.110 1.00 0.00 C ATOM 542 OH TYR A 145 112.641 13.354 -10.191 1.00 0.00 O ATOM 0 H TYR A 145 107.481 7.134 -9.569 1.00 0.00 H new ATOM 0 HA TYR A 145 108.891 8.658 -7.751 1.00 0.00 H new ATOM 0 HB2 TYR A 145 109.749 7.983 -9.938 1.00 0.00 H new ATOM 0 HB3 TYR A 145 108.507 8.902 -10.764 1.00 0.00 H new ATOM 0 HD1 TYR A 145 110.162 10.411 -7.836 1.00 0.00 H new ATOM 0 HD2 TYR A 145 110.227 10.048 -12.082 1.00 0.00 H new ATOM 0 HE1 TYR A 145 111.674 12.340 -7.979 1.00 0.00 H new ATOM 0 HE2 TYR A 145 111.736 11.976 -12.224 1.00 0.00 H new ATOM 0 HH TYR A 145 113.524 13.105 -9.845 1.00 0.00 H new ATOM 552 N ARG A 146 106.535 10.395 -9.276 1.00 0.00 N ATOM 553 CA ARG A 146 105.779 11.644 -9.242 1.00 0.00 C ATOM 554 C ARG A 146 105.231 11.968 -7.853 1.00 0.00 C ATOM 555 O ARG A 146 105.166 13.139 -7.474 1.00 0.00 O ATOM 556 CB ARG A 146 104.645 11.601 -10.264 1.00 0.00 C ATOM 557 CG ARG A 146 105.136 11.580 -11.702 1.00 0.00 C ATOM 558 CD ARG A 146 103.979 11.518 -12.686 1.00 0.00 C ATOM 559 NE ARG A 146 104.438 11.493 -14.073 1.00 0.00 N ATOM 560 CZ ARG A 146 105.100 12.490 -14.650 1.00 0.00 C ATOM 561 NH1 ARG A 146 105.363 13.598 -13.970 1.00 0.00 N ATOM 562 NH2 ARG A 146 105.495 12.383 -15.911 1.00 0.00 N ATOM 0 H ARG A 146 106.208 9.726 -9.973 1.00 0.00 H new ATOM 0 HA ARG A 146 106.474 12.443 -9.500 1.00 0.00 H new ATOM 0 HB2 ARG A 146 104.034 10.717 -10.082 1.00 0.00 H new ATOM 0 HB3 ARG A 146 104.001 12.468 -10.119 1.00 0.00 H new ATOM 0 HG2 ARG A 146 105.733 12.471 -11.897 1.00 0.00 H new ATOM 0 HG3 ARG A 146 105.789 10.720 -11.852 1.00 0.00 H new ATOM 0 HD2 ARG A 146 103.381 10.629 -12.486 1.00 0.00 H new ATOM 0 HD3 ARG A 146 103.329 12.380 -12.535 1.00 0.00 H new ATOM 0 HE ARG A 146 104.239 10.662 -14.630 1.00 0.00 H new ATOM 0 HH11 ARG A 146 105.057 13.687 -13.001 1.00 0.00 H new ATOM 0 HH12 ARG A 146 105.871 14.362 -14.416 1.00 0.00 H new ATOM 0 HH21 ARG A 146 105.291 11.535 -16.439 1.00 0.00 H new ATOM 0 HH22 ARG A 146 106.003 13.149 -16.353 1.00 0.00 H new ATOM 576 N GLN A 147 104.841 10.952 -7.086 1.00 0.00 N ATOM 577 CA GLN A 147 104.314 11.202 -5.744 1.00 0.00 C ATOM 578 C GLN A 147 105.425 11.643 -4.796 1.00 0.00 C ATOM 579 O GLN A 147 105.217 12.509 -3.951 1.00 0.00 O ATOM 580 CB GLN A 147 103.577 9.987 -5.182 1.00 0.00 C ATOM 581 CG GLN A 147 102.090 9.954 -5.511 1.00 0.00 C ATOM 582 CD GLN A 147 101.803 9.692 -6.977 1.00 0.00 C ATOM 583 OE1 GLN A 147 100.660 9.792 -7.423 1.00 0.00 O ATOM 584 NE2 GLN A 147 102.833 9.334 -7.730 1.00 0.00 N ATOM 0 H GLN A 147 104.877 9.970 -7.360 1.00 0.00 H new ATOM 0 HA GLN A 147 103.589 12.011 -5.830 1.00 0.00 H new ATOM 0 HB2 GLN A 147 104.044 9.081 -5.569 1.00 0.00 H new ATOM 0 HB3 GLN A 147 103.699 9.971 -4.099 1.00 0.00 H new ATOM 0 HG2 GLN A 147 101.610 9.181 -4.911 1.00 0.00 H new ATOM 0 HG3 GLN A 147 101.641 10.905 -5.225 1.00 0.00 H new ATOM 0 HE21 GLN A 147 103.764 9.263 -7.320 1.00 0.00 H new ATOM 0 HE22 GLN A 147 102.694 9.129 -8.720 1.00 0.00 H new ATOM 593 N SER A 148 106.610 11.084 -4.946 1.00 0.00 N ATOM 594 CA SER A 148 107.721 11.493 -4.102 1.00 0.00 C ATOM 595 C SER A 148 107.873 13.011 -4.148 1.00 0.00 C ATOM 596 O SER A 148 107.858 13.671 -3.114 1.00 0.00 O ATOM 597 CB SER A 148 109.005 10.821 -4.560 1.00 0.00 C ATOM 598 OG SER A 148 109.008 9.444 -4.237 1.00 0.00 O ATOM 0 H SER A 148 106.829 10.359 -5.630 1.00 0.00 H new ATOM 0 HA SER A 148 107.518 11.188 -3.075 1.00 0.00 H new ATOM 0 HB2 SER A 148 109.118 10.944 -5.637 1.00 0.00 H new ATOM 0 HB3 SER A 148 109.860 11.308 -4.092 1.00 0.00 H new ATOM 0 HG SER A 148 108.100 9.086 -4.323 1.00 0.00 H new ATOM 604 N LYS A 149 107.968 13.555 -5.356 1.00 0.00 N ATOM 605 CA LYS A 149 108.073 15.003 -5.550 1.00 0.00 C ATOM 606 C LYS A 149 106.858 15.701 -4.946 1.00 0.00 C ATOM 607 O LYS A 149 106.971 16.734 -4.283 1.00 0.00 O ATOM 608 CB LYS A 149 108.156 15.320 -7.045 1.00 0.00 C ATOM 609 CG LYS A 149 109.292 14.600 -7.755 1.00 0.00 C ATOM 610 CD LYS A 149 109.272 14.846 -9.257 1.00 0.00 C ATOM 611 CE LYS A 149 109.574 16.298 -9.600 1.00 0.00 C ATOM 612 NZ LYS A 149 110.872 16.743 -9.022 1.00 0.00 N ATOM 0 H LYS A 149 107.975 13.015 -6.221 1.00 0.00 H new ATOM 0 HA LYS A 149 108.974 15.362 -5.053 1.00 0.00 H new ATOM 0 HB2 LYS A 149 107.212 15.049 -7.519 1.00 0.00 H new ATOM 0 HB3 LYS A 149 108.281 16.395 -7.174 1.00 0.00 H new ATOM 0 HG2 LYS A 149 110.245 14.934 -7.345 1.00 0.00 H new ATOM 0 HG3 LYS A 149 109.220 13.530 -7.562 1.00 0.00 H new ATOM 0 HD2 LYS A 149 110.004 14.199 -9.740 1.00 0.00 H new ATOM 0 HD3 LYS A 149 108.295 14.575 -9.656 1.00 0.00 H new ATOM 0 HE2 LYS A 149 109.598 16.418 -10.683 1.00 0.00 H new ATOM 0 HE3 LYS A 149 108.772 16.934 -9.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 111.371 17.343 -9.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 110.697 17.285 -8.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 111.456 15.912 -8.800 1.00 0.00 H new ATOM 626 N GLU A 150 105.703 15.106 -5.187 1.00 0.00 N ATOM 627 CA GLU A 150 104.424 15.606 -4.700 1.00 0.00 C ATOM 628 C GLU A 150 104.411 15.886 -3.198 1.00 0.00 C ATOM 629 O GLU A 150 104.149 17.004 -2.753 1.00 0.00 O ATOM 630 CB GLU A 150 103.374 14.534 -4.958 1.00 0.00 C ATOM 631 CG GLU A 150 101.961 14.989 -4.635 1.00 0.00 C ATOM 632 CD GLU A 150 100.926 13.914 -4.898 1.00 0.00 C ATOM 633 OE1 GLU A 150 100.816 13.466 -6.059 1.00 0.00 O ATOM 634 OE2 GLU A 150 100.225 13.518 -3.943 1.00 0.00 O ATOM 0 H GLU A 150 105.623 14.249 -5.734 1.00 0.00 H new ATOM 0 HA GLU A 150 104.229 16.544 -5.220 1.00 0.00 H new ATOM 0 HB2 GLU A 150 103.421 14.233 -6.005 1.00 0.00 H new ATOM 0 HB3 GLU A 150 103.610 13.653 -4.362 1.00 0.00 H new ATOM 0 HG2 GLU A 150 101.910 15.288 -3.588 1.00 0.00 H new ATOM 0 HG3 GLU A 150 101.723 15.871 -5.230 1.00 0.00 H new ATOM 641 N LYS A 151 104.632 14.819 -2.437 1.00 0.00 N ATOM 642 CA LYS A 151 104.592 14.857 -0.977 1.00 0.00 C ATOM 643 C LYS A 151 105.898 15.302 -0.325 1.00 0.00 C ATOM 644 O LYS A 151 105.882 15.977 0.703 1.00 0.00 O ATOM 645 CB LYS A 151 104.253 13.461 -0.463 1.00 0.00 C ATOM 646 CG LYS A 151 105.459 12.536 -0.424 1.00 0.00 C ATOM 647 CD LYS A 151 105.069 11.089 -0.187 1.00 0.00 C ATOM 648 CE LYS A 151 103.962 10.963 0.846 1.00 0.00 C ATOM 649 NZ LYS A 151 103.753 9.550 1.267 1.00 0.00 N ATOM 0 H LYS A 151 104.845 13.897 -2.817 1.00 0.00 H new ATOM 0 HA LYS A 151 103.838 15.597 -0.709 1.00 0.00 H new ATOM 0 HB2 LYS A 151 103.830 13.541 0.538 1.00 0.00 H new ATOM 0 HB3 LYS A 151 103.485 13.022 -1.099 1.00 0.00 H new ATOM 0 HG2 LYS A 151 106.004 12.613 -1.365 1.00 0.00 H new ATOM 0 HG3 LYS A 151 106.138 12.861 0.365 1.00 0.00 H new ATOM 0 HD2 LYS A 151 104.742 10.643 -1.126 1.00 0.00 H new ATOM 0 HD3 LYS A 151 105.942 10.527 0.146 1.00 0.00 H new ATOM 0 HE2 LYS A 151 104.209 11.569 1.718 1.00 0.00 H new ATOM 0 HE3 LYS A 151 103.034 11.360 0.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 102.783 9.257 1.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 104.430 8.936 0.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 103.899 9.468 2.293 1.00 0.00 H new ATOM 663 N THR A 152 107.028 14.885 -0.888 1.00 0.00 N ATOM 664 CA THR A 152 108.321 15.215 -0.300 1.00 0.00 C ATOM 665 C THR A 152 108.519 16.719 -0.173 1.00 0.00 C ATOM 666 O THR A 152 109.222 17.185 0.723 1.00 0.00 O ATOM 667 CB THR A 152 109.465 14.625 -1.120 1.00 0.00 C ATOM 668 OG1 THR A 152 110.690 14.760 -0.423 1.00 0.00 O ATOM 669 CG2 THR A 152 109.649 15.293 -2.462 1.00 0.00 C ATOM 0 H THR A 152 107.075 14.325 -1.739 1.00 0.00 H new ATOM 0 HA THR A 152 108.329 14.778 0.699 1.00 0.00 H new ATOM 0 HB THR A 152 109.197 13.581 -1.279 1.00 0.00 H new ATOM 0 HG1 THR A 152 111.432 14.525 -1.018 1.00 0.00 H new ATOM 0 HG21 THR A 152 110.479 14.824 -2.991 1.00 0.00 H new ATOM 0 HG22 THR A 152 108.737 15.186 -3.050 1.00 0.00 H new ATOM 0 HG23 THR A 152 109.864 16.351 -2.315 1.00 0.00 H new ATOM 677 N ALA A 153 107.916 17.478 -1.081 1.00 0.00 N ATOM 678 CA ALA A 153 108.066 18.925 -1.052 1.00 0.00 C ATOM 679 C ALA A 153 107.633 19.473 0.306 1.00 0.00 C ATOM 680 O ALA A 153 108.164 20.471 0.795 1.00 0.00 O ATOM 681 CB ALA A 153 107.274 19.570 -2.181 1.00 0.00 C ATOM 0 H ALA A 153 107.328 17.121 -1.834 1.00 0.00 H new ATOM 0 HA ALA A 153 109.118 19.171 -1.200 1.00 0.00 H new ATOM 0 HB1 ALA A 153 107.400 20.652 -2.142 1.00 0.00 H new ATOM 0 HB2 ALA A 153 107.637 19.197 -3.139 1.00 0.00 H new ATOM 0 HB3 ALA A 153 106.218 19.323 -2.072 1.00 0.00 H new ATOM 687 N SER A 154 106.652 18.798 0.896 1.00 0.00 N ATOM 688 CA SER A 154 106.101 19.180 2.193 1.00 0.00 C ATOM 689 C SER A 154 106.876 18.548 3.350 1.00 0.00 C ATOM 690 O SER A 154 106.720 18.951 4.503 1.00 0.00 O ATOM 691 CB SER A 154 104.637 18.744 2.274 1.00 0.00 C ATOM 692 OG SER A 154 104.515 17.340 2.123 1.00 0.00 O ATOM 0 H SER A 154 106.216 17.971 0.489 1.00 0.00 H new ATOM 0 HA SER A 154 106.183 20.263 2.282 1.00 0.00 H new ATOM 0 HB2 SER A 154 104.216 19.048 3.232 1.00 0.00 H new ATOM 0 HB3 SER A 154 104.060 19.248 1.498 1.00 0.00 H new ATOM 0 HG SER A 154 105.360 16.972 1.790 1.00 0.00 H new ATOM 698 N TYR A 155 107.684 17.537 3.044 1.00 0.00 N ATOM 699 CA TYR A 155 108.451 16.832 4.069 1.00 0.00 C ATOM 700 C TYR A 155 109.658 17.622 4.563 1.00 0.00 C ATOM 701 O TYR A 155 110.442 18.161 3.783 1.00 0.00 O ATOM 702 CB TYR A 155 108.923 15.467 3.560 1.00 0.00 C ATOM 703 CG TYR A 155 107.874 14.372 3.546 1.00 0.00 C ATOM 704 CD1 TYR A 155 106.545 14.610 3.893 1.00 0.00 C ATOM 705 CD2 TYR A 155 108.236 13.077 3.203 1.00 0.00 C ATOM 706 CE1 TYR A 155 105.617 13.585 3.894 1.00 0.00 C ATOM 707 CE2 TYR A 155 107.316 12.049 3.209 1.00 0.00 C ATOM 708 CZ TYR A 155 106.008 12.308 3.555 1.00 0.00 C ATOM 709 OH TYR A 155 105.092 11.282 3.577 1.00 0.00 O ATOM 0 H TYR A 155 107.825 17.187 2.096 1.00 0.00 H new ATOM 0 HA TYR A 155 107.770 16.703 4.910 1.00 0.00 H new ATOM 0 HB2 TYR A 155 109.307 15.590 2.547 1.00 0.00 H new ATOM 0 HB3 TYR A 155 109.757 15.138 4.179 1.00 0.00 H new ATOM 0 HD1 TYR A 155 106.236 15.609 4.165 1.00 0.00 H new ATOM 0 HD2 TYR A 155 109.259 12.870 2.926 1.00 0.00 H new ATOM 0 HE1 TYR A 155 104.589 13.785 4.160 1.00 0.00 H new ATOM 0 HE2 TYR A 155 107.619 11.047 2.944 1.00 0.00 H new ATOM 0 HH TYR A 155 105.530 10.447 3.311 1.00 0.00 H new ATOM 719 N THR A 156 109.793 17.642 5.886 1.00 0.00 N ATOM 720 CA THR A 156 110.894 18.308 6.569 1.00 0.00 C ATOM 721 C THR A 156 111.868 17.256 7.088 1.00 0.00 C ATOM 722 O THR A 156 111.682 16.063 6.849 1.00 0.00 O ATOM 723 CB THR A 156 110.376 19.151 7.738 1.00 0.00 C ATOM 724 OG1 THR A 156 111.367 20.069 8.165 1.00 0.00 O ATOM 725 CG2 THR A 156 109.982 18.327 8.946 1.00 0.00 C ATOM 0 H THR A 156 109.133 17.191 6.519 1.00 0.00 H new ATOM 0 HA THR A 156 111.399 18.970 5.865 1.00 0.00 H new ATOM 0 HB THR A 156 109.491 19.659 7.356 1.00 0.00 H new ATOM 0 HG1 THR A 156 111.020 20.601 8.911 1.00 0.00 H new ATOM 0 HG21 THR A 156 109.624 18.987 9.736 1.00 0.00 H new ATOM 0 HG22 THR A 156 109.190 17.631 8.669 1.00 0.00 H new ATOM 0 HG23 THR A 156 110.847 17.769 9.304 1.00 0.00 H new ATOM 733 N LYS A 157 112.894 17.689 7.804 1.00 0.00 N ATOM 734 CA LYS A 157 113.868 16.751 8.352 1.00 0.00 C ATOM 735 C LYS A 157 113.197 15.805 9.345 1.00 0.00 C ATOM 736 O LYS A 157 113.422 14.595 9.318 1.00 0.00 O ATOM 737 CB LYS A 157 115.013 17.486 9.040 1.00 0.00 C ATOM 738 CG LYS A 157 116.155 16.568 9.445 1.00 0.00 C ATOM 739 CD LYS A 157 116.984 17.172 10.559 1.00 0.00 C ATOM 740 CE LYS A 157 118.160 16.283 10.927 1.00 0.00 C ATOM 741 NZ LYS A 157 119.074 16.065 9.772 1.00 0.00 N ATOM 0 H LYS A 157 113.075 18.670 8.019 1.00 0.00 H new ATOM 0 HA LYS A 157 114.275 16.173 7.522 1.00 0.00 H new ATOM 0 HB2 LYS A 157 115.395 18.258 8.371 1.00 0.00 H new ATOM 0 HB3 LYS A 157 114.631 17.993 9.926 1.00 0.00 H new ATOM 0 HG2 LYS A 157 115.754 15.607 9.768 1.00 0.00 H new ATOM 0 HG3 LYS A 157 116.791 16.374 8.581 1.00 0.00 H new ATOM 0 HD2 LYS A 157 117.350 18.151 10.251 1.00 0.00 H new ATOM 0 HD3 LYS A 157 116.357 17.328 11.437 1.00 0.00 H new ATOM 0 HE2 LYS A 157 118.715 16.736 11.748 1.00 0.00 H new ATOM 0 HE3 LYS A 157 117.791 15.322 11.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 120.060 16.161 10.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 118.925 15.111 9.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 118.876 16.771 9.035 1.00 0.00 H new ATOM 755 N GLU A 158 112.373 16.370 10.218 1.00 0.00 N ATOM 756 CA GLU A 158 111.661 15.593 11.227 1.00 0.00 C ATOM 757 C GLU A 158 110.975 14.378 10.607 1.00 0.00 C ATOM 758 O GLU A 158 110.918 13.302 11.204 1.00 0.00 O ATOM 759 CB GLU A 158 110.604 16.472 11.899 1.00 0.00 C ATOM 760 CG GLU A 158 111.173 17.716 12.564 1.00 0.00 C ATOM 761 CD GLU A 158 112.077 17.393 13.739 1.00 0.00 C ATOM 762 OE1 GLU A 158 112.216 16.198 14.073 1.00 0.00 O ATOM 763 OE2 GLU A 158 112.642 18.338 14.329 1.00 0.00 O ATOM 0 H GLU A 158 112.180 17.371 10.248 1.00 0.00 H new ATOM 0 HA GLU A 158 112.388 15.246 11.961 1.00 0.00 H new ATOM 0 HB2 GLU A 158 109.869 16.774 11.153 1.00 0.00 H new ATOM 0 HB3 GLU A 158 110.075 15.881 12.647 1.00 0.00 H new ATOM 0 HG2 GLU A 158 111.734 18.292 11.828 1.00 0.00 H new ATOM 0 HG3 GLU A 158 110.353 18.347 12.905 1.00 0.00 H new ATOM 770 N ASP A 159 110.435 14.580 9.410 1.00 0.00 N ATOM 771 CA ASP A 159 109.715 13.534 8.688 1.00 0.00 C ATOM 772 C ASP A 159 110.623 12.385 8.257 1.00 0.00 C ATOM 773 O ASP A 159 110.320 11.225 8.513 1.00 0.00 O ATOM 774 CB ASP A 159 109.033 14.128 7.454 1.00 0.00 C ATOM 775 CG ASP A 159 108.220 13.099 6.691 1.00 0.00 C ATOM 776 OD1 ASP A 159 108.810 12.099 6.233 1.00 0.00 O ATOM 777 OD2 ASP A 159 106.995 13.293 6.553 1.00 0.00 O ATOM 0 H ASP A 159 110.483 15.470 8.913 1.00 0.00 H new ATOM 0 HA ASP A 159 108.973 13.128 9.375 1.00 0.00 H new ATOM 0 HB2 ASP A 159 108.382 14.947 7.761 1.00 0.00 H new ATOM 0 HB3 ASP A 159 109.789 14.552 6.793 1.00 0.00 H new ATOM 782 N TRP A 160 111.718 12.702 7.583 1.00 0.00 N ATOM 783 CA TRP A 160 112.629 11.672 7.101 1.00 0.00 C ATOM 784 C TRP A 160 113.253 10.868 8.235 1.00 0.00 C ATOM 785 O TRP A 160 113.411 9.657 8.118 1.00 0.00 O ATOM 786 CB TRP A 160 113.721 12.279 6.222 1.00 0.00 C ATOM 787 CG TRP A 160 113.219 12.759 4.894 1.00 0.00 C ATOM 788 CD1 TRP A 160 113.417 13.990 4.352 1.00 0.00 C ATOM 789 CD2 TRP A 160 112.453 12.017 3.934 1.00 0.00 C ATOM 790 NE1 TRP A 160 112.818 14.070 3.120 1.00 0.00 N ATOM 791 CE2 TRP A 160 112.223 12.869 2.840 1.00 0.00 C ATOM 792 CE3 TRP A 160 111.939 10.719 3.892 1.00 0.00 C ATOM 793 CZ2 TRP A 160 111.503 12.464 1.718 1.00 0.00 C ATOM 794 CZ3 TRP A 160 111.222 10.320 2.779 1.00 0.00 C ATOM 795 CH2 TRP A 160 111.011 11.189 1.705 1.00 0.00 C ATOM 0 H TRP A 160 111.997 13.657 7.358 1.00 0.00 H new ATOM 0 HA TRP A 160 112.032 10.983 6.504 1.00 0.00 H new ATOM 0 HB2 TRP A 160 114.181 13.114 6.751 1.00 0.00 H new ATOM 0 HB3 TRP A 160 114.501 11.536 6.060 1.00 0.00 H new ATOM 0 HD1 TRP A 160 113.967 14.791 4.824 1.00 0.00 H new ATOM 0 HE1 TRP A 160 112.816 14.889 2.513 1.00 0.00 H new ATOM 0 HE3 TRP A 160 112.099 10.038 4.715 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 111.339 13.134 0.887 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 110.818 9.319 2.739 1.00 0.00 H new ATOM 0 HH2 TRP A 160 110.449 10.847 0.849 1.00 0.00 H new ATOM 806 N GLN A 161 113.616 11.525 9.326 1.00 0.00 N ATOM 807 CA GLN A 161 114.226 10.818 10.444 1.00 0.00 C ATOM 808 C GLN A 161 113.244 9.827 11.062 1.00 0.00 C ATOM 809 O GLN A 161 113.613 8.689 11.350 1.00 0.00 O ATOM 810 CB GLN A 161 114.762 11.803 11.484 1.00 0.00 C ATOM 811 CG GLN A 161 115.374 11.141 12.711 1.00 0.00 C ATOM 812 CD GLN A 161 114.338 10.560 13.658 1.00 0.00 C ATOM 813 OE1 GLN A 161 114.681 9.881 14.626 1.00 0.00 O ATOM 814 NE2 GLN A 161 113.066 10.839 13.399 1.00 0.00 N ATOM 0 H GLN A 161 113.502 12.529 9.462 1.00 0.00 H new ATOM 0 HA GLN A 161 115.074 10.247 10.066 1.00 0.00 H new ATOM 0 HB2 GLN A 161 115.513 12.437 11.014 1.00 0.00 H new ATOM 0 HB3 GLN A 161 113.949 12.455 11.804 1.00 0.00 H new ATOM 0 HG2 GLN A 161 116.048 10.347 12.389 1.00 0.00 H new ATOM 0 HG3 GLN A 161 115.977 11.873 13.248 1.00 0.00 H new ATOM 0 HE21 GLN A 161 112.823 11.405 12.586 1.00 0.00 H new ATOM 0 HE22 GLN A 161 112.331 10.487 14.013 1.00 0.00 H new ATOM 823 N ARG A 162 111.992 10.234 11.237 1.00 0.00 N ATOM 824 CA ARG A 162 110.993 9.326 11.790 1.00 0.00 C ATOM 825 C ARG A 162 110.876 8.105 10.884 1.00 0.00 C ATOM 826 O ARG A 162 110.670 6.982 11.342 1.00 0.00 O ATOM 827 CB ARG A 162 109.634 10.019 11.915 1.00 0.00 C ATOM 828 CG ARG A 162 108.529 9.098 12.409 1.00 0.00 C ATOM 829 CD ARG A 162 107.203 9.832 12.523 1.00 0.00 C ATOM 830 NE ARG A 162 107.277 10.953 13.456 1.00 0.00 N ATOM 831 CZ ARG A 162 106.249 11.751 13.731 1.00 0.00 C ATOM 832 NH1 ARG A 162 105.077 11.550 13.147 1.00 0.00 N ATOM 833 NH2 ARG A 162 106.395 12.750 14.591 1.00 0.00 N ATOM 0 H ARG A 162 111.649 11.167 11.010 1.00 0.00 H new ATOM 0 HA ARG A 162 111.306 9.019 12.788 1.00 0.00 H new ATOM 0 HB2 ARG A 162 109.726 10.863 12.599 1.00 0.00 H new ATOM 0 HB3 ARG A 162 109.351 10.425 10.944 1.00 0.00 H new ATOM 0 HG2 ARG A 162 108.423 8.256 11.725 1.00 0.00 H new ATOM 0 HG3 ARG A 162 108.803 8.687 13.380 1.00 0.00 H new ATOM 0 HD2 ARG A 162 106.905 10.197 11.540 1.00 0.00 H new ATOM 0 HD3 ARG A 162 106.431 9.137 12.852 1.00 0.00 H new ATOM 0 HE ARG A 162 108.166 11.134 13.922 1.00 0.00 H new ATOM 0 HH11 ARG A 162 104.962 10.782 12.485 1.00 0.00 H new ATOM 0 HH12 ARG A 162 104.290 12.163 13.359 1.00 0.00 H new ATOM 0 HH21 ARG A 162 107.296 12.907 15.042 1.00 0.00 H new ATOM 0 HH22 ARG A 162 105.606 13.361 14.801 1.00 0.00 H new ATOM 847 N ILE A 163 111.031 8.355 9.590 1.00 0.00 N ATOM 848 CA ILE A 163 110.972 7.317 8.570 1.00 0.00 C ATOM 849 C ILE A 163 112.225 6.448 8.615 1.00 0.00 C ATOM 850 O ILE A 163 112.141 5.226 8.702 1.00 0.00 O ATOM 851 CB ILE A 163 110.830 7.947 7.167 1.00 0.00 C ATOM 852 CG1 ILE A 163 109.397 8.444 6.911 1.00 0.00 C ATOM 853 CG2 ILE A 163 111.237 6.953 6.086 1.00 0.00 C ATOM 854 CD1 ILE A 163 108.742 9.177 8.068 1.00 0.00 C ATOM 0 H ILE A 163 111.202 9.289 9.217 1.00 0.00 H new ATOM 0 HA ILE A 163 110.101 6.694 8.772 1.00 0.00 H new ATOM 0 HB ILE A 163 111.498 8.807 7.129 1.00 0.00 H new ATOM 0 HG12 ILE A 163 109.410 9.106 6.045 1.00 0.00 H new ATOM 0 HG13 ILE A 163 108.776 7.588 6.648 1.00 0.00 H new ATOM 0 HG21 ILE A 163 111.129 7.417 5.106 1.00 0.00 H new ATOM 0 HG22 ILE A 163 112.276 6.658 6.236 1.00 0.00 H new ATOM 0 HG23 ILE A 163 110.598 6.072 6.142 1.00 0.00 H new ATOM 0 HD11 ILE A 163 107.736 9.484 7.782 1.00 0.00 H new ATOM 0 HD12 ILE A 163 108.688 8.516 8.933 1.00 0.00 H new ATOM 0 HD13 ILE A 163 109.332 10.058 8.321 1.00 0.00 H new ATOM 866 N GLN A 164 113.393 7.082 8.571 1.00 0.00 N ATOM 867 CA GLN A 164 114.645 6.344 8.625 1.00 0.00 C ATOM 868 C GLN A 164 114.672 5.481 9.866 1.00 0.00 C ATOM 869 O GLN A 164 114.976 4.290 9.807 1.00 0.00 O ATOM 870 CB GLN A 164 115.832 7.297 8.599 1.00 0.00 C ATOM 871 CG GLN A 164 115.983 7.973 7.259 1.00 0.00 C ATOM 872 CD GLN A 164 116.269 6.985 6.146 1.00 0.00 C ATOM 873 OE1 GLN A 164 117.308 6.324 6.139 1.00 0.00 O ATOM 874 NE2 GLN A 164 115.341 6.870 5.203 1.00 0.00 N ATOM 0 H GLN A 164 113.496 8.094 8.499 1.00 0.00 H new ATOM 0 HA GLN A 164 114.717 5.701 7.748 1.00 0.00 H new ATOM 0 HB2 GLN A 164 115.708 8.053 9.375 1.00 0.00 H new ATOM 0 HB3 GLN A 164 116.744 6.747 8.833 1.00 0.00 H new ATOM 0 HG2 GLN A 164 115.071 8.524 7.028 1.00 0.00 H new ATOM 0 HG3 GLN A 164 116.791 8.702 7.311 1.00 0.00 H new ATOM 0 HE21 GLN A 164 114.495 7.438 5.248 1.00 0.00 H new ATOM 0 HE22 GLN A 164 115.474 6.214 4.433 1.00 0.00 H new ATOM 883 N ASP A 165 114.303 6.082 10.983 1.00 0.00 N ATOM 884 CA ASP A 165 114.232 5.361 12.232 1.00 0.00 C ATOM 885 C ASP A 165 113.315 4.169 12.042 1.00 0.00 C ATOM 886 O ASP A 165 113.492 3.123 12.667 1.00 0.00 O ATOM 887 CB ASP A 165 113.707 6.256 13.351 1.00 0.00 C ATOM 888 CG ASP A 165 113.674 5.550 14.691 1.00 0.00 C ATOM 889 OD1 ASP A 165 114.748 5.115 15.160 1.00 0.00 O ATOM 890 OD2 ASP A 165 112.576 5.431 15.273 1.00 0.00 O ATOM 0 H ASP A 165 114.049 7.068 11.046 1.00 0.00 H new ATOM 0 HA ASP A 165 115.230 5.029 12.517 1.00 0.00 H new ATOM 0 HB2 ASP A 165 114.335 7.144 13.427 1.00 0.00 H new ATOM 0 HB3 ASP A 165 112.703 6.597 13.099 1.00 0.00 H new ATOM 895 N GLU A 166 112.326 4.338 11.160 1.00 0.00 N ATOM 896 CA GLU A 166 111.380 3.264 10.886 1.00 0.00 C ATOM 897 C GLU A 166 112.079 2.154 10.112 1.00 0.00 C ATOM 898 O GLU A 166 111.926 0.974 10.425 1.00 0.00 O ATOM 899 CB GLU A 166 110.170 3.779 10.100 1.00 0.00 C ATOM 900 CG GLU A 166 108.963 2.855 10.151 1.00 0.00 C ATOM 901 CD GLU A 166 108.342 2.762 11.534 1.00 0.00 C ATOM 902 OE1 GLU A 166 109.017 2.263 12.459 1.00 0.00 O ATOM 903 OE2 GLU A 166 107.180 3.189 11.691 1.00 0.00 O ATOM 0 H GLU A 166 112.164 5.196 10.633 1.00 0.00 H new ATOM 0 HA GLU A 166 111.017 2.871 11.836 1.00 0.00 H new ATOM 0 HB2 GLU A 166 109.884 4.756 10.491 1.00 0.00 H new ATOM 0 HB3 GLU A 166 110.460 3.924 9.059 1.00 0.00 H new ATOM 0 HG2 GLU A 166 108.212 3.209 9.445 1.00 0.00 H new ATOM 0 HG3 GLU A 166 109.262 1.859 9.826 1.00 0.00 H new ATOM 910 N ALA A 167 112.870 2.544 9.115 1.00 0.00 N ATOM 911 CA ALA A 167 113.618 1.579 8.322 1.00 0.00 C ATOM 912 C ALA A 167 114.561 0.806 9.228 1.00 0.00 C ATOM 913 O ALA A 167 114.639 -0.421 9.164 1.00 0.00 O ATOM 914 CB ALA A 167 114.391 2.270 7.209 1.00 0.00 C ATOM 0 H ALA A 167 113.007 3.517 8.840 1.00 0.00 H new ATOM 0 HA ALA A 167 112.917 0.886 7.856 1.00 0.00 H new ATOM 0 HB1 ALA A 167 114.941 1.526 6.632 1.00 0.00 H new ATOM 0 HB2 ALA A 167 113.695 2.795 6.555 1.00 0.00 H new ATOM 0 HB3 ALA A 167 115.092 2.984 7.642 1.00 0.00 H new ATOM 920 N ASP A 168 115.270 1.536 10.084 1.00 0.00 N ATOM 921 CA ASP A 168 116.200 0.928 11.020 1.00 0.00 C ATOM 922 C ASP A 168 115.500 -0.135 11.845 1.00 0.00 C ATOM 923 O ASP A 168 115.896 -1.298 11.849 1.00 0.00 O ATOM 924 CB ASP A 168 116.755 2.003 11.957 1.00 0.00 C ATOM 925 CG ASP A 168 117.738 1.440 12.965 1.00 0.00 C ATOM 926 OD1 ASP A 168 118.769 0.877 12.539 1.00 0.00 O ATOM 927 OD2 ASP A 168 117.476 1.561 14.180 1.00 0.00 O ATOM 0 H ASP A 168 115.215 2.553 10.146 1.00 0.00 H new ATOM 0 HA ASP A 168 117.012 0.466 10.458 1.00 0.00 H new ATOM 0 HB2 ASP A 168 117.247 2.777 11.367 1.00 0.00 H new ATOM 0 HB3 ASP A 168 115.930 2.481 12.486 1.00 0.00 H new ATOM 932 N GLU A 169 114.441 0.270 12.532 1.00 0.00 N ATOM 933 CA GLU A 169 113.675 -0.652 13.347 1.00 0.00 C ATOM 934 C GLU A 169 113.317 -1.877 12.526 1.00 0.00 C ATOM 935 O GLU A 169 113.530 -3.009 12.955 1.00 0.00 O ATOM 936 CB GLU A 169 112.404 0.021 13.865 1.00 0.00 C ATOM 937 CG GLU A 169 111.557 -0.881 14.746 1.00 0.00 C ATOM 938 CD GLU A 169 112.281 -1.315 16.005 1.00 0.00 C ATOM 939 OE1 GLU A 169 112.670 -0.433 16.800 1.00 0.00 O ATOM 940 OE2 GLU A 169 112.460 -2.535 16.197 1.00 0.00 O ATOM 0 H GLU A 169 114.096 1.230 12.539 1.00 0.00 H new ATOM 0 HA GLU A 169 114.279 -0.953 14.203 1.00 0.00 H new ATOM 0 HB2 GLU A 169 112.678 0.913 14.429 1.00 0.00 H new ATOM 0 HB3 GLU A 169 111.806 0.352 13.016 1.00 0.00 H new ATOM 0 HG2 GLU A 169 110.641 -0.358 15.020 1.00 0.00 H new ATOM 0 HG3 GLU A 169 111.262 -1.764 14.179 1.00 0.00 H new ATOM 947 N LEU A 170 112.779 -1.638 11.335 1.00 0.00 N ATOM 948 CA LEU A 170 112.398 -2.718 10.442 1.00 0.00 C ATOM 949 C LEU A 170 113.595 -3.600 10.120 1.00 0.00 C ATOM 950 O LEU A 170 113.456 -4.806 9.923 1.00 0.00 O ATOM 951 CB LEU A 170 111.780 -2.165 9.154 1.00 0.00 C ATOM 952 CG LEU A 170 111.524 -3.203 8.058 1.00 0.00 C ATOM 953 CD1 LEU A 170 110.536 -2.662 7.031 1.00 0.00 C ATOM 954 CD2 LEU A 170 112.835 -3.619 7.380 1.00 0.00 C ATOM 0 H LEU A 170 112.598 -0.704 10.968 1.00 0.00 H new ATOM 0 HA LEU A 170 111.649 -3.327 10.949 1.00 0.00 H new ATOM 0 HB2 LEU A 170 110.835 -1.681 9.402 1.00 0.00 H new ATOM 0 HB3 LEU A 170 112.439 -1.394 8.755 1.00 0.00 H new ATOM 0 HG LEU A 170 111.089 -4.088 8.523 1.00 0.00 H new ATOM 0 HD11 LEU A 170 110.366 -3.413 6.259 1.00 0.00 H new ATOM 0 HD12 LEU A 170 109.592 -2.427 7.523 1.00 0.00 H new ATOM 0 HD13 LEU A 170 110.943 -1.759 6.575 1.00 0.00 H new ATOM 0 HD21 LEU A 170 112.626 -4.357 6.605 1.00 0.00 H new ATOM 0 HD22 LEU A 170 113.306 -2.745 6.931 1.00 0.00 H new ATOM 0 HD23 LEU A 170 113.507 -4.052 8.121 1.00 0.00 H new ATOM 966 N THR A 171 114.772 -2.994 10.079 1.00 0.00 N ATOM 967 CA THR A 171 115.993 -3.726 9.792 1.00 0.00 C ATOM 968 C THR A 171 116.374 -4.582 10.988 1.00 0.00 C ATOM 969 O THR A 171 116.730 -5.752 10.847 1.00 0.00 O ATOM 970 CB THR A 171 117.120 -2.746 9.472 1.00 0.00 C ATOM 971 OG1 THR A 171 116.730 -1.852 8.445 1.00 0.00 O ATOM 972 CG2 THR A 171 118.397 -3.421 9.024 1.00 0.00 C ATOM 0 H THR A 171 114.906 -1.996 10.241 1.00 0.00 H new ATOM 0 HA THR A 171 115.829 -4.373 8.930 1.00 0.00 H new ATOM 0 HB THR A 171 117.314 -2.220 10.407 1.00 0.00 H new ATOM 0 HG1 THR A 171 116.252 -1.092 8.837 1.00 0.00 H new ATOM 0 HG21 THR A 171 119.154 -2.665 8.814 1.00 0.00 H new ATOM 0 HG22 THR A 171 118.755 -4.083 9.813 1.00 0.00 H new ATOM 0 HG23 THR A 171 118.204 -4.002 8.122 1.00 0.00 H new ATOM 980 N ARG A 172 116.302 -3.977 12.166 1.00 0.00 N ATOM 981 CA ARG A 172 116.644 -4.660 13.402 1.00 0.00 C ATOM 982 C ARG A 172 115.916 -5.994 13.527 1.00 0.00 C ATOM 983 O ARG A 172 116.517 -7.008 13.877 1.00 0.00 O ATOM 984 CB ARG A 172 116.295 -3.784 14.604 1.00 0.00 C ATOM 985 CG ARG A 172 117.080 -2.484 14.667 1.00 0.00 C ATOM 986 CD ARG A 172 116.766 -1.707 15.937 1.00 0.00 C ATOM 987 NE ARG A 172 117.507 -0.450 16.010 1.00 0.00 N ATOM 988 CZ ARG A 172 118.832 -0.377 16.085 1.00 0.00 C ATOM 989 NH1 ARG A 172 119.560 -1.485 16.122 1.00 0.00 N ATOM 990 NH2 ARG A 172 119.430 0.806 16.131 1.00 0.00 N ATOM 0 H ARG A 172 116.008 -3.008 12.290 1.00 0.00 H new ATOM 0 HA ARG A 172 117.717 -4.852 13.381 1.00 0.00 H new ATOM 0 HB2 ARG A 172 115.230 -3.553 14.576 1.00 0.00 H new ATOM 0 HB3 ARG A 172 116.474 -4.350 15.518 1.00 0.00 H new ATOM 0 HG2 ARG A 172 118.148 -2.699 14.625 1.00 0.00 H new ATOM 0 HG3 ARG A 172 116.844 -1.872 13.796 1.00 0.00 H new ATOM 0 HD2 ARG A 172 115.697 -1.500 15.980 1.00 0.00 H new ATOM 0 HD3 ARG A 172 117.007 -2.320 16.805 1.00 0.00 H new ATOM 0 HE ARG A 172 116.977 0.422 16.003 1.00 0.00 H new ATOM 0 HH11 ARG A 172 119.103 -2.397 16.093 1.00 0.00 H new ATOM 0 HH12 ARG A 172 120.577 -1.426 16.180 1.00 0.00 H new ATOM 0 HH21 ARG A 172 118.873 1.660 16.109 1.00 0.00 H new ATOM 0 HH22 ARG A 172 120.447 0.862 16.189 1.00 0.00 H new ATOM 1004 N ARG A 173 114.616 -5.981 13.252 1.00 0.00 N ATOM 1005 CA ARG A 173 113.809 -7.193 13.350 1.00 0.00 C ATOM 1006 C ARG A 173 114.177 -8.187 12.250 1.00 0.00 C ATOM 1007 O ARG A 173 114.279 -9.389 12.500 1.00 0.00 O ATOM 1008 CB ARG A 173 112.317 -6.851 13.308 1.00 0.00 C ATOM 1009 CG ARG A 173 111.957 -5.848 12.234 1.00 0.00 C ATOM 1010 CD ARG A 173 110.472 -5.543 12.215 1.00 0.00 C ATOM 1011 NE ARG A 173 110.107 -4.805 11.015 1.00 0.00 N ATOM 1012 CZ ARG A 173 108.900 -4.327 10.774 1.00 0.00 C ATOM 1013 NH1 ARG A 173 107.909 -4.551 11.626 1.00 0.00 N ATOM 1014 NH2 ARG A 173 108.685 -3.628 9.669 1.00 0.00 N ATOM 0 H ARG A 173 114.101 -5.150 12.961 1.00 0.00 H new ATOM 0 HA ARG A 173 114.021 -7.667 14.308 1.00 0.00 H new ATOM 0 HB2 ARG A 173 111.747 -7.766 13.145 1.00 0.00 H new ATOM 0 HB3 ARG A 173 112.016 -6.456 14.278 1.00 0.00 H new ATOM 0 HG2 ARG A 173 112.514 -4.926 12.398 1.00 0.00 H new ATOM 0 HG3 ARG A 173 112.260 -6.235 11.261 1.00 0.00 H new ATOM 0 HD2 ARG A 173 109.905 -6.473 12.261 1.00 0.00 H new ATOM 0 HD3 ARG A 173 110.205 -4.963 13.098 1.00 0.00 H new ATOM 0 HE ARG A 173 110.831 -4.647 10.314 1.00 0.00 H new ATOM 0 HH11 ARG A 173 108.077 -5.095 12.472 1.00 0.00 H new ATOM 0 HH12 ARG A 173 106.978 -4.179 11.435 1.00 0.00 H new ATOM 0 HH21 ARG A 173 109.449 -3.463 9.013 1.00 0.00 H new ATOM 0 HH22 ARG A 173 107.756 -3.255 9.474 1.00 0.00 H new ATOM 1028 N PHE A 174 114.412 -7.681 11.041 1.00 0.00 N ATOM 1029 CA PHE A 174 114.809 -8.536 9.925 1.00 0.00 C ATOM 1030 C PHE A 174 116.088 -9.262 10.281 1.00 0.00 C ATOM 1031 O PHE A 174 116.192 -10.467 10.121 1.00 0.00 O ATOM 1032 CB PHE A 174 115.025 -7.716 8.649 1.00 0.00 C ATOM 1033 CG PHE A 174 113.759 -7.296 7.956 1.00 0.00 C ATOM 1034 CD1 PHE A 174 112.639 -6.954 8.685 1.00 0.00 C ATOM 1035 CD2 PHE A 174 113.700 -7.224 6.575 1.00 0.00 C ATOM 1036 CE1 PHE A 174 111.481 -6.550 8.059 1.00 0.00 C ATOM 1037 CE2 PHE A 174 112.541 -6.823 5.938 1.00 0.00 C ATOM 1038 CZ PHE A 174 111.429 -6.486 6.685 1.00 0.00 C ATOM 0 H PHE A 174 114.335 -6.690 10.810 1.00 0.00 H new ATOM 0 HA PHE A 174 114.009 -9.253 9.739 1.00 0.00 H new ATOM 0 HB2 PHE A 174 115.601 -6.825 8.898 1.00 0.00 H new ATOM 0 HB3 PHE A 174 115.628 -8.301 7.954 1.00 0.00 H new ATOM 0 HD1 PHE A 174 112.671 -7.004 9.763 1.00 0.00 H new ATOM 0 HD2 PHE A 174 114.569 -7.484 5.989 1.00 0.00 H new ATOM 0 HE1 PHE A 174 110.614 -6.284 8.646 1.00 0.00 H new ATOM 0 HE2 PHE A 174 112.505 -6.773 4.860 1.00 0.00 H new ATOM 0 HZ PHE A 174 110.521 -6.173 6.192 1.00 0.00 H new ATOM 1048 N VAL A 175 117.053 -8.522 10.772 1.00 0.00 N ATOM 1049 CA VAL A 175 118.325 -9.096 11.156 1.00 0.00 C ATOM 1050 C VAL A 175 118.175 -10.119 12.279 1.00 0.00 C ATOM 1051 O VAL A 175 118.668 -11.238 12.170 1.00 0.00 O ATOM 1052 CB VAL A 175 119.291 -7.978 11.570 1.00 0.00 C ATOM 1053 CG1 VAL A 175 120.408 -8.506 12.455 1.00 0.00 C ATOM 1054 CG2 VAL A 175 119.861 -7.322 10.326 1.00 0.00 C ATOM 0 H VAL A 175 116.983 -7.515 10.917 1.00 0.00 H new ATOM 0 HA VAL A 175 118.730 -9.626 10.294 1.00 0.00 H new ATOM 0 HB VAL A 175 118.739 -7.240 12.152 1.00 0.00 H new ATOM 0 HG11 VAL A 175 121.073 -7.687 12.729 1.00 0.00 H new ATOM 0 HG12 VAL A 175 119.981 -8.944 13.357 1.00 0.00 H new ATOM 0 HG13 VAL A 175 120.972 -9.266 11.914 1.00 0.00 H new ATOM 0 HG21 VAL A 175 120.548 -6.527 10.616 1.00 0.00 H new ATOM 0 HG22 VAL A 175 120.396 -8.066 9.735 1.00 0.00 H new ATOM 0 HG23 VAL A 175 119.049 -6.901 9.732 1.00 0.00 H new ATOM 1064 N ALA A 176 117.495 -9.739 13.353 1.00 0.00 N ATOM 1065 CA ALA A 176 117.295 -10.644 14.481 1.00 0.00 C ATOM 1066 C ALA A 176 116.586 -11.926 14.047 1.00 0.00 C ATOM 1067 O ALA A 176 116.930 -13.018 14.498 1.00 0.00 O ATOM 1068 CB ALA A 176 116.508 -9.949 15.582 1.00 0.00 C ATOM 0 H ALA A 176 117.075 -8.817 13.468 1.00 0.00 H new ATOM 0 HA ALA A 176 118.276 -10.920 14.868 1.00 0.00 H new ATOM 0 HB1 ALA A 176 116.366 -10.635 16.417 1.00 0.00 H new ATOM 0 HB2 ALA A 176 117.057 -9.071 15.923 1.00 0.00 H new ATOM 0 HB3 ALA A 176 115.536 -9.642 15.196 1.00 0.00 H new ATOM 1074 N LEU A 177 115.594 -11.782 13.178 1.00 0.00 N ATOM 1075 CA LEU A 177 114.821 -12.919 12.681 1.00 0.00 C ATOM 1076 C LEU A 177 115.529 -13.605 11.509 1.00 0.00 C ATOM 1077 O LEU A 177 115.566 -14.833 11.428 1.00 0.00 O ATOM 1078 CB LEU A 177 113.433 -12.438 12.240 1.00 0.00 C ATOM 1079 CG LEU A 177 113.352 -11.921 10.798 1.00 0.00 C ATOM 1080 CD1 LEU A 177 113.164 -13.079 9.815 1.00 0.00 C ATOM 1081 CD2 LEU A 177 112.232 -10.897 10.650 1.00 0.00 C ATOM 0 H LEU A 177 115.302 -10.882 12.798 1.00 0.00 H new ATOM 0 HA LEU A 177 114.724 -13.646 13.487 1.00 0.00 H new ATOM 0 HB2 LEU A 177 112.727 -13.260 12.355 1.00 0.00 H new ATOM 0 HB3 LEU A 177 113.110 -11.644 12.913 1.00 0.00 H new ATOM 0 HG LEU A 177 114.295 -11.427 10.563 1.00 0.00 H new ATOM 0 HD11 LEU A 177 113.109 -12.688 8.799 1.00 0.00 H new ATOM 0 HD12 LEU A 177 114.007 -13.765 9.895 1.00 0.00 H new ATOM 0 HD13 LEU A 177 112.241 -13.610 10.050 1.00 0.00 H new ATOM 0 HD21 LEU A 177 112.195 -10.545 9.619 1.00 0.00 H new ATOM 0 HD22 LEU A 177 111.280 -11.359 10.911 1.00 0.00 H new ATOM 0 HD23 LEU A 177 112.420 -10.054 11.315 1.00 0.00 H new ATOM 1093 N MET A 178 116.075 -12.804 10.600 1.00 0.00 N ATOM 1094 CA MET A 178 116.765 -13.325 9.424 1.00 0.00 C ATOM 1095 C MET A 178 118.024 -14.084 9.825 1.00 0.00 C ATOM 1096 O MET A 178 118.242 -15.224 9.417 1.00 0.00 O ATOM 1097 CB MET A 178 117.127 -12.159 8.507 1.00 0.00 C ATOM 1098 CG MET A 178 117.734 -12.574 7.186 1.00 0.00 C ATOM 1099 SD MET A 178 119.428 -13.162 7.360 1.00 0.00 S ATOM 1100 CE MET A 178 120.016 -12.988 5.679 1.00 0.00 C ATOM 0 H MET A 178 116.053 -11.786 10.655 1.00 0.00 H new ATOM 0 HA MET A 178 116.106 -14.019 8.902 1.00 0.00 H new ATOM 0 HB2 MET A 178 116.229 -11.572 8.313 1.00 0.00 H new ATOM 0 HB3 MET A 178 117.828 -11.507 9.027 1.00 0.00 H new ATOM 0 HG2 MET A 178 117.124 -13.360 6.740 1.00 0.00 H new ATOM 0 HG3 MET A 178 117.715 -11.728 6.499 1.00 0.00 H new ATOM 0 HE1 MET A 178 121.084 -12.769 5.688 1.00 0.00 H new ATOM 0 HE2 MET A 178 119.841 -13.916 5.134 1.00 0.00 H new ATOM 0 HE3 MET A 178 119.482 -12.173 5.189 1.00 0.00 H new ATOM 1110 N ASP A 179 118.837 -13.432 10.649 1.00 0.00 N ATOM 1111 CA ASP A 179 120.077 -14.007 11.154 1.00 0.00 C ATOM 1112 C ASP A 179 119.789 -15.277 11.932 1.00 0.00 C ATOM 1113 O ASP A 179 120.641 -16.159 12.043 1.00 0.00 O ATOM 1114 CB ASP A 179 120.795 -12.996 12.054 1.00 0.00 C ATOM 1115 CG ASP A 179 122.064 -13.562 12.662 1.00 0.00 C ATOM 1116 OD1 ASP A 179 122.969 -13.949 11.892 1.00 0.00 O ATOM 1117 OD2 ASP A 179 122.152 -13.620 13.905 1.00 0.00 O ATOM 0 H ASP A 179 118.653 -12.487 10.986 1.00 0.00 H new ATOM 0 HA ASP A 179 120.719 -14.251 10.308 1.00 0.00 H new ATOM 0 HB2 ASP A 179 121.039 -12.106 11.474 1.00 0.00 H new ATOM 0 HB3 ASP A 179 120.122 -12.682 12.852 1.00 0.00 H new ATOM 1122 N ALA A 180 118.572 -15.377 12.451 1.00 0.00 N ATOM 1123 CA ALA A 180 118.164 -16.555 13.196 1.00 0.00 C ATOM 1124 C ALA A 180 118.087 -17.757 12.271 1.00 0.00 C ATOM 1125 O ALA A 180 117.819 -18.874 12.714 1.00 0.00 O ATOM 1126 CB ALA A 180 116.832 -16.322 13.892 1.00 0.00 C ATOM 0 H ALA A 180 117.854 -14.657 12.369 1.00 0.00 H new ATOM 0 HA ALA A 180 118.911 -16.755 13.964 1.00 0.00 H new ATOM 0 HB1 ALA A 180 116.548 -17.218 14.443 1.00 0.00 H new ATOM 0 HB2 ALA A 180 116.924 -15.485 14.584 1.00 0.00 H new ATOM 0 HB3 ALA A 180 116.068 -16.096 13.149 1.00 0.00 H new ATOM 1132 N GLY A 181 118.311 -17.527 10.982 1.00 0.00 N ATOM 1133 CA GLY A 181 118.247 -18.610 10.025 1.00 0.00 C ATOM 1134 C GLY A 181 116.817 -18.936 9.687 1.00 0.00 C ATOM 1135 O GLY A 181 116.506 -20.027 9.209 1.00 0.00 O ATOM 0 H GLY A 181 118.535 -16.614 10.586 1.00 0.00 H new ATOM 0 HA2 GLY A 181 118.786 -18.334 9.119 1.00 0.00 H new ATOM 0 HA3 GLY A 181 118.740 -19.492 10.433 1.00 0.00 H new ATOM 1139 N GLU A 182 115.945 -17.973 9.951 1.00 0.00 N ATOM 1140 CA GLU A 182 114.523 -18.133 9.692 1.00 0.00 C ATOM 1141 C GLU A 182 114.234 -17.921 8.203 1.00 0.00 C ATOM 1142 O GLU A 182 114.579 -16.874 7.657 1.00 0.00 O ATOM 1143 CB GLU A 182 113.756 -17.114 10.538 1.00 0.00 C ATOM 1144 CG GLU A 182 112.244 -17.237 10.450 1.00 0.00 C ATOM 1145 CD GLU A 182 111.726 -18.544 11.018 1.00 0.00 C ATOM 1146 OE1 GLU A 182 112.036 -18.846 12.189 1.00 0.00 O ATOM 1147 OE2 GLU A 182 110.999 -19.260 10.297 1.00 0.00 O ATOM 0 H GLU A 182 116.201 -17.068 10.347 1.00 0.00 H new ATOM 0 HA GLU A 182 114.205 -19.141 9.958 1.00 0.00 H new ATOM 0 HB2 GLU A 182 114.057 -17.224 11.580 1.00 0.00 H new ATOM 0 HB3 GLU A 182 114.046 -16.110 10.227 1.00 0.00 H new ATOM 0 HG2 GLU A 182 111.785 -16.406 10.986 1.00 0.00 H new ATOM 0 HG3 GLU A 182 111.937 -17.152 9.407 1.00 0.00 H new ATOM 1154 N PRO A 183 113.609 -18.895 7.506 1.00 0.00 N ATOM 1155 CA PRO A 183 113.320 -18.743 6.080 1.00 0.00 C ATOM 1156 C PRO A 183 112.467 -17.511 5.815 1.00 0.00 C ATOM 1157 O PRO A 183 111.749 -17.032 6.694 1.00 0.00 O ATOM 1158 CB PRO A 183 112.604 -20.042 5.686 1.00 0.00 C ATOM 1159 CG PRO A 183 112.157 -20.645 6.978 1.00 0.00 C ATOM 1160 CD PRO A 183 113.145 -20.195 8.022 1.00 0.00 C ATOM 0 HA PRO A 183 114.223 -18.590 5.488 1.00 0.00 H new ATOM 0 HB2 PRO A 183 111.757 -19.842 5.030 1.00 0.00 H new ATOM 0 HB3 PRO A 183 113.273 -20.714 5.148 1.00 0.00 H new ATOM 0 HG2 PRO A 183 111.149 -20.318 7.231 1.00 0.00 H new ATOM 0 HG3 PRO A 183 112.132 -21.733 6.911 1.00 0.00 H new ATOM 0 HD2 PRO A 183 112.679 -20.096 9.002 1.00 0.00 H new ATOM 0 HD3 PRO A 183 113.967 -20.902 8.130 1.00 0.00 H new ATOM 1168 N ALA A 184 112.606 -16.969 4.612 1.00 0.00 N ATOM 1169 CA ALA A 184 111.909 -15.751 4.236 1.00 0.00 C ATOM 1170 C ALA A 184 110.402 -15.920 4.077 1.00 0.00 C ATOM 1171 O ALA A 184 109.689 -14.917 4.024 1.00 0.00 O ATOM 1172 CB ALA A 184 112.521 -15.171 2.971 1.00 0.00 C ATOM 0 H ALA A 184 113.199 -17.358 3.878 1.00 0.00 H new ATOM 0 HA ALA A 184 112.039 -15.056 5.066 1.00 0.00 H new ATOM 0 HB1 ALA A 184 111.992 -14.258 2.696 1.00 0.00 H new ATOM 0 HB2 ALA A 184 113.572 -14.943 3.147 1.00 0.00 H new ATOM 0 HB3 ALA A 184 112.438 -15.896 2.161 1.00 0.00 H new ATOM 1178 N ASP A 185 109.882 -17.149 4.016 1.00 0.00 N ATOM 1179 CA ASP A 185 108.435 -17.322 3.882 1.00 0.00 C ATOM 1180 C ASP A 185 107.840 -17.624 5.251 1.00 0.00 C ATOM 1181 O ASP A 185 106.705 -18.086 5.372 1.00 0.00 O ATOM 1182 CB ASP A 185 108.103 -18.439 2.891 1.00 0.00 C ATOM 1183 CG ASP A 185 108.798 -18.258 1.557 1.00 0.00 C ATOM 1184 OD1 ASP A 185 108.572 -17.219 0.906 1.00 0.00 O ATOM 1185 OD2 ASP A 185 109.569 -19.157 1.163 1.00 0.00 O ATOM 0 H ASP A 185 110.422 -18.013 4.056 1.00 0.00 H new ATOM 0 HA ASP A 185 108.002 -16.401 3.492 1.00 0.00 H new ATOM 0 HB2 ASP A 185 108.392 -19.398 3.320 1.00 0.00 H new ATOM 0 HB3 ASP A 185 107.025 -18.472 2.734 1.00 0.00 H new ATOM 1190 N SER A 186 108.637 -17.344 6.274 1.00 0.00 N ATOM 1191 CA SER A 186 108.254 -17.553 7.657 1.00 0.00 C ATOM 1192 C SER A 186 107.203 -16.553 8.098 1.00 0.00 C ATOM 1193 O SER A 186 107.217 -15.399 7.677 1.00 0.00 O ATOM 1194 CB SER A 186 109.485 -17.407 8.549 1.00 0.00 C ATOM 1195 OG SER A 186 110.478 -18.353 8.196 1.00 0.00 O ATOM 0 H SER A 186 109.576 -16.962 6.162 1.00 0.00 H new ATOM 0 HA SER A 186 107.834 -18.555 7.745 1.00 0.00 H new ATOM 0 HB2 SER A 186 109.888 -16.399 8.457 1.00 0.00 H new ATOM 0 HB3 SER A 186 109.201 -17.543 9.593 1.00 0.00 H new ATOM 0 HG SER A 186 110.585 -19.002 8.923 1.00 0.00 H new ATOM 1201 N GLU A 187 106.304 -16.992 8.964 1.00 0.00 N ATOM 1202 CA GLU A 187 105.266 -16.110 9.470 1.00 0.00 C ATOM 1203 C GLU A 187 105.914 -14.834 9.988 1.00 0.00 C ATOM 1204 O GLU A 187 105.388 -13.732 9.841 1.00 0.00 O ATOM 1205 CB GLU A 187 104.466 -16.790 10.585 1.00 0.00 C ATOM 1206 CG GLU A 187 103.702 -18.025 10.131 1.00 0.00 C ATOM 1207 CD GLU A 187 104.605 -19.215 9.867 1.00 0.00 C ATOM 1208 OE1 GLU A 187 105.814 -19.122 10.163 1.00 0.00 O ATOM 1209 OE2 GLU A 187 104.098 -20.246 9.379 1.00 0.00 O ATOM 0 H GLU A 187 106.272 -17.944 9.328 1.00 0.00 H new ATOM 0 HA GLU A 187 104.573 -15.872 8.663 1.00 0.00 H new ATOM 0 HB2 GLU A 187 105.147 -17.071 11.388 1.00 0.00 H new ATOM 0 HB3 GLU A 187 103.761 -16.072 11.003 1.00 0.00 H new ATOM 0 HG2 GLU A 187 102.970 -18.293 10.893 1.00 0.00 H new ATOM 0 HG3 GLU A 187 103.146 -17.789 9.224 1.00 0.00 H new ATOM 1216 N GLY A 188 107.080 -15.015 10.591 1.00 0.00 N ATOM 1217 CA GLY A 188 107.829 -13.902 11.121 1.00 0.00 C ATOM 1218 C GLY A 188 108.304 -12.982 10.015 1.00 0.00 C ATOM 1219 O GLY A 188 108.236 -11.758 10.137 1.00 0.00 O ATOM 0 H GLY A 188 107.522 -15.925 10.722 1.00 0.00 H new ATOM 0 HA2 GLY A 188 107.208 -13.343 11.820 1.00 0.00 H new ATOM 0 HA3 GLY A 188 108.687 -14.272 11.682 1.00 0.00 H new ATOM 1223 N ALA A 189 108.789 -13.579 8.930 1.00 0.00 N ATOM 1224 CA ALA A 189 109.286 -12.824 7.788 1.00 0.00 C ATOM 1225 C ALA A 189 108.148 -12.174 6.996 1.00 0.00 C ATOM 1226 O ALA A 189 108.218 -10.993 6.655 1.00 0.00 O ATOM 1227 CB ALA A 189 110.110 -13.733 6.884 1.00 0.00 C ATOM 0 H ALA A 189 108.848 -14.591 8.819 1.00 0.00 H new ATOM 0 HA ALA A 189 109.918 -12.021 8.167 1.00 0.00 H new ATOM 0 HB1 ALA A 189 110.478 -13.162 6.032 1.00 0.00 H new ATOM 0 HB2 ALA A 189 110.954 -14.135 7.444 1.00 0.00 H new ATOM 0 HB3 ALA A 189 109.487 -14.554 6.528 1.00 0.00 H new ATOM 1233 N MET A 190 107.107 -12.950 6.690 1.00 0.00 N ATOM 1234 CA MET A 190 105.970 -12.442 5.922 1.00 0.00 C ATOM 1235 C MET A 190 105.366 -11.206 6.586 1.00 0.00 C ATOM 1236 O MET A 190 105.070 -10.213 5.921 1.00 0.00 O ATOM 1237 CB MET A 190 104.902 -13.530 5.765 1.00 0.00 C ATOM 1238 CG MET A 190 104.001 -13.681 6.980 1.00 0.00 C ATOM 1239 SD MET A 190 102.846 -15.060 6.840 1.00 0.00 S ATOM 1240 CE MET A 190 101.678 -14.420 5.641 1.00 0.00 C ATOM 0 H MET A 190 107.028 -13.930 6.962 1.00 0.00 H new ATOM 0 HA MET A 190 106.333 -12.156 4.935 1.00 0.00 H new ATOM 0 HB2 MET A 190 104.288 -13.301 4.894 1.00 0.00 H new ATOM 0 HB3 MET A 190 105.393 -14.483 5.567 1.00 0.00 H new ATOM 0 HG2 MET A 190 104.618 -13.821 7.867 1.00 0.00 H new ATOM 0 HG3 MET A 190 103.439 -12.758 7.125 1.00 0.00 H new ATOM 0 HE1 MET A 190 101.193 -15.250 5.127 1.00 0.00 H new ATOM 0 HE2 MET A 190 100.925 -13.819 6.151 1.00 0.00 H new ATOM 0 HE3 MET A 190 102.205 -13.801 4.915 1.00 0.00 H new ATOM 1250 N ASP A 191 105.204 -11.268 7.906 1.00 0.00 N ATOM 1251 CA ASP A 191 104.659 -10.150 8.667 1.00 0.00 C ATOM 1252 C ASP A 191 105.574 -8.944 8.552 1.00 0.00 C ATOM 1253 O ASP A 191 105.105 -7.809 8.485 1.00 0.00 O ATOM 1254 CB ASP A 191 104.480 -10.536 10.137 1.00 0.00 C ATOM 1255 CG ASP A 191 103.509 -11.685 10.321 1.00 0.00 C ATOM 1256 OD1 ASP A 191 102.966 -12.173 9.309 1.00 0.00 O ATOM 1257 OD2 ASP A 191 103.291 -12.098 11.480 1.00 0.00 O ATOM 0 H ASP A 191 105.443 -12.083 8.470 1.00 0.00 H new ATOM 0 HA ASP A 191 103.683 -9.895 8.255 1.00 0.00 H new ATOM 0 HB2 ASP A 191 105.447 -10.811 10.557 1.00 0.00 H new ATOM 0 HB3 ASP A 191 104.124 -9.671 10.696 1.00 0.00 H new ATOM 1262 N ALA A 192 106.878 -9.181 8.502 1.00 0.00 N ATOM 1263 CA ALA A 192 107.821 -8.089 8.363 1.00 0.00 C ATOM 1264 C ALA A 192 107.484 -7.303 7.102 1.00 0.00 C ATOM 1265 O ALA A 192 107.368 -6.078 7.127 1.00 0.00 O ATOM 1266 CB ALA A 192 109.245 -8.635 8.314 1.00 0.00 C ATOM 0 H ALA A 192 107.299 -10.108 8.555 1.00 0.00 H new ATOM 0 HA ALA A 192 107.752 -7.420 9.221 1.00 0.00 H new ATOM 0 HB1 ALA A 192 109.948 -7.809 8.209 1.00 0.00 H new ATOM 0 HB2 ALA A 192 109.458 -9.179 9.234 1.00 0.00 H new ATOM 0 HB3 ALA A 192 109.347 -9.308 7.463 1.00 0.00 H new ATOM 1272 N ALA A 193 107.310 -8.030 6.003 1.00 0.00 N ATOM 1273 CA ALA A 193 106.962 -7.424 4.726 1.00 0.00 C ATOM 1274 C ALA A 193 105.694 -6.589 4.856 1.00 0.00 C ATOM 1275 O ALA A 193 105.628 -5.471 4.355 1.00 0.00 O ATOM 1276 CB ALA A 193 106.809 -8.496 3.668 1.00 0.00 C ATOM 0 H ALA A 193 107.405 -9.045 5.973 1.00 0.00 H new ATOM 0 HA ALA A 193 107.767 -6.756 4.420 1.00 0.00 H new ATOM 0 HB1 ALA A 193 106.549 -8.033 2.716 1.00 0.00 H new ATOM 0 HB2 ALA A 193 107.748 -9.040 3.562 1.00 0.00 H new ATOM 0 HB3 ALA A 193 106.020 -9.188 3.963 1.00 0.00 H new ATOM 1282 N GLU A 194 104.688 -7.120 5.538 1.00 0.00 N ATOM 1283 CA GLU A 194 103.448 -6.375 5.721 1.00 0.00 C ATOM 1284 C GLU A 194 103.771 -4.984 6.259 1.00 0.00 C ATOM 1285 O GLU A 194 103.417 -3.980 5.643 1.00 0.00 O ATOM 1286 CB GLU A 194 102.499 -7.123 6.662 1.00 0.00 C ATOM 1287 CG GLU A 194 101.875 -8.358 6.035 1.00 0.00 C ATOM 1288 CD GLU A 194 100.954 -9.093 6.988 1.00 0.00 C ATOM 1289 OE1 GLU A 194 100.803 -8.635 8.140 1.00 0.00 O ATOM 1290 OE2 GLU A 194 100.382 -10.127 6.581 1.00 0.00 O ATOM 0 H GLU A 194 104.703 -8.045 5.967 1.00 0.00 H new ATOM 0 HA GLU A 194 102.943 -6.275 4.760 1.00 0.00 H new ATOM 0 HB2 GLU A 194 103.045 -7.417 7.558 1.00 0.00 H new ATOM 0 HB3 GLU A 194 101.706 -6.446 6.979 1.00 0.00 H new ATOM 0 HG2 GLU A 194 101.315 -8.066 5.147 1.00 0.00 H new ATOM 0 HG3 GLU A 194 102.665 -9.033 5.706 1.00 0.00 H new ATOM 1297 N ASP A 195 104.486 -4.923 7.370 1.00 0.00 N ATOM 1298 CA ASP A 195 104.891 -3.640 7.926 1.00 0.00 C ATOM 1299 C ASP A 195 105.656 -2.849 6.868 1.00 0.00 C ATOM 1300 O ASP A 195 105.430 -1.652 6.686 1.00 0.00 O ATOM 1301 CB ASP A 195 105.760 -3.843 9.163 1.00 0.00 C ATOM 1302 CG ASP A 195 106.134 -2.525 9.817 1.00 0.00 C ATOM 1303 OD1 ASP A 195 105.720 -1.468 9.296 1.00 0.00 O ATOM 1304 OD2 ASP A 195 106.838 -2.549 10.847 1.00 0.00 O ATOM 0 H ASP A 195 104.796 -5.737 7.901 1.00 0.00 H new ATOM 0 HA ASP A 195 104.002 -3.083 8.222 1.00 0.00 H new ATOM 0 HB2 ASP A 195 105.228 -4.466 9.882 1.00 0.00 H new ATOM 0 HB3 ASP A 195 106.667 -4.380 8.885 1.00 0.00 H new ATOM 1309 N HIS A 196 106.555 -3.534 6.170 1.00 0.00 N ATOM 1310 CA HIS A 196 107.359 -2.922 5.117 1.00 0.00 C ATOM 1311 C HIS A 196 106.476 -2.244 4.075 1.00 0.00 C ATOM 1312 O HIS A 196 106.640 -1.065 3.775 1.00 0.00 O ATOM 1313 CB HIS A 196 108.203 -4.006 4.445 1.00 0.00 C ATOM 1314 CG HIS A 196 109.113 -3.523 3.361 1.00 0.00 C ATOM 1315 ND1 HIS A 196 108.634 -2.892 2.238 1.00 0.00 N ATOM 1316 CD2 HIS A 196 110.451 -3.660 3.258 1.00 0.00 C ATOM 1317 CE1 HIS A 196 109.690 -2.663 1.475 1.00 0.00 C ATOM 1318 NE2 HIS A 196 110.817 -3.109 2.054 1.00 0.00 N ATOM 0 H HIS A 196 106.747 -4.525 6.317 1.00 0.00 H new ATOM 0 HA HIS A 196 108.001 -2.163 5.563 1.00 0.00 H new ATOM 0 HB2 HIS A 196 108.804 -4.502 5.208 1.00 0.00 H new ATOM 0 HB3 HIS A 196 107.534 -4.758 4.028 1.00 0.00 H new ATOM 0 HD2 HIS A 196 111.109 -4.116 3.983 1.00 0.00 H new ATOM 0 HE1 HIS A 196 109.651 -2.179 0.510 1.00 0.00 H new ATOM 0 HE2 HIS A 196 111.762 -3.050 1.673 1.00 0.00 H new ATOM 1326 N ARG A 197 105.548 -3.010 3.525 1.00 0.00 N ATOM 1327 CA ARG A 197 104.630 -2.526 2.501 1.00 0.00 C ATOM 1328 C ARG A 197 103.774 -1.367 3.014 1.00 0.00 C ATOM 1329 O ARG A 197 103.675 -0.323 2.369 1.00 0.00 O ATOM 1330 CB ARG A 197 103.735 -3.695 2.058 1.00 0.00 C ATOM 1331 CG ARG A 197 102.929 -3.462 0.784 1.00 0.00 C ATOM 1332 CD ARG A 197 101.847 -2.409 0.964 1.00 0.00 C ATOM 1333 NE ARG A 197 100.890 -2.419 -0.139 1.00 0.00 N ATOM 1334 CZ ARG A 197 99.835 -1.613 -0.203 1.00 0.00 C ATOM 1335 NH1 ARG A 197 99.608 -0.734 0.763 1.00 0.00 N ATOM 1336 NH2 ARG A 197 99.006 -1.684 -1.237 1.00 0.00 N ATOM 0 H ARG A 197 105.408 -3.989 3.776 1.00 0.00 H new ATOM 0 HA ARG A 197 105.207 -2.149 1.656 1.00 0.00 H new ATOM 0 HB2 ARG A 197 104.362 -4.575 1.914 1.00 0.00 H new ATOM 0 HB3 ARG A 197 103.043 -3.926 2.867 1.00 0.00 H new ATOM 0 HG2 ARG A 197 103.602 -3.154 -0.016 1.00 0.00 H new ATOM 0 HG3 ARG A 197 102.470 -4.400 0.471 1.00 0.00 H new ATOM 0 HD2 ARG A 197 101.321 -2.585 1.903 1.00 0.00 H new ATOM 0 HD3 ARG A 197 102.307 -1.424 1.036 1.00 0.00 H new ATOM 0 HE ARG A 197 101.039 -3.080 -0.901 1.00 0.00 H new ATOM 0 HH11 ARG A 197 100.244 -0.675 1.558 1.00 0.00 H new ATOM 0 HH12 ARG A 197 98.798 -0.117 0.711 1.00 0.00 H new ATOM 0 HH21 ARG A 197 99.178 -2.358 -1.983 1.00 0.00 H new ATOM 0 HH22 ARG A 197 98.197 -1.065 -1.285 1.00 0.00 H new ATOM 1350 N GLN A 198 103.138 -1.569 4.163 1.00 0.00 N ATOM 1351 CA GLN A 198 102.260 -0.556 4.743 1.00 0.00 C ATOM 1352 C GLN A 198 102.920 0.820 4.852 1.00 0.00 C ATOM 1353 O GLN A 198 102.523 1.769 4.182 1.00 0.00 O ATOM 1354 CB GLN A 198 101.793 -1.002 6.135 1.00 0.00 C ATOM 1355 CG GLN A 198 100.652 -2.008 6.107 1.00 0.00 C ATOM 1356 CD GLN A 198 100.986 -3.257 5.318 1.00 0.00 C ATOM 1357 OE1 GLN A 198 101.257 -3.193 4.121 1.00 0.00 O ATOM 1358 NE2 GLN A 198 100.963 -4.403 5.987 1.00 0.00 N ATOM 0 H GLN A 198 103.213 -2.425 4.712 1.00 0.00 H new ATOM 0 HA GLN A 198 101.412 -0.457 4.066 1.00 0.00 H new ATOM 0 HB2 GLN A 198 102.637 -1.439 6.668 1.00 0.00 H new ATOM 0 HB3 GLN A 198 101.478 -0.125 6.701 1.00 0.00 H new ATOM 0 HG2 GLN A 198 100.396 -2.288 7.129 1.00 0.00 H new ATOM 0 HG3 GLN A 198 99.769 -1.537 5.675 1.00 0.00 H new ATOM 0 HE21 GLN A 198 100.733 -4.409 6.981 1.00 0.00 H new ATOM 0 HE22 GLN A 198 101.176 -5.278 5.508 1.00 0.00 H new ATOM 1367 N GLY A 199 103.901 0.915 5.749 1.00 0.00 N ATOM 1368 CA GLY A 199 104.584 2.173 6.009 1.00 0.00 C ATOM 1369 C GLY A 199 105.424 2.720 4.867 1.00 0.00 C ATOM 1370 O GLY A 199 105.587 3.936 4.758 1.00 0.00 O ATOM 0 H GLY A 199 104.238 0.131 6.307 1.00 0.00 H new ATOM 0 HA2 GLY A 199 103.838 2.921 6.276 1.00 0.00 H new ATOM 0 HA3 GLY A 199 105.229 2.041 6.878 1.00 0.00 H new ATOM 1374 N ILE A 200 105.980 1.859 4.022 1.00 0.00 N ATOM 1375 CA ILE A 200 106.812 2.344 2.923 1.00 0.00 C ATOM 1376 C ILE A 200 105.967 3.059 1.872 1.00 0.00 C ATOM 1377 O ILE A 200 106.413 4.038 1.273 1.00 0.00 O ATOM 1378 CB ILE A 200 107.631 1.220 2.252 1.00 0.00 C ATOM 1379 CG1 ILE A 200 108.914 1.797 1.650 1.00 0.00 C ATOM 1380 CG2 ILE A 200 106.808 0.522 1.177 1.00 0.00 C ATOM 1381 CD1 ILE A 200 109.684 0.811 0.798 1.00 0.00 C ATOM 0 H ILE A 200 105.875 0.846 4.072 1.00 0.00 H new ATOM 0 HA ILE A 200 107.517 3.048 3.365 1.00 0.00 H new ATOM 0 HB ILE A 200 107.896 0.483 3.010 1.00 0.00 H new ATOM 0 HG12 ILE A 200 108.661 2.667 1.044 1.00 0.00 H new ATOM 0 HG13 ILE A 200 109.558 2.147 2.457 1.00 0.00 H new ATOM 0 HG21 ILE A 200 107.404 -0.266 0.717 1.00 0.00 H new ATOM 0 HG22 ILE A 200 105.916 0.087 1.627 1.00 0.00 H new ATOM 0 HG23 ILE A 200 106.514 1.246 0.416 1.00 0.00 H new ATOM 0 HD11 ILE A 200 110.580 1.291 0.406 1.00 0.00 H new ATOM 0 HD12 ILE A 200 109.969 -0.049 1.404 1.00 0.00 H new ATOM 0 HD13 ILE A 200 109.058 0.480 -0.030 1.00 0.00 H new ATOM 1393 N ALA A 201 104.742 2.586 1.664 1.00 0.00 N ATOM 1394 CA ALA A 201 103.851 3.210 0.702 1.00 0.00 C ATOM 1395 C ALA A 201 103.403 4.567 1.227 1.00 0.00 C ATOM 1396 O ALA A 201 103.108 5.490 0.467 1.00 0.00 O ATOM 1397 CB ALA A 201 102.651 2.312 0.429 1.00 0.00 C ATOM 0 H ALA A 201 104.349 1.778 2.147 1.00 0.00 H new ATOM 0 HA ALA A 201 104.383 3.355 -0.238 1.00 0.00 H new ATOM 0 HB1 ALA A 201 101.993 2.794 -0.294 1.00 0.00 H new ATOM 0 HB2 ALA A 201 102.994 1.358 0.028 1.00 0.00 H new ATOM 0 HB3 ALA A 201 102.106 2.140 1.357 1.00 0.00 H new ATOM 1403 N ARG A 202 103.357 4.657 2.544 1.00 0.00 N ATOM 1404 CA ARG A 202 102.950 5.863 3.244 1.00 0.00 C ATOM 1405 C ARG A 202 104.063 6.904 3.315 1.00 0.00 C ATOM 1406 O ARG A 202 103.817 8.032 3.743 1.00 0.00 O ATOM 1407 CB ARG A 202 102.514 5.504 4.668 1.00 0.00 C ATOM 1408 CG ARG A 202 101.334 4.543 4.734 1.00 0.00 C ATOM 1409 CD ARG A 202 100.014 5.178 4.306 1.00 0.00 C ATOM 1410 NE ARG A 202 99.586 6.254 5.201 1.00 0.00 N ATOM 1411 CZ ARG A 202 99.999 7.516 5.104 1.00 0.00 C ATOM 1412 NH1 ARG A 202 100.795 7.885 4.110 1.00 0.00 N ATOM 1413 NH2 ARG A 202 99.596 8.415 5.992 1.00 0.00 N ATOM 0 H ARG A 202 103.604 3.886 3.165 1.00 0.00 H new ATOM 0 HA ARG A 202 102.124 6.298 2.681 1.00 0.00 H new ATOM 0 HB2 ARG A 202 103.359 5.061 5.194 1.00 0.00 H new ATOM 0 HB3 ARG A 202 102.253 6.420 5.198 1.00 0.00 H new ATOM 0 HG2 ARG A 202 101.539 3.683 4.097 1.00 0.00 H new ATOM 0 HG3 ARG A 202 101.236 4.169 5.753 1.00 0.00 H new ATOM 0 HD2 ARG A 202 100.117 5.572 3.295 1.00 0.00 H new ATOM 0 HD3 ARG A 202 99.241 4.410 4.272 1.00 0.00 H new ATOM 0 HE ARG A 202 98.930 6.022 5.947 1.00 0.00 H new ATOM 0 HH11 ARG A 202 101.094 7.201 3.415 1.00 0.00 H new ATOM 0 HH12 ARG A 202 101.109 8.853 4.040 1.00 0.00 H new ATOM 0 HH21 ARG A 202 98.970 8.139 6.749 1.00 0.00 H new ATOM 0 HH22 ARG A 202 99.912 9.382 5.918 1.00 0.00 H new ATOM 1427 N ASN A 203 105.295 6.546 2.936 1.00 0.00 N ATOM 1428 CA ASN A 203 106.409 7.496 3.019 1.00 0.00 C ATOM 1429 C ASN A 203 106.836 8.004 1.644 1.00 0.00 C ATOM 1430 O ASN A 203 107.545 9.004 1.538 1.00 0.00 O ATOM 1431 CB ASN A 203 107.601 6.829 3.707 1.00 0.00 C ATOM 1432 CG ASN A 203 107.236 6.249 5.060 1.00 0.00 C ATOM 1433 OD1 ASN A 203 108.063 5.619 5.719 1.00 0.00 O ATOM 1434 ND2 ASN A 203 105.995 6.460 5.480 1.00 0.00 N ATOM 0 H ASN A 203 105.543 5.624 2.576 1.00 0.00 H new ATOM 0 HA ASN A 203 106.067 8.354 3.598 1.00 0.00 H new ATOM 0 HB2 ASN A 203 107.989 6.036 3.068 1.00 0.00 H new ATOM 0 HB3 ASN A 203 108.401 7.559 3.831 1.00 0.00 H new ATOM 0 HD21 ASN A 203 105.693 6.094 6.383 1.00 0.00 H new ATOM 0 HD22 ASN A 203 105.343 6.988 4.900 1.00 0.00 H new ATOM 1441 N HIS A 204 106.389 7.323 0.596 1.00 0.00 N ATOM 1442 CA HIS A 204 106.720 7.729 -0.769 1.00 0.00 C ATOM 1443 C HIS A 204 105.503 7.689 -1.684 1.00 0.00 C ATOM 1444 O HIS A 204 105.188 8.680 -2.343 1.00 0.00 O ATOM 1445 CB HIS A 204 107.855 6.878 -1.337 1.00 0.00 C ATOM 1446 CG HIS A 204 107.612 5.409 -1.232 1.00 0.00 C ATOM 1447 ND1 HIS A 204 106.482 4.833 -1.750 1.00 0.00 N ATOM 1448 CD2 HIS A 204 108.373 4.453 -0.656 1.00 0.00 C ATOM 1449 CE1 HIS A 204 106.578 3.548 -1.476 1.00 0.00 C ATOM 1450 NE2 HIS A 204 107.708 3.268 -0.819 1.00 0.00 N ATOM 0 H HIS A 204 105.800 6.493 0.661 1.00 0.00 H new ATOM 0 HA HIS A 204 107.060 8.764 -0.722 1.00 0.00 H new ATOM 0 HB2 HIS A 204 108.004 7.139 -2.385 1.00 0.00 H new ATOM 0 HB3 HIS A 204 108.779 7.123 -0.813 1.00 0.00 H new ATOM 0 HD2 HIS A 204 109.323 4.596 -0.162 1.00 0.00 H new ATOM 0 HE1 HIS A 204 105.836 2.812 -1.748 1.00 0.00 H new ATOM 0 HE2 HIS A 204 108.015 2.349 -0.501 1.00 0.00 H new ATOM 1458 N TYR A 205 104.816 6.553 -1.735 1.00 0.00 N ATOM 1459 CA TYR A 205 103.642 6.437 -2.590 1.00 0.00 C ATOM 1460 C TYR A 205 102.848 5.165 -2.332 1.00 0.00 C ATOM 1461 O TYR A 205 103.235 4.316 -1.540 1.00 0.00 O ATOM 1462 CB TYR A 205 104.046 6.494 -4.066 1.00 0.00 C ATOM 1463 CG TYR A 205 105.474 6.078 -4.335 1.00 0.00 C ATOM 1464 CD1 TYR A 205 105.846 4.740 -4.340 1.00 0.00 C ATOM 1465 CD2 TYR A 205 106.448 7.029 -4.600 1.00 0.00 C ATOM 1466 CE1 TYR A 205 107.151 4.365 -4.601 1.00 0.00 C ATOM 1467 CE2 TYR A 205 107.749 6.663 -4.869 1.00 0.00 C ATOM 1468 CZ TYR A 205 108.097 5.333 -4.869 1.00 0.00 C ATOM 1469 OH TYR A 205 109.391 4.970 -5.146 1.00 0.00 O ATOM 0 H TYR A 205 105.047 5.713 -1.204 1.00 0.00 H new ATOM 0 HA TYR A 205 102.998 7.282 -2.346 1.00 0.00 H new ATOM 0 HB2 TYR A 205 103.378 5.851 -4.639 1.00 0.00 H new ATOM 0 HB3 TYR A 205 103.901 7.510 -4.432 1.00 0.00 H new ATOM 0 HD1 TYR A 205 105.105 3.981 -4.137 1.00 0.00 H new ATOM 0 HD2 TYR A 205 106.182 8.076 -4.595 1.00 0.00 H new ATOM 0 HE1 TYR A 205 107.428 3.321 -4.595 1.00 0.00 H new ATOM 0 HE2 TYR A 205 108.492 7.418 -5.079 1.00 0.00 H new ATOM 0 HH TYR A 205 109.514 4.911 -6.117 1.00 0.00 H new ATOM 1479 N ASP A 206 101.732 5.054 -3.033 1.00 0.00 N ATOM 1480 CA ASP A 206 100.861 3.894 -2.915 1.00 0.00 C ATOM 1481 C ASP A 206 101.389 2.739 -3.757 1.00 0.00 C ATOM 1482 O ASP A 206 101.403 2.812 -4.986 1.00 0.00 O ATOM 1483 CB ASP A 206 99.446 4.253 -3.358 1.00 0.00 C ATOM 1484 CG ASP A 206 98.825 5.334 -2.495 1.00 0.00 C ATOM 1485 OD1 ASP A 206 99.391 6.447 -2.439 1.00 0.00 O ATOM 1486 OD2 ASP A 206 97.772 5.069 -1.877 1.00 0.00 O ATOM 0 H ASP A 206 101.405 5.758 -3.695 1.00 0.00 H new ATOM 0 HA ASP A 206 100.841 3.584 -1.870 1.00 0.00 H new ATOM 0 HB2 ASP A 206 99.467 4.588 -4.395 1.00 0.00 H new ATOM 0 HB3 ASP A 206 98.821 3.361 -3.324 1.00 0.00 H new ATOM 1491 N CYS A 207 101.823 1.673 -3.088 1.00 0.00 N ATOM 1492 CA CYS A 207 102.356 0.501 -3.775 1.00 0.00 C ATOM 1493 C CYS A 207 101.478 -0.724 -3.558 1.00 0.00 C ATOM 1494 O CYS A 207 100.942 -0.931 -2.469 1.00 0.00 O ATOM 1495 CB CYS A 207 103.772 0.196 -3.285 1.00 0.00 C ATOM 1496 SG CYS A 207 105.012 1.402 -3.804 1.00 0.00 S ATOM 0 H CYS A 207 101.816 1.598 -2.071 1.00 0.00 H new ATOM 0 HA CYS A 207 102.374 0.730 -4.840 1.00 0.00 H new ATOM 0 HB2 CYS A 207 103.764 0.145 -2.196 1.00 0.00 H new ATOM 0 HB3 CYS A 207 104.066 -0.789 -3.648 1.00 0.00 H new ATOM 0 HG CYS A 207 106.175 1.057 -3.338 1.00 0.00 H new ATOM 1502 N GLY A 208 101.358 -1.548 -4.592 1.00 0.00 N ATOM 1503 CA GLY A 208 100.571 -2.763 -4.490 1.00 0.00 C ATOM 1504 C GLY A 208 101.462 -3.973 -4.302 1.00 0.00 C ATOM 1505 O GLY A 208 102.686 -3.846 -4.299 1.00 0.00 O ATOM 0 H GLY A 208 101.793 -1.396 -5.502 1.00 0.00 H new ATOM 0 HA2 GLY A 208 99.879 -2.683 -3.652 1.00 0.00 H new ATOM 0 HA3 GLY A 208 99.969 -2.887 -5.390 1.00 0.00 H new ATOM 1509 N TYR A 209 100.867 -5.149 -4.155 1.00 0.00 N ATOM 1510 CA TYR A 209 101.644 -6.369 -3.982 1.00 0.00 C ATOM 1511 C TYR A 209 102.478 -6.643 -5.224 1.00 0.00 C ATOM 1512 O TYR A 209 103.694 -6.809 -5.147 1.00 0.00 O ATOM 1513 CB TYR A 209 100.716 -7.550 -3.704 1.00 0.00 C ATOM 1514 CG TYR A 209 99.868 -7.359 -2.466 1.00 0.00 C ATOM 1515 CD1 TYR A 209 100.457 -7.174 -1.222 1.00 0.00 C ATOM 1516 CD2 TYR A 209 98.480 -7.358 -2.541 1.00 0.00 C ATOM 1517 CE1 TYR A 209 99.689 -6.994 -0.089 1.00 0.00 C ATOM 1518 CE2 TYR A 209 97.705 -7.177 -1.412 1.00 0.00 C ATOM 1519 CZ TYR A 209 98.314 -6.996 -0.189 1.00 0.00 C ATOM 1520 OH TYR A 209 97.546 -6.815 0.938 1.00 0.00 O ATOM 0 H TYR A 209 99.856 -5.284 -4.152 1.00 0.00 H new ATOM 0 HA TYR A 209 102.313 -6.238 -3.131 1.00 0.00 H new ATOM 0 HB2 TYR A 209 100.064 -7.702 -4.564 1.00 0.00 H new ATOM 0 HB3 TYR A 209 101.313 -8.455 -3.592 1.00 0.00 H new ATOM 0 HD1 TYR A 209 101.534 -7.171 -1.140 1.00 0.00 H new ATOM 0 HD2 TYR A 209 98.000 -7.501 -3.498 1.00 0.00 H new ATOM 0 HE1 TYR A 209 100.163 -6.852 0.871 1.00 0.00 H new ATOM 0 HE2 TYR A 209 96.628 -7.177 -1.487 1.00 0.00 H new ATOM 0 HH TYR A 209 96.597 -6.842 0.695 1.00 0.00 H new ATOM 1530 N GLU A 210 101.813 -6.672 -6.371 1.00 0.00 N ATOM 1531 CA GLU A 210 102.483 -6.908 -7.640 1.00 0.00 C ATOM 1532 C GLU A 210 103.525 -5.827 -7.904 1.00 0.00 C ATOM 1533 O GLU A 210 104.610 -6.082 -8.441 1.00 0.00 O ATOM 1534 CB GLU A 210 101.453 -6.900 -8.773 1.00 0.00 C ATOM 1535 CG GLU A 210 102.057 -7.145 -10.146 1.00 0.00 C ATOM 1536 CD GLU A 210 101.017 -7.135 -11.249 1.00 0.00 C ATOM 1537 OE1 GLU A 210 100.344 -6.096 -11.422 1.00 0.00 O ATOM 1538 OE2 GLU A 210 100.877 -8.164 -11.943 1.00 0.00 O ATOM 0 H GLU A 210 100.805 -6.534 -6.447 1.00 0.00 H new ATOM 0 HA GLU A 210 102.980 -7.877 -7.595 1.00 0.00 H new ATOM 0 HB2 GLU A 210 100.701 -7.664 -8.575 1.00 0.00 H new ATOM 0 HB3 GLU A 210 100.938 -5.939 -8.778 1.00 0.00 H new ATOM 0 HG2 GLU A 210 102.807 -6.381 -10.351 1.00 0.00 H new ATOM 0 HG3 GLU A 210 102.573 -8.105 -10.146 1.00 0.00 H new ATOM 1545 N MET A 211 103.155 -4.605 -7.543 1.00 0.00 N ATOM 1546 CA MET A 211 103.998 -3.441 -7.754 1.00 0.00 C ATOM 1547 C MET A 211 105.372 -3.563 -7.102 1.00 0.00 C ATOM 1548 O MET A 211 106.370 -3.761 -7.799 1.00 0.00 O ATOM 1549 CB MET A 211 103.296 -2.178 -7.256 1.00 0.00 C ATOM 1550 CG MET A 211 101.971 -1.905 -7.947 1.00 0.00 C ATOM 1551 SD MET A 211 102.150 -1.688 -9.728 1.00 0.00 S ATOM 1552 CE MET A 211 100.448 -1.392 -10.206 1.00 0.00 C ATOM 0 H MET A 211 102.262 -4.396 -7.096 1.00 0.00 H new ATOM 0 HA MET A 211 104.164 -3.375 -8.829 1.00 0.00 H new ATOM 0 HB2 MET A 211 103.125 -2.267 -6.183 1.00 0.00 H new ATOM 0 HB3 MET A 211 103.956 -1.323 -7.404 1.00 0.00 H new ATOM 0 HG2 MET A 211 101.287 -2.731 -7.752 1.00 0.00 H new ATOM 0 HG3 MET A 211 101.520 -1.010 -7.519 1.00 0.00 H new ATOM 0 HE1 MET A 211 100.394 -1.239 -11.284 1.00 0.00 H new ATOM 0 HE2 MET A 211 99.838 -2.252 -9.931 1.00 0.00 H new ATOM 0 HE3 MET A 211 100.075 -0.505 -9.694 1.00 0.00 H new ATOM 1562 N HIS A 212 105.457 -3.386 -5.779 1.00 0.00 N ATOM 1563 CA HIS A 212 106.768 -3.422 -5.134 1.00 0.00 C ATOM 1564 C HIS A 212 107.314 -4.830 -4.901 1.00 0.00 C ATOM 1565 O HIS A 212 108.525 -4.966 -4.743 1.00 0.00 O ATOM 1566 CB HIS A 212 106.859 -2.508 -3.906 1.00 0.00 C ATOM 1567 CG HIS A 212 107.057 -3.220 -2.600 1.00 0.00 C ATOM 1568 ND1 HIS A 212 106.131 -4.109 -2.109 1.00 0.00 N ATOM 1569 CD2 HIS A 212 108.077 -3.108 -1.716 1.00 0.00 C ATOM 1570 CE1 HIS A 212 106.605 -4.514 -0.940 1.00 0.00 C ATOM 1571 NE2 HIS A 212 107.782 -3.933 -0.662 1.00 0.00 N ATOM 0 H HIS A 212 104.666 -3.223 -5.157 1.00 0.00 H new ATOM 0 HA HIS A 212 107.454 -2.993 -5.865 1.00 0.00 H new ATOM 0 HB2 HIS A 212 107.684 -1.810 -4.051 1.00 0.00 H new ATOM 0 HB3 HIS A 212 105.947 -1.915 -3.845 1.00 0.00 H new ATOM 0 HD1 HIS A 212 105.259 -4.397 -2.553 1.00 0.00 H new ATOM 0 HD2 HIS A 212 108.955 -2.487 -1.821 1.00 0.00 H new ATOM 0 HE1 HIS A 212 106.107 -5.222 -0.293 1.00 0.00 H new ATOM 1579 N THR A 213 106.524 -5.898 -5.007 1.00 0.00 N ATOM 1580 CA THR A 213 107.143 -7.217 -4.938 1.00 0.00 C ATOM 1581 C THR A 213 108.256 -7.189 -5.974 1.00 0.00 C ATOM 1582 O THR A 213 109.413 -7.504 -5.688 1.00 0.00 O ATOM 1583 CB THR A 213 106.145 -8.325 -5.276 1.00 0.00 C ATOM 1584 OG1 THR A 213 106.749 -9.598 -5.155 1.00 0.00 O ATOM 1585 CG2 THR A 213 105.579 -8.237 -6.663 1.00 0.00 C ATOM 0 H THR A 213 105.512 -5.882 -5.134 1.00 0.00 H new ATOM 0 HA THR A 213 107.508 -7.427 -3.933 1.00 0.00 H new ATOM 0 HB THR A 213 105.333 -8.190 -4.562 1.00 0.00 H new ATOM 0 HG1 THR A 213 106.444 -10.175 -5.886 1.00 0.00 H new ATOM 0 HG21 THR A 213 104.880 -9.058 -6.824 1.00 0.00 H new ATOM 0 HG22 THR A 213 105.057 -7.288 -6.783 1.00 0.00 H new ATOM 0 HG23 THR A 213 106.388 -8.301 -7.391 1.00 0.00 H new ATOM 1593 N CYS A 214 107.893 -6.721 -7.172 1.00 0.00 N ATOM 1594 CA CYS A 214 108.857 -6.547 -8.245 1.00 0.00 C ATOM 1595 C CYS A 214 109.922 -5.545 -7.814 1.00 0.00 C ATOM 1596 O CYS A 214 111.093 -5.715 -8.143 1.00 0.00 O ATOM 1597 CB CYS A 214 108.180 -6.096 -9.539 1.00 0.00 C ATOM 1598 SG CYS A 214 109.330 -5.445 -10.795 1.00 0.00 S ATOM 0 H CYS A 214 106.938 -6.458 -7.416 1.00 0.00 H new ATOM 0 HA CYS A 214 109.328 -7.509 -8.447 1.00 0.00 H new ATOM 0 HB2 CYS A 214 107.635 -6.939 -9.964 1.00 0.00 H new ATOM 0 HB3 CYS A 214 107.444 -5.327 -9.302 1.00 0.00 H new ATOM 1603 N LEU A 215 109.561 -4.535 -7.033 1.00 0.00 N ATOM 1604 CA LEU A 215 110.584 -3.614 -6.559 1.00 0.00 C ATOM 1605 C LEU A 215 111.618 -4.435 -5.800 1.00 0.00 C ATOM 1606 O LEU A 215 112.825 -4.227 -5.918 1.00 0.00 O ATOM 1607 CB LEU A 215 109.999 -2.516 -5.657 1.00 0.00 C ATOM 1608 CG LEU A 215 111.017 -1.502 -5.122 1.00 0.00 C ATOM 1609 CD1 LEU A 215 111.942 -2.136 -4.084 1.00 0.00 C ATOM 1610 CD2 LEU A 215 111.826 -0.915 -6.270 1.00 0.00 C ATOM 0 H LEU A 215 108.609 -4.337 -6.725 1.00 0.00 H new ATOM 0 HA LEU A 215 111.036 -3.103 -7.409 1.00 0.00 H new ATOM 0 HB2 LEU A 215 109.233 -1.978 -6.216 1.00 0.00 H new ATOM 0 HB3 LEU A 215 109.502 -2.990 -4.810 1.00 0.00 H new ATOM 0 HG LEU A 215 110.468 -0.700 -4.630 1.00 0.00 H new ATOM 0 HD11 LEU A 215 112.651 -1.390 -3.725 1.00 0.00 H new ATOM 0 HD12 LEU A 215 111.350 -2.506 -3.247 1.00 0.00 H new ATOM 0 HD13 LEU A 215 112.485 -2.964 -4.539 1.00 0.00 H new ATOM 0 HD21 LEU A 215 112.546 -0.196 -5.878 1.00 0.00 H new ATOM 0 HD22 LEU A 215 112.357 -1.714 -6.787 1.00 0.00 H new ATOM 0 HD23 LEU A 215 111.156 -0.413 -6.968 1.00 0.00 H new ATOM 1622 N GLY A 216 111.102 -5.382 -5.024 1.00 0.00 N ATOM 1623 CA GLY A 216 111.933 -6.265 -4.230 1.00 0.00 C ATOM 1624 C GLY A 216 112.992 -7.004 -5.035 1.00 0.00 C ATOM 1625 O GLY A 216 114.091 -7.236 -4.534 1.00 0.00 O ATOM 0 H GLY A 216 110.101 -5.555 -4.931 1.00 0.00 H new ATOM 0 HA2 GLY A 216 112.424 -5.682 -3.451 1.00 0.00 H new ATOM 0 HA3 GLY A 216 111.296 -6.995 -3.729 1.00 0.00 H new ATOM 1629 N GLU A 217 112.674 -7.401 -6.269 1.00 0.00 N ATOM 1630 CA GLU A 217 113.645 -8.140 -7.083 1.00 0.00 C ATOM 1631 C GLU A 217 114.718 -7.231 -7.681 1.00 0.00 C ATOM 1632 O GLU A 217 115.889 -7.606 -7.687 1.00 0.00 O ATOM 1633 CB GLU A 217 112.969 -8.984 -8.172 1.00 0.00 C ATOM 1634 CG GLU A 217 112.353 -8.173 -9.296 1.00 0.00 C ATOM 1635 CD GLU A 217 111.836 -9.042 -10.425 1.00 0.00 C ATOM 1636 OE1 GLU A 217 112.646 -9.780 -11.024 1.00 0.00 O ATOM 1637 OE2 GLU A 217 110.621 -8.986 -10.710 1.00 0.00 O ATOM 0 H GLU A 217 111.775 -7.230 -6.719 1.00 0.00 H new ATOM 0 HA GLU A 217 114.146 -8.826 -6.400 1.00 0.00 H new ATOM 0 HB2 GLU A 217 113.705 -9.668 -8.594 1.00 0.00 H new ATOM 0 HB3 GLU A 217 112.192 -9.595 -7.712 1.00 0.00 H new ATOM 0 HG2 GLU A 217 111.534 -7.573 -8.900 1.00 0.00 H new ATOM 0 HG3 GLU A 217 113.096 -7.479 -9.688 1.00 0.00 H new ATOM 1644 N MET A 218 114.370 -6.040 -8.164 1.00 0.00 N ATOM 1645 CA MET A 218 115.410 -5.165 -8.707 1.00 0.00 C ATOM 1646 C MET A 218 116.139 -4.500 -7.550 1.00 0.00 C ATOM 1647 O MET A 218 117.050 -3.691 -7.735 1.00 0.00 O ATOM 1648 CB MET A 218 114.840 -4.097 -9.647 1.00 0.00 C ATOM 1649 CG MET A 218 114.024 -4.664 -10.799 1.00 0.00 C ATOM 1650 SD MET A 218 112.283 -4.851 -10.383 1.00 0.00 S ATOM 1651 CE MET A 218 111.808 -3.132 -10.229 1.00 0.00 C ATOM 0 H MET A 218 113.420 -5.669 -8.192 1.00 0.00 H new ATOM 0 HA MET A 218 116.095 -5.774 -9.296 1.00 0.00 H new ATOM 0 HB2 MET A 218 114.213 -3.416 -9.071 1.00 0.00 H new ATOM 0 HB3 MET A 218 115.662 -3.507 -10.052 1.00 0.00 H new ATOM 0 HG2 MET A 218 114.119 -4.009 -11.665 1.00 0.00 H new ATOM 0 HG3 MET A 218 114.432 -5.633 -11.087 1.00 0.00 H new ATOM 0 HE1 MET A 218 110.726 -3.043 -10.327 1.00 0.00 H new ATOM 0 HE2 MET A 218 112.116 -2.755 -9.253 1.00 0.00 H new ATOM 0 HE3 MET A 218 112.293 -2.549 -11.012 1.00 0.00 H new ATOM 1661 N TYR A 219 115.671 -4.828 -6.350 1.00 0.00 N ATOM 1662 CA TYR A 219 116.185 -4.266 -5.109 1.00 0.00 C ATOM 1663 C TYR A 219 117.657 -4.622 -4.923 1.00 0.00 C ATOM 1664 O TYR A 219 118.530 -3.766 -4.776 1.00 0.00 O ATOM 1665 CB TYR A 219 115.371 -4.878 -3.966 1.00 0.00 C ATOM 1666 CG TYR A 219 115.308 -4.084 -2.677 1.00 0.00 C ATOM 1667 CD1 TYR A 219 115.889 -2.824 -2.542 1.00 0.00 C ATOM 1668 CD2 TYR A 219 114.628 -4.608 -1.585 1.00 0.00 C ATOM 1669 CE1 TYR A 219 115.791 -2.123 -1.356 1.00 0.00 C ATOM 1670 CE2 TYR A 219 114.524 -3.911 -0.401 1.00 0.00 C ATOM 1671 CZ TYR A 219 115.106 -2.669 -0.289 1.00 0.00 C ATOM 1672 OH TYR A 219 115.000 -1.973 0.891 1.00 0.00 O ATOM 0 H TYR A 219 114.916 -5.499 -6.212 1.00 0.00 H new ATOM 0 HA TYR A 219 116.100 -3.179 -5.126 1.00 0.00 H new ATOM 0 HB2 TYR A 219 114.352 -5.035 -4.320 1.00 0.00 H new ATOM 0 HB3 TYR A 219 115.785 -5.861 -3.741 1.00 0.00 H new ATOM 0 HD1 TYR A 219 116.422 -2.391 -3.375 1.00 0.00 H new ATOM 0 HD2 TYR A 219 114.171 -5.583 -1.666 1.00 0.00 H new ATOM 0 HE1 TYR A 219 116.249 -1.149 -1.264 1.00 0.00 H new ATOM 0 HE2 TYR A 219 113.989 -4.337 0.435 1.00 0.00 H new ATOM 0 HH TYR A 219 114.485 -2.501 1.537 1.00 0.00 H new ATOM 1682 N VAL A 220 117.884 -5.936 -4.936 1.00 0.00 N ATOM 1683 CA VAL A 220 119.197 -6.550 -4.780 1.00 0.00 C ATOM 1684 C VAL A 220 120.141 -6.206 -5.925 1.00 0.00 C ATOM 1685 O VAL A 220 121.356 -6.121 -5.746 1.00 0.00 O ATOM 1686 CB VAL A 220 119.043 -8.084 -4.748 1.00 0.00 C ATOM 1687 CG1 VAL A 220 118.236 -8.573 -5.940 1.00 0.00 C ATOM 1688 CG2 VAL A 220 120.406 -8.760 -4.705 1.00 0.00 C ATOM 0 H VAL A 220 117.137 -6.619 -5.059 1.00 0.00 H new ATOM 0 HA VAL A 220 119.619 -6.165 -3.852 1.00 0.00 H new ATOM 0 HB VAL A 220 118.501 -8.351 -3.841 1.00 0.00 H new ATOM 0 HG11 VAL A 220 118.141 -9.658 -5.895 1.00 0.00 H new ATOM 0 HG12 VAL A 220 117.244 -8.121 -5.918 1.00 0.00 H new ATOM 0 HG13 VAL A 220 118.743 -8.291 -6.863 1.00 0.00 H new ATOM 0 HG21 VAL A 220 120.275 -9.842 -4.683 1.00 0.00 H new ATOM 0 HG22 VAL A 220 120.978 -8.482 -5.590 1.00 0.00 H new ATOM 0 HG23 VAL A 220 120.942 -8.441 -3.811 1.00 0.00 H new ATOM 1698 N SER A 221 119.564 -6.059 -7.112 1.00 0.00 N ATOM 1699 CA SER A 221 120.330 -5.781 -8.320 1.00 0.00 C ATOM 1700 C SER A 221 121.196 -4.537 -8.189 1.00 0.00 C ATOM 1701 O SER A 221 122.368 -4.559 -8.564 1.00 0.00 O ATOM 1702 CB SER A 221 119.392 -5.639 -9.520 1.00 0.00 C ATOM 1703 OG SER A 221 120.119 -5.367 -10.706 1.00 0.00 O ATOM 0 H SER A 221 118.558 -6.129 -7.263 1.00 0.00 H new ATOM 0 HA SER A 221 121.000 -6.627 -8.474 1.00 0.00 H new ATOM 0 HB2 SER A 221 118.815 -6.555 -9.645 1.00 0.00 H new ATOM 0 HB3 SER A 221 118.678 -4.836 -9.335 1.00 0.00 H new ATOM 0 HG SER A 221 119.497 -5.282 -11.459 1.00 0.00 H new ATOM 1709 N ASP A 222 120.639 -3.446 -7.680 1.00 0.00 N ATOM 1710 CA ASP A 222 121.414 -2.219 -7.546 1.00 0.00 C ATOM 1711 C ASP A 222 122.219 -2.206 -6.249 1.00 0.00 C ATOM 1712 O ASP A 222 121.680 -2.404 -5.160 1.00 0.00 O ATOM 1713 CB ASP A 222 120.502 -0.998 -7.632 1.00 0.00 C ATOM 1714 CG ASP A 222 119.877 -0.838 -9.004 1.00 0.00 C ATOM 1715 OD1 ASP A 222 120.633 -0.694 -9.988 1.00 0.00 O ATOM 1716 OD2 ASP A 222 118.632 -0.858 -9.095 1.00 0.00 O ATOM 0 H ASP A 222 119.673 -3.384 -7.359 1.00 0.00 H new ATOM 0 HA ASP A 222 122.123 -2.180 -8.373 1.00 0.00 H new ATOM 0 HB2 ASP A 222 119.713 -1.084 -6.884 1.00 0.00 H new ATOM 0 HB3 ASP A 222 121.075 -0.103 -7.390 1.00 0.00 H new ATOM 1721 N GLU A 223 123.514 -1.954 -6.391 1.00 0.00 N ATOM 1722 CA GLU A 223 124.439 -1.887 -5.263 1.00 0.00 C ATOM 1723 C GLU A 223 124.211 -0.657 -4.397 1.00 0.00 C ATOM 1724 O GLU A 223 124.532 -0.675 -3.211 1.00 0.00 O ATOM 1725 CB GLU A 223 125.885 -1.887 -5.773 1.00 0.00 C ATOM 1726 CG GLU A 223 126.928 -1.730 -4.677 1.00 0.00 C ATOM 1727 CD GLU A 223 127.047 -0.301 -4.180 1.00 0.00 C ATOM 1728 OE1 GLU A 223 126.380 0.586 -4.752 1.00 0.00 O ATOM 1729 OE2 GLU A 223 127.820 -0.067 -3.229 1.00 0.00 O ATOM 0 H GLU A 223 123.956 -1.789 -7.295 1.00 0.00 H new ATOM 0 HA GLU A 223 124.255 -2.766 -4.645 1.00 0.00 H new ATOM 0 HB2 GLU A 223 126.071 -2.819 -6.307 1.00 0.00 H new ATOM 0 HB3 GLU A 223 126.005 -1.078 -6.493 1.00 0.00 H new ATOM 0 HG2 GLU A 223 126.671 -2.381 -3.841 1.00 0.00 H new ATOM 0 HG3 GLU A 223 127.896 -2.061 -5.053 1.00 0.00 H new ATOM 1736 N ARG A 224 123.699 0.427 -4.972 1.00 0.00 N ATOM 1737 CA ARG A 224 123.505 1.640 -4.186 1.00 0.00 C ATOM 1738 C ARG A 224 122.384 1.471 -3.162 1.00 0.00 C ATOM 1739 O ARG A 224 122.478 1.987 -2.047 1.00 0.00 O ATOM 1740 CB ARG A 224 123.266 2.854 -5.083 1.00 0.00 C ATOM 1741 CG ARG A 224 124.388 3.101 -6.078 1.00 0.00 C ATOM 1742 CD ARG A 224 124.083 4.286 -6.980 1.00 0.00 C ATOM 1743 NE ARG A 224 125.155 4.528 -7.943 1.00 0.00 N ATOM 1744 CZ ARG A 224 125.120 5.493 -8.857 1.00 0.00 C ATOM 1745 NH1 ARG A 224 124.069 6.299 -8.934 1.00 0.00 N ATOM 1746 NH2 ARG A 224 126.135 5.653 -9.695 1.00 0.00 N ATOM 0 H ARG A 224 123.418 0.492 -5.950 1.00 0.00 H new ATOM 0 HA ARG A 224 124.426 1.820 -3.632 1.00 0.00 H new ATOM 0 HB2 ARG A 224 122.332 2.716 -5.627 1.00 0.00 H new ATOM 0 HB3 ARG A 224 123.143 3.739 -4.459 1.00 0.00 H new ATOM 0 HG2 ARG A 224 125.319 3.282 -5.541 1.00 0.00 H new ATOM 0 HG3 ARG A 224 124.539 2.209 -6.686 1.00 0.00 H new ATOM 0 HD2 ARG A 224 123.150 4.105 -7.513 1.00 0.00 H new ATOM 0 HD3 ARG A 224 123.934 5.177 -6.371 1.00 0.00 H new ATOM 0 HE ARG A 224 125.976 3.923 -7.912 1.00 0.00 H new ATOM 0 HH11 ARG A 224 123.286 6.179 -8.291 1.00 0.00 H new ATOM 0 HH12 ARG A 224 124.044 7.039 -9.636 1.00 0.00 H new ATOM 0 HH21 ARG A 224 126.945 5.035 -9.639 1.00 0.00 H new ATOM 0 HH22 ARG A 224 126.106 6.394 -10.395 1.00 0.00 H new ATOM 1760 N PHE A 225 121.361 0.685 -3.494 1.00 0.00 N ATOM 1761 CA PHE A 225 120.281 0.392 -2.560 1.00 0.00 C ATOM 1762 C PHE A 225 120.728 -0.663 -1.559 1.00 0.00 C ATOM 1763 O PHE A 225 120.568 -0.514 -0.350 1.00 0.00 O ATOM 1764 CB PHE A 225 119.064 -0.154 -3.321 1.00 0.00 C ATOM 1765 CG PHE A 225 118.219 0.901 -3.984 1.00 0.00 C ATOM 1766 CD1 PHE A 225 117.278 1.603 -3.250 1.00 0.00 C ATOM 1767 CD2 PHE A 225 118.353 1.183 -5.335 1.00 0.00 C ATOM 1768 CE1 PHE A 225 116.488 2.566 -3.847 1.00 0.00 C ATOM 1769 CE2 PHE A 225 117.563 2.141 -5.940 1.00 0.00 C ATOM 1770 CZ PHE A 225 116.630 2.834 -5.194 1.00 0.00 C ATOM 0 H PHE A 225 121.260 0.240 -4.406 1.00 0.00 H new ATOM 0 HA PHE A 225 120.018 1.313 -2.040 1.00 0.00 H new ATOM 0 HB2 PHE A 225 119.411 -0.855 -4.081 1.00 0.00 H new ATOM 0 HB3 PHE A 225 118.441 -0.718 -2.627 1.00 0.00 H new ATOM 0 HD1 PHE A 225 117.160 1.395 -2.197 1.00 0.00 H new ATOM 0 HD2 PHE A 225 119.084 0.647 -5.922 1.00 0.00 H new ATOM 0 HE1 PHE A 225 115.761 3.108 -3.261 1.00 0.00 H new ATOM 0 HE2 PHE A 225 117.675 2.348 -6.994 1.00 0.00 H new ATOM 0 HZ PHE A 225 116.012 3.585 -5.664 1.00 0.00 H new ATOM 1780 N THR A 226 121.268 -1.747 -2.100 1.00 0.00 N ATOM 1781 CA THR A 226 121.730 -2.881 -1.310 1.00 0.00 C ATOM 1782 C THR A 226 122.867 -2.522 -0.362 1.00 0.00 C ATOM 1783 O THR A 226 122.872 -2.948 0.790 1.00 0.00 O ATOM 1784 CB THR A 226 122.193 -3.999 -2.247 1.00 0.00 C ATOM 1785 OG1 THR A 226 121.111 -4.484 -3.021 1.00 0.00 O ATOM 1786 CG2 THR A 226 122.808 -5.181 -1.521 1.00 0.00 C ATOM 0 H THR A 226 121.399 -1.865 -3.105 1.00 0.00 H new ATOM 0 HA THR A 226 120.889 -3.207 -0.698 1.00 0.00 H new ATOM 0 HB THR A 226 122.959 -3.546 -2.877 1.00 0.00 H new ATOM 0 HG1 THR A 226 121.048 -3.970 -3.853 1.00 0.00 H new ATOM 0 HG21 THR A 226 123.113 -5.935 -2.247 1.00 0.00 H new ATOM 0 HG22 THR A 226 123.678 -4.848 -0.956 1.00 0.00 H new ATOM 0 HG23 THR A 226 122.075 -5.610 -0.838 1.00 0.00 H new ATOM 1794 N ARG A 227 123.840 -1.764 -0.850 1.00 0.00 N ATOM 1795 CA ARG A 227 124.994 -1.390 -0.040 1.00 0.00 C ATOM 1796 C ARG A 227 124.613 -0.424 1.074 1.00 0.00 C ATOM 1797 O ARG A 227 125.145 -0.504 2.183 1.00 0.00 O ATOM 1798 CB ARG A 227 126.071 -0.783 -0.948 1.00 0.00 C ATOM 1799 CG ARG A 227 127.382 -0.434 -0.255 1.00 0.00 C ATOM 1800 CD ARG A 227 127.340 0.942 0.403 1.00 0.00 C ATOM 1801 NE ARG A 227 126.959 1.987 -0.541 1.00 0.00 N ATOM 1802 CZ ARG A 227 126.815 3.265 -0.204 1.00 0.00 C ATOM 1803 NH1 ARG A 227 127.014 3.646 1.051 1.00 0.00 N ATOM 1804 NH2 ARG A 227 126.471 4.160 -1.119 1.00 0.00 N ATOM 0 H ARG A 227 123.854 -1.396 -1.801 1.00 0.00 H new ATOM 0 HA ARG A 227 125.387 -2.286 0.441 1.00 0.00 H new ATOM 0 HB2 ARG A 227 126.281 -1.485 -1.755 1.00 0.00 H new ATOM 0 HB3 ARG A 227 125.670 0.120 -1.407 1.00 0.00 H new ATOM 0 HG2 ARG A 227 127.604 -1.189 0.500 1.00 0.00 H new ATOM 0 HG3 ARG A 227 128.194 -0.462 -0.982 1.00 0.00 H new ATOM 0 HD2 ARG A 227 126.632 0.926 1.232 1.00 0.00 H new ATOM 0 HD3 ARG A 227 128.319 1.173 0.824 1.00 0.00 H new ATOM 0 HE ARG A 227 126.794 1.723 -1.512 1.00 0.00 H new ATOM 0 HH11 ARG A 227 127.277 2.959 1.757 1.00 0.00 H new ATOM 0 HH12 ARG A 227 126.904 4.626 1.310 1.00 0.00 H new ATOM 0 HH21 ARG A 227 126.316 3.869 -2.084 1.00 0.00 H new ATOM 0 HH22 ARG A 227 126.361 5.140 -0.858 1.00 0.00 H new ATOM 1818 N ASN A 228 123.669 0.465 0.794 1.00 0.00 N ATOM 1819 CA ASN A 228 123.226 1.410 1.809 1.00 0.00 C ATOM 1820 C ASN A 228 122.379 0.681 2.845 1.00 0.00 C ATOM 1821 O ASN A 228 122.459 0.961 4.041 1.00 0.00 O ATOM 1822 CB ASN A 228 122.466 2.579 1.174 1.00 0.00 C ATOM 1823 CG ASN A 228 123.365 3.458 0.328 1.00 0.00 C ATOM 1824 OD1 ASN A 228 124.003 2.990 -0.615 1.00 0.00 O ATOM 1825 ND2 ASN A 228 123.421 4.742 0.663 1.00 0.00 N ATOM 0 H ASN A 228 123.203 0.551 -0.109 1.00 0.00 H new ATOM 0 HA ASN A 228 124.096 1.834 2.311 1.00 0.00 H new ATOM 0 HB2 ASN A 228 121.656 2.190 0.556 1.00 0.00 H new ATOM 0 HB3 ASN A 228 122.008 3.181 1.959 1.00 0.00 H new ATOM 0 HD21 ASN A 228 124.010 5.383 0.131 1.00 0.00 H new ATOM 0 HD22 ASN A 228 122.875 5.087 1.452 1.00 0.00 H new ATOM 1832 N ILE A 229 121.590 -0.275 2.375 1.00 0.00 N ATOM 1833 CA ILE A 229 120.748 -1.076 3.253 1.00 0.00 C ATOM 1834 C ILE A 229 121.561 -2.111 4.028 1.00 0.00 C ATOM 1835 O ILE A 229 121.501 -2.166 5.256 1.00 0.00 O ATOM 1836 CB ILE A 229 119.640 -1.795 2.467 1.00 0.00 C ATOM 1837 CG1 ILE A 229 118.658 -0.772 1.901 1.00 0.00 C ATOM 1838 CG2 ILE A 229 118.915 -2.797 3.359 1.00 0.00 C ATOM 1839 CD1 ILE A 229 117.636 -1.371 0.967 1.00 0.00 C ATOM 0 H ILE A 229 121.515 -0.516 1.387 1.00 0.00 H new ATOM 0 HA ILE A 229 120.294 -0.382 3.960 1.00 0.00 H new ATOM 0 HB ILE A 229 120.093 -2.343 1.641 1.00 0.00 H new ATOM 0 HG12 ILE A 229 118.141 -0.281 2.726 1.00 0.00 H new ATOM 0 HG13 ILE A 229 119.215 -0.000 1.370 1.00 0.00 H new ATOM 0 HG21 ILE A 229 118.134 -3.296 2.785 1.00 0.00 H new ATOM 0 HG22 ILE A 229 119.625 -3.538 3.726 1.00 0.00 H new ATOM 0 HG23 ILE A 229 118.467 -2.274 4.204 1.00 0.00 H new ATOM 0 HD11 ILE A 229 116.972 -0.587 0.603 1.00 0.00 H new ATOM 0 HD12 ILE A 229 118.144 -1.837 0.123 1.00 0.00 H new ATOM 0 HD13 ILE A 229 117.053 -2.122 1.499 1.00 0.00 H new ATOM 1851 N ASP A 230 122.292 -2.958 3.302 1.00 0.00 N ATOM 1852 CA ASP A 230 123.078 -4.017 3.930 1.00 0.00 C ATOM 1853 C ASP A 230 124.190 -3.469 4.816 1.00 0.00 C ATOM 1854 O ASP A 230 124.824 -4.226 5.551 1.00 0.00 O ATOM 1855 CB ASP A 230 123.647 -4.993 2.896 1.00 0.00 C ATOM 1856 CG ASP A 230 124.693 -4.355 2.002 1.00 0.00 C ATOM 1857 OD1 ASP A 230 125.655 -3.768 2.541 1.00 0.00 O ATOM 1858 OD2 ASP A 230 124.562 -4.460 0.765 1.00 0.00 O ATOM 0 H ASP A 230 122.355 -2.931 2.284 1.00 0.00 H new ATOM 0 HA ASP A 230 122.388 -4.565 4.572 1.00 0.00 H new ATOM 0 HB2 ASP A 230 124.087 -5.846 3.412 1.00 0.00 H new ATOM 0 HB3 ASP A 230 122.834 -5.378 2.280 1.00 0.00 H new ATOM 1863 N ALA A 231 124.426 -2.163 4.776 1.00 0.00 N ATOM 1864 CA ALA A 231 125.462 -1.582 5.618 1.00 0.00 C ATOM 1865 C ALA A 231 125.260 -2.041 7.062 1.00 0.00 C ATOM 1866 O ALA A 231 126.208 -2.118 7.844 1.00 0.00 O ATOM 1867 CB ALA A 231 125.434 -0.064 5.529 1.00 0.00 C ATOM 0 H ALA A 231 123.926 -1.500 4.184 1.00 0.00 H new ATOM 0 HA ALA A 231 126.438 -1.920 5.270 1.00 0.00 H new ATOM 0 HB1 ALA A 231 126.215 0.352 6.165 1.00 0.00 H new ATOM 0 HB2 ALA A 231 125.604 0.243 4.497 1.00 0.00 H new ATOM 0 HB3 ALA A 231 124.463 0.302 5.861 1.00 0.00 H new ATOM 1873 N ALA A 232 124.010 -2.364 7.395 1.00 0.00 N ATOM 1874 CA ALA A 232 123.651 -2.842 8.729 1.00 0.00 C ATOM 1875 C ALA A 232 123.854 -4.352 8.848 1.00 0.00 C ATOM 1876 O ALA A 232 124.070 -4.864 9.946 1.00 0.00 O ATOM 1877 CB ALA A 232 122.212 -2.472 9.062 1.00 0.00 C ATOM 0 H ALA A 232 123.222 -2.302 6.751 1.00 0.00 H new ATOM 0 HA ALA A 232 124.311 -2.355 9.447 1.00 0.00 H new ATOM 0 HB1 ALA A 232 121.964 -2.837 10.059 1.00 0.00 H new ATOM 0 HB2 ALA A 232 122.099 -1.388 9.033 1.00 0.00 H new ATOM 0 HB3 ALA A 232 121.541 -2.926 8.332 1.00 0.00 H new ATOM 1883 N LYS A 233 123.818 -5.062 7.725 1.00 0.00 N ATOM 1884 CA LYS A 233 124.037 -6.505 7.747 1.00 0.00 C ATOM 1885 C LYS A 233 124.380 -7.030 6.365 1.00 0.00 C ATOM 1886 O LYS A 233 123.584 -6.898 5.435 1.00 0.00 O ATOM 1887 CB LYS A 233 122.818 -7.246 8.297 1.00 0.00 C ATOM 1888 CG LYS A 233 123.044 -8.753 8.417 1.00 0.00 C ATOM 1889 CD LYS A 233 122.290 -9.535 7.370 1.00 0.00 C ATOM 1890 CE LYS A 233 120.819 -9.671 7.735 1.00 0.00 C ATOM 1891 NZ LYS A 233 120.042 -10.345 6.662 1.00 0.00 N ATOM 0 H LYS A 233 123.642 -4.669 6.800 1.00 0.00 H new ATOM 0 HA LYS A 233 124.882 -6.690 8.410 1.00 0.00 H new ATOM 0 HB2 LYS A 233 122.565 -6.842 9.277 1.00 0.00 H new ATOM 0 HB3 LYS A 233 121.963 -7.062 7.646 1.00 0.00 H new ATOM 0 HG2 LYS A 233 124.109 -8.966 8.328 1.00 0.00 H new ATOM 0 HG3 LYS A 233 122.734 -9.086 9.408 1.00 0.00 H new ATOM 0 HD2 LYS A 233 122.383 -9.038 6.404 1.00 0.00 H new ATOM 0 HD3 LYS A 233 122.733 -10.525 7.263 1.00 0.00 H new ATOM 0 HE2 LYS A 233 120.726 -10.238 8.661 1.00 0.00 H new ATOM 0 HE3 LYS A 233 120.398 -8.683 7.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 233 119.294 -9.707 6.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 233 120.676 -10.587 5.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 233 119.611 -11.213 7.039 1.00 0.00 H new ATOM 1905 N PRO A 234 125.565 -7.645 6.193 1.00 0.00 N ATOM 1906 CA PRO A 234 125.953 -8.179 4.894 1.00 0.00 C ATOM 1907 C PRO A 234 125.092 -9.381 4.535 1.00 0.00 C ATOM 1908 O PRO A 234 125.117 -10.395 5.231 1.00 0.00 O ATOM 1909 CB PRO A 234 127.412 -8.596 5.107 1.00 0.00 C ATOM 1910 CG PRO A 234 127.520 -8.864 6.565 1.00 0.00 C ATOM 1911 CD PRO A 234 126.598 -7.876 7.224 1.00 0.00 C ATOM 0 HA PRO A 234 125.830 -7.466 4.079 1.00 0.00 H new ATOM 0 HB2 PRO A 234 127.660 -9.482 4.522 1.00 0.00 H new ATOM 0 HB3 PRO A 234 128.098 -7.808 4.798 1.00 0.00 H new ATOM 0 HG2 PRO A 234 127.229 -9.888 6.798 1.00 0.00 H new ATOM 0 HG3 PRO A 234 128.545 -8.737 6.913 1.00 0.00 H new ATOM 0 HD2 PRO A 234 126.169 -8.276 8.143 1.00 0.00 H new ATOM 0 HD3 PRO A 234 127.117 -6.955 7.489 1.00 0.00 H new ATOM 1919 N GLY A 235 124.315 -9.268 3.469 1.00 0.00 N ATOM 1920 CA GLY A 235 123.447 -10.359 3.075 1.00 0.00 C ATOM 1921 C GLY A 235 122.051 -10.195 3.646 1.00 0.00 C ATOM 1922 O GLY A 235 121.542 -11.086 4.323 1.00 0.00 O ATOM 0 H GLY A 235 124.269 -8.443 2.871 1.00 0.00 H new ATOM 0 HA2 GLY A 235 123.393 -10.407 1.987 1.00 0.00 H new ATOM 0 HA3 GLY A 235 123.871 -11.304 3.415 1.00 0.00 H new ATOM 1926 N LEU A 236 121.431 -9.048 3.366 1.00 0.00 N ATOM 1927 CA LEU A 236 120.081 -8.764 3.851 1.00 0.00 C ATOM 1928 C LEU A 236 119.194 -8.265 2.716 1.00 0.00 C ATOM 1929 O LEU A 236 118.000 -8.561 2.676 1.00 0.00 O ATOM 1930 CB LEU A 236 120.112 -7.715 4.967 1.00 0.00 C ATOM 1931 CG LEU A 236 118.745 -7.205 5.441 1.00 0.00 C ATOM 1932 CD1 LEU A 236 117.933 -8.314 6.096 1.00 0.00 C ATOM 1933 CD2 LEU A 236 118.918 -6.034 6.399 1.00 0.00 C ATOM 0 H LEU A 236 121.842 -8.301 2.806 1.00 0.00 H new ATOM 0 HA LEU A 236 119.670 -9.693 4.246 1.00 0.00 H new ATOM 0 HB2 LEU A 236 120.638 -8.138 5.823 1.00 0.00 H new ATOM 0 HB3 LEU A 236 120.697 -6.863 4.623 1.00 0.00 H new ATOM 0 HG LEU A 236 118.194 -6.864 4.564 1.00 0.00 H new ATOM 0 HD11 LEU A 236 116.971 -7.918 6.420 1.00 0.00 H new ATOM 0 HD12 LEU A 236 117.771 -9.119 5.379 1.00 0.00 H new ATOM 0 HD13 LEU A 236 118.475 -8.701 6.959 1.00 0.00 H new ATOM 0 HD21 LEU A 236 117.939 -5.684 6.726 1.00 0.00 H new ATOM 0 HD22 LEU A 236 119.497 -6.355 7.265 1.00 0.00 H new ATOM 0 HD23 LEU A 236 119.442 -5.224 5.892 1.00 0.00 H new ATOM 1945 N ALA A 237 119.781 -7.513 1.794 1.00 0.00 N ATOM 1946 CA ALA A 237 119.033 -6.983 0.663 1.00 0.00 C ATOM 1947 C ALA A 237 118.299 -8.101 -0.065 1.00 0.00 C ATOM 1948 O ALA A 237 117.162 -7.929 -0.503 1.00 0.00 O ATOM 1949 CB ALA A 237 119.961 -6.243 -0.288 1.00 0.00 C ATOM 0 H ALA A 237 120.768 -7.258 1.807 1.00 0.00 H new ATOM 0 HA ALA A 237 118.293 -6.277 1.040 1.00 0.00 H new ATOM 0 HB1 ALA A 237 119.386 -5.853 -1.128 1.00 0.00 H new ATOM 0 HB2 ALA A 237 120.439 -5.417 0.239 1.00 0.00 H new ATOM 0 HB3 ALA A 237 120.724 -6.928 -0.658 1.00 0.00 H new ATOM 1955 N ALA A 238 118.955 -9.250 -0.183 1.00 0.00 N ATOM 1956 CA ALA A 238 118.359 -10.399 -0.850 1.00 0.00 C ATOM 1957 C ALA A 238 117.268 -11.025 0.008 1.00 0.00 C ATOM 1958 O ALA A 238 116.263 -11.508 -0.510 1.00 0.00 O ATOM 1959 CB ALA A 238 119.417 -11.432 -1.199 1.00 0.00 C ATOM 0 H ALA A 238 119.897 -9.409 0.174 1.00 0.00 H new ATOM 0 HA ALA A 238 117.904 -10.046 -1.776 1.00 0.00 H new ATOM 0 HB1 ALA A 238 118.947 -12.281 -1.696 1.00 0.00 H new ATOM 0 HB2 ALA A 238 120.156 -10.985 -1.864 1.00 0.00 H new ATOM 0 HB3 ALA A 238 119.908 -11.772 -0.287 1.00 0.00 H new ATOM 1965 N TYR A 239 117.463 -11.020 1.324 1.00 0.00 N ATOM 1966 CA TYR A 239 116.472 -11.595 2.219 1.00 0.00 C ATOM 1967 C TYR A 239 115.203 -10.770 2.182 1.00 0.00 C ATOM 1968 O TYR A 239 114.096 -11.305 2.238 1.00 0.00 O ATOM 1969 CB TYR A 239 117.004 -11.719 3.643 1.00 0.00 C ATOM 1970 CG TYR A 239 116.040 -12.409 4.584 1.00 0.00 C ATOM 1971 CD1 TYR A 239 115.937 -13.796 4.606 1.00 0.00 C ATOM 1972 CD2 TYR A 239 115.225 -11.678 5.442 1.00 0.00 C ATOM 1973 CE1 TYR A 239 115.054 -14.433 5.457 1.00 0.00 C ATOM 1974 CE2 TYR A 239 114.340 -12.309 6.296 1.00 0.00 C ATOM 1975 CZ TYR A 239 114.259 -13.686 6.299 1.00 0.00 C ATOM 1976 OH TYR A 239 113.380 -14.319 7.147 1.00 0.00 O ATOM 0 H TYR A 239 118.285 -10.630 1.785 1.00 0.00 H new ATOM 0 HA TYR A 239 116.246 -12.604 1.874 1.00 0.00 H new ATOM 0 HB2 TYR A 239 117.943 -12.272 3.626 1.00 0.00 H new ATOM 0 HB3 TYR A 239 117.227 -10.724 4.028 1.00 0.00 H new ATOM 0 HD1 TYR A 239 116.558 -14.385 3.947 1.00 0.00 H new ATOM 0 HD2 TYR A 239 115.285 -10.600 5.441 1.00 0.00 H new ATOM 0 HE1 TYR A 239 114.987 -15.511 5.462 1.00 0.00 H new ATOM 0 HE2 TYR A 239 113.715 -11.727 6.957 1.00 0.00 H new ATOM 0 HH TYR A 239 113.737 -15.198 7.392 1.00 0.00 H new ATOM 1986 N MET A 240 115.371 -9.466 2.037 1.00 0.00 N ATOM 1987 CA MET A 240 114.230 -8.580 1.932 1.00 0.00 C ATOM 1988 C MET A 240 113.482 -8.946 0.661 1.00 0.00 C ATOM 1989 O MET A 240 112.255 -9.024 0.639 1.00 0.00 O ATOM 1990 CB MET A 240 114.681 -7.127 1.873 1.00 0.00 C ATOM 1991 CG MET A 240 115.346 -6.627 3.142 1.00 0.00 C ATOM 1992 SD MET A 240 115.842 -4.898 3.026 1.00 0.00 S ATOM 1993 CE MET A 240 116.468 -4.614 4.679 1.00 0.00 C ATOM 0 H MET A 240 116.279 -9.003 1.990 1.00 0.00 H new ATOM 0 HA MET A 240 113.587 -8.691 2.805 1.00 0.00 H new ATOM 0 HB2 MET A 240 115.376 -7.008 1.042 1.00 0.00 H new ATOM 0 HB3 MET A 240 113.816 -6.499 1.658 1.00 0.00 H new ATOM 0 HG2 MET A 240 114.660 -6.749 3.980 1.00 0.00 H new ATOM 0 HG3 MET A 240 116.222 -7.240 3.355 1.00 0.00 H new ATOM 0 HE1 MET A 240 116.130 -3.640 5.034 1.00 0.00 H new ATOM 0 HE2 MET A 240 116.098 -5.392 5.347 1.00 0.00 H new ATOM 0 HE3 MET A 240 117.558 -4.637 4.664 1.00 0.00 H new ATOM 2003 N ARG A 241 114.254 -9.171 -0.397 1.00 0.00 N ATOM 2004 CA ARG A 241 113.714 -9.538 -1.693 1.00 0.00 C ATOM 2005 C ARG A 241 112.869 -10.807 -1.611 1.00 0.00 C ATOM 2006 O ARG A 241 111.730 -10.820 -2.072 1.00 0.00 O ATOM 2007 CB ARG A 241 114.854 -9.717 -2.702 1.00 0.00 C ATOM 2008 CG ARG A 241 114.401 -10.070 -4.110 1.00 0.00 C ATOM 2009 CD ARG A 241 113.995 -11.529 -4.239 1.00 0.00 C ATOM 2010 NE ARG A 241 115.035 -12.432 -3.755 1.00 0.00 N ATOM 2011 CZ ARG A 241 114.941 -13.757 -3.805 1.00 0.00 C ATOM 2012 NH1 ARG A 241 113.859 -14.328 -4.314 1.00 0.00 N ATOM 2013 NH2 ARG A 241 115.930 -14.511 -3.344 1.00 0.00 N ATOM 0 H ARG A 241 115.272 -9.103 -0.376 1.00 0.00 H new ATOM 0 HA ARG A 241 113.062 -8.732 -2.028 1.00 0.00 H new ATOM 0 HB2 ARG A 241 115.435 -8.796 -2.741 1.00 0.00 H new ATOM 0 HB3 ARG A 241 115.521 -10.500 -2.342 1.00 0.00 H new ATOM 0 HG2 ARG A 241 113.559 -9.436 -4.388 1.00 0.00 H new ATOM 0 HG3 ARG A 241 115.207 -9.856 -4.812 1.00 0.00 H new ATOM 0 HD2 ARG A 241 113.076 -11.700 -3.678 1.00 0.00 H new ATOM 0 HD3 ARG A 241 113.777 -11.754 -5.283 1.00 0.00 H new ATOM 0 HE ARG A 241 115.880 -12.024 -3.356 1.00 0.00 H new ATOM 0 HH11 ARG A 241 113.096 -13.751 -4.668 1.00 0.00 H new ATOM 0 HH12 ARG A 241 113.789 -15.345 -4.352 1.00 0.00 H new ATOM 0 HH21 ARG A 241 116.764 -14.074 -2.951 1.00 0.00 H new ATOM 0 HH22 ARG A 241 115.857 -15.528 -3.383 1.00 0.00 H new ATOM 2027 N ASP A 242 113.408 -11.887 -1.051 1.00 0.00 N ATOM 2028 CA ASP A 242 112.640 -13.129 -0.972 1.00 0.00 C ATOM 2029 C ASP A 242 111.500 -13.007 0.036 1.00 0.00 C ATOM 2030 O ASP A 242 110.407 -13.530 -0.180 1.00 0.00 O ATOM 2031 CB ASP A 242 113.546 -14.316 -0.635 1.00 0.00 C ATOM 2032 CG ASP A 242 114.535 -13.996 0.469 1.00 0.00 C ATOM 2033 OD1 ASP A 242 114.095 -13.573 1.557 1.00 0.00 O ATOM 2034 OD2 ASP A 242 115.751 -14.171 0.244 1.00 0.00 O ATOM 0 H ASP A 242 114.347 -11.931 -0.655 1.00 0.00 H new ATOM 0 HA ASP A 242 112.201 -13.312 -1.953 1.00 0.00 H new ATOM 0 HB2 ASP A 242 112.931 -15.164 -0.333 1.00 0.00 H new ATOM 0 HB3 ASP A 242 114.090 -14.619 -1.529 1.00 0.00 H new ATOM 2039 N ALA A 243 111.759 -12.297 1.128 1.00 0.00 N ATOM 2040 CA ALA A 243 110.757 -12.079 2.164 1.00 0.00 C ATOM 2041 C ALA A 243 109.611 -11.221 1.641 1.00 0.00 C ATOM 2042 O ALA A 243 108.435 -11.517 1.862 1.00 0.00 O ATOM 2043 CB ALA A 243 111.402 -11.397 3.363 1.00 0.00 C ATOM 0 H ALA A 243 112.661 -11.860 1.319 1.00 0.00 H new ATOM 0 HA ALA A 243 110.354 -13.046 2.463 1.00 0.00 H new ATOM 0 HB1 ALA A 243 110.651 -11.235 4.137 1.00 0.00 H new ATOM 0 HB2 ALA A 243 112.198 -12.029 3.757 1.00 0.00 H new ATOM 0 HB3 ALA A 243 111.819 -10.438 3.055 1.00 0.00 H new ATOM 2049 N ILE A 244 109.978 -10.148 0.950 1.00 0.00 N ATOM 2050 CA ILE A 244 109.011 -9.218 0.383 1.00 0.00 C ATOM 2051 C ILE A 244 108.268 -9.823 -0.807 1.00 0.00 C ATOM 2052 O ILE A 244 107.041 -9.754 -0.881 1.00 0.00 O ATOM 2053 CB ILE A 244 109.680 -7.895 -0.044 1.00 0.00 C ATOM 2054 CG1 ILE A 244 108.631 -6.800 -0.207 1.00 0.00 C ATOM 2055 CG2 ILE A 244 110.459 -8.078 -1.335 1.00 0.00 C ATOM 2056 CD1 ILE A 244 107.915 -6.451 1.084 1.00 0.00 C ATOM 0 H ILE A 244 110.950 -9.900 0.768 1.00 0.00 H new ATOM 0 HA ILE A 244 108.288 -9.009 1.171 1.00 0.00 H new ATOM 0 HB ILE A 244 110.379 -7.596 0.737 1.00 0.00 H new ATOM 0 HG12 ILE A 244 109.111 -5.904 -0.601 1.00 0.00 H new ATOM 0 HG13 ILE A 244 107.896 -7.119 -0.946 1.00 0.00 H new ATOM 0 HG21 ILE A 244 110.922 -7.133 -1.617 1.00 0.00 H new ATOM 0 HG22 ILE A 244 111.232 -8.832 -1.189 1.00 0.00 H new ATOM 0 HG23 ILE A 244 109.782 -8.401 -2.126 1.00 0.00 H new ATOM 0 HD11 ILE A 244 107.184 -5.666 0.894 1.00 0.00 H new ATOM 0 HD12 ILE A 244 107.406 -7.335 1.468 1.00 0.00 H new ATOM 0 HD13 ILE A 244 108.640 -6.101 1.819 1.00 0.00 H new ATOM 2068 N LEU A 245 109.014 -10.412 -1.739 1.00 0.00 N ATOM 2069 CA LEU A 245 108.415 -11.022 -2.923 1.00 0.00 C ATOM 2070 C LEU A 245 107.416 -12.105 -2.512 1.00 0.00 C ATOM 2071 O LEU A 245 106.282 -12.142 -2.990 1.00 0.00 O ATOM 2072 CB LEU A 245 109.501 -11.607 -3.830 1.00 0.00 C ATOM 2073 CG LEU A 245 109.091 -11.818 -5.289 1.00 0.00 C ATOM 2074 CD1 LEU A 245 110.192 -12.539 -6.049 1.00 0.00 C ATOM 2075 CD2 LEU A 245 107.781 -12.584 -5.375 1.00 0.00 C ATOM 0 H LEU A 245 110.031 -10.480 -1.697 1.00 0.00 H new ATOM 0 HA LEU A 245 107.881 -10.252 -3.480 1.00 0.00 H new ATOM 0 HB2 LEU A 245 110.367 -10.946 -3.805 1.00 0.00 H new ATOM 0 HB3 LEU A 245 109.819 -12.564 -3.417 1.00 0.00 H new ATOM 0 HG LEU A 245 108.939 -10.842 -5.750 1.00 0.00 H new ATOM 0 HD11 LEU A 245 109.885 -12.682 -7.085 1.00 0.00 H new ATOM 0 HD12 LEU A 245 111.105 -11.944 -6.019 1.00 0.00 H new ATOM 0 HD13 LEU A 245 110.377 -13.509 -5.588 1.00 0.00 H new ATOM 0 HD21 LEU A 245 107.509 -12.723 -6.421 1.00 0.00 H new ATOM 0 HD22 LEU A 245 107.897 -13.557 -4.898 1.00 0.00 H new ATOM 0 HD23 LEU A 245 106.997 -12.022 -4.867 1.00 0.00 H new ATOM 2087 N ALA A 246 107.841 -12.951 -1.588 1.00 0.00 N ATOM 2088 CA ALA A 246 106.995 -14.017 -1.056 1.00 0.00 C ATOM 2089 C ALA A 246 105.752 -13.441 -0.396 1.00 0.00 C ATOM 2090 O ALA A 246 104.642 -13.937 -0.592 1.00 0.00 O ATOM 2091 CB ALA A 246 107.781 -14.838 -0.046 1.00 0.00 C ATOM 0 H ALA A 246 108.777 -12.922 -1.184 1.00 0.00 H new ATOM 0 HA ALA A 246 106.682 -14.656 -1.882 1.00 0.00 H new ATOM 0 HB1 ALA A 246 107.148 -15.632 0.349 1.00 0.00 H new ATOM 0 HB2 ALA A 246 108.652 -15.277 -0.533 1.00 0.00 H new ATOM 0 HB3 ALA A 246 108.108 -14.194 0.771 1.00 0.00 H new ATOM 2097 N ASN A 247 105.948 -12.391 0.384 1.00 0.00 N ATOM 2098 CA ASN A 247 104.848 -11.743 1.079 1.00 0.00 C ATOM 2099 C ASN A 247 103.736 -11.371 0.110 1.00 0.00 C ATOM 2100 O ASN A 247 102.554 -11.481 0.434 1.00 0.00 O ATOM 2101 CB ASN A 247 105.353 -10.485 1.781 1.00 0.00 C ATOM 2102 CG ASN A 247 104.278 -9.817 2.615 1.00 0.00 C ATOM 2103 OD1 ASN A 247 103.765 -10.402 3.569 1.00 0.00 O ATOM 2104 ND2 ASN A 247 103.929 -8.587 2.257 1.00 0.00 N ATOM 0 H ASN A 247 106.861 -11.968 0.552 1.00 0.00 H new ATOM 0 HA ASN A 247 104.448 -12.442 1.814 1.00 0.00 H new ATOM 0 HB2 ASN A 247 106.197 -10.743 2.421 1.00 0.00 H new ATOM 0 HB3 ASN A 247 105.722 -9.780 1.036 1.00 0.00 H new ATOM 0 HD21 ASN A 247 103.209 -8.089 2.780 1.00 0.00 H new ATOM 0 HD22 ASN A 247 104.381 -8.140 1.459 1.00 0.00 H new ATOM 2111 N ALA A 248 104.124 -10.911 -1.073 1.00 0.00 N ATOM 2112 CA ALA A 248 103.165 -10.500 -2.080 1.00 0.00 C ATOM 2113 C ALA A 248 102.393 -11.679 -2.659 1.00 0.00 C ATOM 2114 O ALA A 248 101.256 -11.523 -3.099 1.00 0.00 O ATOM 2115 CB ALA A 248 103.888 -9.765 -3.191 1.00 0.00 C ATOM 0 H ALA A 248 105.099 -10.815 -1.355 1.00 0.00 H new ATOM 0 HA ALA A 248 102.440 -9.843 -1.600 1.00 0.00 H new ATOM 0 HB1 ALA A 248 103.170 -9.455 -3.950 1.00 0.00 H new ATOM 0 HB2 ALA A 248 104.386 -8.886 -2.782 1.00 0.00 H new ATOM 0 HB3 ALA A 248 104.629 -10.425 -3.642 1.00 0.00 H new ATOM 2121 N VAL A 249 103.024 -12.858 -2.680 1.00 0.00 N ATOM 2122 CA VAL A 249 102.419 -14.071 -3.232 1.00 0.00 C ATOM 2123 C VAL A 249 101.175 -14.522 -2.491 1.00 0.00 C ATOM 2124 O VAL A 249 100.161 -14.857 -3.102 1.00 0.00 O ATOM 2125 CB VAL A 249 103.410 -15.242 -3.175 1.00 0.00 C ATOM 2126 CG1 VAL A 249 102.848 -16.460 -3.892 1.00 0.00 C ATOM 2127 CG2 VAL A 249 104.740 -14.832 -3.760 1.00 0.00 C ATOM 0 H VAL A 249 103.966 -12.996 -2.315 1.00 0.00 H new ATOM 0 HA VAL A 249 102.149 -13.809 -4.255 1.00 0.00 H new ATOM 0 HB VAL A 249 103.566 -15.514 -2.131 1.00 0.00 H new ATOM 0 HG11 VAL A 249 103.567 -17.277 -3.839 1.00 0.00 H new ATOM 0 HG12 VAL A 249 101.916 -16.765 -3.416 1.00 0.00 H new ATOM 0 HG13 VAL A 249 102.657 -16.212 -4.936 1.00 0.00 H new ATOM 0 HG21 VAL A 249 105.433 -15.672 -3.713 1.00 0.00 H new ATOM 0 HG22 VAL A 249 104.604 -14.532 -4.799 1.00 0.00 H new ATOM 0 HG23 VAL A 249 105.145 -13.995 -3.191 1.00 0.00 H new ATOM 2137 N ARG A 250 101.269 -14.556 -1.172 1.00 0.00 N ATOM 2138 CA ARG A 250 100.152 -15.003 -0.353 1.00 0.00 C ATOM 2139 C ARG A 250 99.140 -13.890 -0.126 1.00 0.00 C ATOM 2140 O ARG A 250 97.961 -14.157 0.108 1.00 0.00 O ATOM 2141 CB ARG A 250 100.643 -15.561 0.983 1.00 0.00 C ATOM 2142 CG ARG A 250 101.811 -14.788 1.574 1.00 0.00 C ATOM 2143 CD ARG A 250 103.140 -15.391 1.149 1.00 0.00 C ATOM 2144 NE ARG A 250 103.349 -16.719 1.720 1.00 0.00 N ATOM 2145 CZ ARG A 250 103.470 -16.954 3.022 1.00 0.00 C ATOM 2146 NH1 ARG A 250 103.421 -15.951 3.888 1.00 0.00 N ATOM 2147 NH2 ARG A 250 103.645 -18.194 3.461 1.00 0.00 N ATOM 0 H ARG A 250 102.100 -14.282 -0.648 1.00 0.00 H new ATOM 0 HA ARG A 250 99.650 -15.802 -0.899 1.00 0.00 H new ATOM 0 HB2 ARG A 250 99.817 -15.556 1.695 1.00 0.00 H new ATOM 0 HB3 ARG A 250 100.939 -16.601 0.846 1.00 0.00 H new ATOM 0 HG2 ARG A 250 101.762 -13.747 1.253 1.00 0.00 H new ATOM 0 HG3 ARG A 250 101.739 -14.790 2.662 1.00 0.00 H new ATOM 0 HD2 ARG A 250 103.177 -15.455 0.061 1.00 0.00 H new ATOM 0 HD3 ARG A 250 103.952 -14.732 1.458 1.00 0.00 H new ATOM 0 HE ARG A 250 103.405 -17.513 1.082 1.00 0.00 H new ATOM 0 HH11 ARG A 250 103.290 -14.996 3.555 1.00 0.00 H new ATOM 0 HH12 ARG A 250 103.514 -16.135 4.887 1.00 0.00 H new ATOM 0 HH21 ARG A 250 103.687 -18.968 2.798 1.00 0.00 H new ATOM 0 HH22 ARG A 250 103.738 -18.373 4.461 1.00 0.00 H new ATOM 2161 N HIS A 251 99.589 -12.645 -0.203 1.00 0.00 N ATOM 2162 CA HIS A 251 98.685 -11.518 -0.008 1.00 0.00 C ATOM 2163 C HIS A 251 97.867 -11.283 -1.272 1.00 0.00 C ATOM 2164 O HIS A 251 96.637 -11.264 -1.232 1.00 0.00 O ATOM 2165 CB HIS A 251 99.458 -10.254 0.373 1.00 0.00 C ATOM 2166 CG HIS A 251 100.146 -10.344 1.698 1.00 0.00 C ATOM 2167 ND1 HIS A 251 100.819 -11.469 2.121 1.00 0.00 N ATOM 2168 CD2 HIS A 251 100.277 -9.434 2.693 1.00 0.00 C ATOM 2169 CE1 HIS A 251 101.331 -11.250 3.318 1.00 0.00 C ATOM 2170 NE2 HIS A 251 101.017 -10.022 3.688 1.00 0.00 N ATOM 0 H HIS A 251 100.558 -12.391 -0.396 1.00 0.00 H new ATOM 0 HA HIS A 251 98.009 -11.756 0.813 1.00 0.00 H new ATOM 0 HB2 HIS A 251 100.200 -10.047 -0.398 1.00 0.00 H new ATOM 0 HB3 HIS A 251 98.770 -9.409 0.388 1.00 0.00 H new ATOM 0 HD1 HIS A 251 100.908 -12.336 1.592 1.00 0.00 H new ATOM 0 HD2 HIS A 251 99.874 -8.432 2.702 1.00 0.00 H new ATOM 0 HE1 HIS A 251 101.909 -11.956 3.897 1.00 0.00 H new ATOM 2179 N THR A 252 98.554 -11.114 -2.396 1.00 0.00 N ATOM 2180 CA THR A 252 97.885 -10.891 -3.671 1.00 0.00 C ATOM 2181 C THR A 252 96.823 -11.964 -3.913 1.00 0.00 C ATOM 2182 O THR A 252 97.016 -13.126 -3.553 1.00 0.00 O ATOM 2183 CB THR A 252 98.905 -10.908 -4.809 1.00 0.00 C ATOM 2184 OG1 THR A 252 98.284 -10.609 -6.046 1.00 0.00 O ATOM 2185 CG2 THR A 252 99.607 -12.245 -4.960 1.00 0.00 C ATOM 0 H THR A 252 99.572 -11.127 -2.450 1.00 0.00 H new ATOM 0 HA THR A 252 97.399 -9.916 -3.640 1.00 0.00 H new ATOM 0 HB THR A 252 99.644 -10.151 -4.547 1.00 0.00 H new ATOM 0 HG1 THR A 252 98.955 -10.623 -6.761 1.00 0.00 H new ATOM 0 HG21 THR A 252 100.318 -12.192 -5.784 1.00 0.00 H new ATOM 0 HG22 THR A 252 100.138 -12.484 -4.038 1.00 0.00 H new ATOM 0 HG23 THR A 252 98.870 -13.022 -5.166 1.00 0.00 H new ATOM 2193 N PRO A 253 95.684 -11.597 -4.532 1.00 0.00 N ATOM 2194 CA PRO A 253 94.606 -12.541 -4.816 1.00 0.00 C ATOM 2195 C PRO A 253 95.128 -13.913 -5.233 1.00 0.00 C ATOM 2196 O PRO A 253 95.757 -14.004 -6.308 1.00 0.00 O ATOM 2197 CB PRO A 253 93.870 -11.866 -5.971 1.00 0.00 C ATOM 2198 CG PRO A 253 94.026 -10.406 -5.706 1.00 0.00 C ATOM 2199 CD PRO A 253 95.356 -10.236 -5.006 1.00 0.00 C ATOM 2200 OXT PRO A 253 94.904 -14.884 -4.480 1.00 0.00 O ATOM 0 HA PRO A 253 93.982 -12.738 -3.944 1.00 0.00 H new ATOM 0 HB2 PRO A 253 94.300 -12.144 -6.933 1.00 0.00 H new ATOM 0 HB3 PRO A 253 92.819 -12.155 -5.996 1.00 0.00 H new ATOM 0 HG2 PRO A 253 94.002 -9.838 -6.636 1.00 0.00 H new ATOM 0 HG3 PRO A 253 93.211 -10.035 -5.085 1.00 0.00 H new ATOM 0 HD2 PRO A 253 96.119 -9.855 -5.685 1.00 0.00 H new ATOM 0 HD3 PRO A 253 95.285 -9.531 -4.178 1.00 0.00 H new TER 2208 PRO A 253 ATOM 2209 CA SER B 501 111.483 3.688 -8.895 1.00 0.00 C ATOM 2210 C SER B 501 111.519 4.856 -8.040 1.00 0.00 C ATOM 2211 CB SER B 501 110.978 3.799 -10.168 1.00 0.00 C HETATM 2213 N BB9 B 502 112.598 5.519 -7.551 1.00 0.00 N HETATM 2214 CA BB9 B 502 112.227 6.674 -6.841 1.00 0.00 C HETATM 2215 C BB9 B 502 113.201 7.535 -6.255 1.00 0.00 C HETATM 2216 O BB9 B 502 112.873 8.545 -5.633 1.00 0.00 O HETATM 2217 CB BB9 B 502 110.894 6.863 -6.801 1.00 0.00 C HETATM 2218 SG BB9 B 502 110.099 5.630 -7.628 1.00 0.00 S HETATM 0 HN1 BB9 B 502 113.584 5.280 -7.657 1.00 0.00 H new HETATM 0 HB BB9 B 502 110.399 7.697 -6.303 1.00 0.00 H new ATOM 2220 N THR B 503 114.442 7.077 -6.265 1.00 0.00 N ATOM 2221 CA THR B 503 115.507 7.743 -5.532 1.00 0.00 C ATOM 2222 C THR B 503 116.845 7.095 -5.839 1.00 0.00 C ATOM 2223 O THR B 503 117.890 7.547 -5.371 1.00 0.00 O ATOM 2224 CB THR B 503 115.241 7.666 -4.024 1.00 0.00 C ATOM 2225 OG1 THR B 503 116.148 8.497 -3.321 1.00 0.00 O ATOM 2226 CG2 THR B 503 115.357 6.243 -3.460 1.00 0.00 C ATOM 0 H THR B 503 114.738 6.244 -6.774 1.00 0.00 H new ATOM 0 HA THR B 503 115.534 8.788 -5.842 1.00 0.00 H new ATOM 0 HB THR B 503 114.213 8.001 -3.885 1.00 0.00 H new ATOM 0 HG1 THR B 503 117.026 8.465 -3.756 1.00 0.00 H new ATOM 0 HG21 THR B 503 115.157 6.259 -2.389 1.00 0.00 H new ATOM 0 HG22 THR B 503 114.633 5.595 -3.955 1.00 0.00 H new ATOM 0 HG23 THR B 503 116.363 5.863 -3.636 1.00 0.00 H new HETATM 2233 N DBU B 504 116.762 5.897 -6.397 1.00 0.00 N HETATM 2234 CA DBU B 504 117.931 5.132 -6.441 1.00 0.00 C HETATM 2235 CB DBU B 504 118.353 4.676 -7.617 1.00 0.00 C HETATM 2236 CG DBU B 504 117.575 4.941 -8.872 1.00 0.00 C HETATM 2237 C DBU B 504 118.670 4.785 -5.215 1.00 0.00 C HETATM 0 HG3 DBU B 504 116.577 4.514 -8.778 1.00 0.00 H new HETATM 0 HG2 DBU B 504 117.496 6.016 -9.031 1.00 0.00 H new HETATM 0 HG1 DBU B 504 118.086 4.486 -9.720 1.00 0.00 H new HETATM 0 HB DBU B 504 119.278 4.101 -7.670 1.00 0.00 H new HETATM 0 H DBU B 504 116.250 6.096 -7.256 1.00 0.00 H new HETATM 2243 N BB9 B 505 118.190 4.666 -3.951 1.00 0.00 N HETATM 2244 CA BB9 B 505 119.191 4.300 -3.038 1.00 0.00 C HETATM 2245 C BB9 B 505 118.909 4.093 -1.657 1.00 0.00 C HETATM 2246 O BB9 B 505 119.791 3.775 -0.859 1.00 0.00 O HETATM 2247 CB BB9 B 505 120.398 4.151 -3.616 1.00 0.00 C HETATM 2248 SG BB9 B 505 120.306 4.454 -5.270 1.00 0.00 S HETATM 0 HN1 BB9 B 505 117.229 4.791 -3.632 1.00 0.00 H new HETATM 0 HB BB9 B 505 121.309 3.873 -3.086 1.00 0.00 H new HETATM 2250 N 3GL B 506 117.643 4.256 -1.297 1.00 0.00 N HETATM 2251 CA 3GL B 506 117.209 4.071 0.079 1.00 0.00 C HETATM 2252 C 3GL B 506 116.047 3.082 0.053 1.00 0.00 C HETATM 2253 CB 3GL B 506 116.841 5.437 0.709 1.00 0.00 C HETATM 2254 CG 3GL B 506 115.381 5.824 0.606 1.00 0.00 C HETATM 2255 OH 3GL B 506 114.836 5.347 -0.608 1.00 0.00 O HETATM 2256 CD 3GL B 506 115.167 7.323 0.643 1.00 0.00 C HETATM 2257 OE1 3GL B 506 114.530 7.891 1.682 1.00 0.00 O HETATM 2258 OE2 3GL B 506 115.713 8.043 -0.192 1.00 0.00 O HETATM 0 HB2C 3GL B 506 117.122 5.421 1.762 1.00 0.00 H new HETATM 0 HB1C 3GL B 506 117.440 6.212 0.231 1.00 0.00 H new HETATM 0 HH 3GL B 506 113.963 4.936 -0.436 1.00 0.00 H new HETATM 0 HG 3GL B 506 114.888 5.377 1.469 1.00 0.00 H new HETATM 0 HA 3GL B 506 118.001 3.663 0.707 1.00 0.00 H new HETATM 2264 N BB9 B 507 115.028 3.014 -0.844 1.00 0.00 N HETATM 2265 CA BB9 B 507 114.212 1.891 -0.630 1.00 0.00 C HETATM 2266 C BB9 B 507 113.077 1.619 -1.464 1.00 0.00 C HETATM 2267 O BB9 B 507 112.367 0.631 -1.277 1.00 0.00 O HETATM 2268 CB BB9 B 507 114.625 1.135 0.420 1.00 0.00 C HETATM 2269 SG BB9 B 507 115.998 1.814 1.132 1.00 0.00 S HETATM 0 HN1 BB9 B 507 114.819 3.658 -1.607 1.00 0.00 H new HETATM 0 HB BB9 B 507 114.139 0.219 0.756 1.00 0.00 H new ATOM 2271 N CYS B 508 112.845 2.493 -2.449 1.00 0.00 N ATOM 2272 CA CYS B 508 111.724 2.327 -3.380 1.00 0.00 C ATOM 2273 C CYS B 508 112.289 2.272 -4.795 1.00 0.00 C ATOM 2274 CB CYS B 508 110.697 3.475 -3.251 1.00 0.00 C ATOM 2275 SG CYS B 508 111.392 5.137 -3.456 1.00 0.00 S ATOM 0 H CYS B 508 113.416 3.320 -2.622 1.00 0.00 H new ATOM 0 HA CYS B 508 111.194 1.404 -3.144 1.00 0.00 H new ATOM 0 HB2 CYS B 508 109.913 3.329 -3.995 1.00 0.00 H new ATOM 0 HB3 CYS B 508 110.223 3.412 -2.272 1.00 0.00 H new HETATM 2280 N BB9 B 509 111.628 2.453 -5.966 1.00 0.00 N HETATM 2281 CA BB9 B 509 112.485 2.307 -7.073 1.00 0.00 C HETATM 2282 C BB9 B 509 111.930 2.449 -8.464 1.00 0.00 C HETATM 2283 CB BB9 B 509 113.768 2.025 -6.724 1.00 0.00 C HETATM 2284 SG BB9 B 509 113.902 1.938 -5.042 1.00 0.00 S HETATM 0 HN1 BB9 B 509 110.638 2.654 -6.110 1.00 0.00 H new HETATM 0 HB BB9 B 509 114.589 1.877 -7.425 1.00 0.00 H new HETATM 2286 N MH6 B 510 111.877 1.359 -9.266 1.00 0.00 N HETATM 2287 CA MH6 B 510 111.374 1.492 -10.515 1.00 0.00 C HETATM 2288 C MH6 B 510 111.311 0.331 -11.386 1.00 0.00 C HETATM 2289 CB MH6 B 510 110.915 2.703 -10.998 1.00 0.00 C HETATM 2290 OG MH6 B 510 110.411 2.799 -12.276 1.00 0.00 O HETATM 0 HG MH6 B 510 110.973 3.404 -12.805 1.00 0.00 H new HETATM 2291 N BB9 B 511 110.331 -0.607 -11.479 1.00 0.00 N HETATM 2292 CA BB9 B 511 110.587 -1.542 -12.499 1.00 0.00 C HETATM 2293 C BB9 B 511 109.684 -2.617 -12.784 1.00 0.00 C HETATM 2294 O BB9 B 511 109.914 -3.426 -13.682 1.00 0.00 O HETATM 2295 CB BB9 B 511 111.749 -1.301 -13.149 1.00 0.00 C HETATM 2296 SG BB9 B 511 112.512 0.059 -12.512 1.00 0.00 S HETATM 0 HN1 BB9 B 511 109.483 -0.684 -10.918 1.00 0.00 H new HETATM 0 HB BB9 B 511 112.137 -1.903 -13.970 1.00 0.00 H new ATOM 2298 N ALA B 512 108.597 -2.681 -12.019 1.00 0.00 N ATOM 2299 CA ALA B 512 107.584 -3.721 -12.196 1.00 0.00 C ATOM 2300 C ALA B 512 106.537 -3.654 -11.090 1.00 0.00 C ATOM 2301 O ALA B 512 106.771 -3.066 -10.034 1.00 0.00 O ATOM 2302 CB ALA B 512 108.217 -5.129 -12.200 1.00 0.00 C ATOM 0 H ALA B 512 108.394 -2.022 -11.267 1.00 0.00 H new ATOM 0 HA ALA B 512 107.109 -3.542 -13.160 1.00 0.00 H new ATOM 0 HB1 ALA B 512 107.437 -5.878 -12.333 1.00 0.00 H new ATOM 0 HB2 ALA B 512 108.935 -5.203 -13.017 1.00 0.00 H new ATOM 0 HB3 ALA B 512 108.727 -5.301 -11.252 1.00 0.00 H new HETATM 2307 N NH2 B 513 105.378 -4.256 -11.334 1.00 0.00 N TER 2310 NH2 B 513 HETATM 2311 C NO1 B 601 111.362 5.711 -1.792 1.00 0.00 C HETATM 2312 O NO1 B 601 111.408 4.872 -0.893 1.00 0.00 O HETATM 2313 CB NO1 B 601 112.220 6.706 0.992 1.00 0.00 C HETATM 2314 CG NO1 B 601 112.413 7.478 -0.297 1.00 0.00 C HETATM 2315 CD1 NO1 B 601 111.877 7.104 -1.493 1.00 0.00 C HETATM 2316 NE1 NO1 B 601 111.953 8.139 -2.391 1.00 0.00 N HETATM 2317 CD2 NO1 B 601 113.028 8.770 -0.520 1.00 0.00 C HETATM 2318 CE2 NO1 B 601 112.684 9.155 -1.837 1.00 0.00 C HETATM 2319 CE3 NO1 B 601 113.794 9.673 0.254 1.00 0.00 C HETATM 2320 CZ2 NO1 B 601 113.066 10.382 -2.385 1.00 0.00 C HETATM 2321 CZ3 NO1 B 601 114.175 10.883 -0.301 1.00 0.00 C HETATM 2322 CH2 NO1 B 601 113.810 11.227 -1.607 1.00 0.00 C HETATM 2323 CF NO1 B 601 114.327 9.291 1.622 1.00 0.00 C HETATM 0 HB3C NO1 B 601 111.157 6.654 1.229 1.00 0.00 H new HETATM 0 HB2C NO1 B 601 112.616 5.697 0.875 1.00 0.00 H new HETATM 0 HB1C NO1 B 601 112.748 7.211 1.801 1.00 0.00 H new HETATM 0 HZ3 NO1 B 601 114.770 11.580 0.290 1.00 0.00 H new HETATM 0 HZ2 NO1 B 601 112.780 10.658 -3.400 1.00 0.00 H new HETATM 0 HH2 NO1 B 601 114.125 12.188 -2.013 1.00 0.00 H new HETATM 0 HE1 NO1 B 601 111.533 8.149 -3.320 1.00 0.00 H new