USER MOD reduce.3.24.130724 H: found=0, std=0, add=654, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 653 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl -178:sc= -1.09 (180deg=-1.1) USER MOD Single : A 1 MET N :NH3+ 151:sc= -0.068 (180deg=-1.35!) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 172:sc= -0.976 (180deg=-1.38) USER MOD Single : A 5 GLN :FLIP amide:sc= -3.22! C(o=-5.4!,f=-3.2!) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.133 USER MOD Single : A 10 THR OG1 : rot -37:sc= 0.297 USER MOD Single : A 11 ASN :FLIP amide:sc= -2.52 F(o=-5.3!,f=-2.5) USER MOD Single : A 12 LYS NZ :NH3+ -150:sc= -0.176 (180deg=-0.759) USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 HIS : no HD1:sc= -1.87! C(o=-1.9!,f=-3.2!) USER MOD Single : A 21 MET CE :methyl -115:sc= -0.182 (180deg=-4.05!) USER MOD Single : A 22 LYS NZ :NH3+ -143:sc= 0 (180deg=-0.059) USER MOD Single : A 27 MET CE :methyl -153:sc= -0.07 (180deg=-0.5) USER MOD Single : A 28 GLN : amide:sc= -0.0103 K(o=-0.01,f=-1.1) USER MOD Single : A 38 ASN : amide:sc= -3.12! C(o=-3.1!,f=-3.1!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= -1.25! C(o=-1.3!,f=-1.9!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot -35:sc= 0.163 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN :FLIP amide:sc= -0.123 F(o=-0.76,f=-0.12) USER MOD Single : A 68 THR OG1 : rot 180:sc= -2.9! USER MOD Single : A 71 GLN :FLIP amide:sc= -0.326 F(o=-3.8!,f=-0.33) USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0.02) USER MOD Single : A 85 SER OG : rot 180:sc= -0.268 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 46.335 -12.218 18.809 1.00 0.00 N ATOM 2 CA MET A 1 47.198 -13.086 19.658 1.00 0.00 C ATOM 3 C MET A 1 48.627 -12.548 19.642 1.00 0.00 C ATOM 4 O MET A 1 48.857 -11.371 19.920 1.00 0.00 O ATOM 5 CB MET A 1 47.160 -14.523 19.122 1.00 0.00 C ATOM 6 CG MET A 1 47.449 -14.528 17.618 1.00 0.00 C ATOM 7 SD MET A 1 47.042 -16.154 16.935 1.00 0.00 S ATOM 8 CE MET A 1 47.642 -15.850 15.254 1.00 0.00 C ATOM 0 H1 MET A 1 45.556 -12.783 18.415 1.00 0.00 H new ATOM 0 H2 MET A 1 45.945 -11.445 19.386 1.00 0.00 H new ATOM 0 H3 MET A 1 46.901 -11.819 18.033 1.00 0.00 H new ATOM 0 HA MET A 1 46.832 -13.084 20.685 1.00 0.00 H new ATOM 0 HB2 MET A 1 47.896 -15.134 19.644 1.00 0.00 H new ATOM 0 HB3 MET A 1 46.183 -14.966 19.315 1.00 0.00 H new ATOM 0 HG2 MET A 1 46.863 -13.755 17.121 1.00 0.00 H new ATOM 0 HG3 MET A 1 48.499 -14.297 17.437 1.00 0.00 H new ATOM 0 HE1 MET A 1 47.454 -16.728 14.636 1.00 0.00 H new ATOM 0 HE2 MET A 1 47.121 -14.991 14.831 1.00 0.00 H new ATOM 0 HE3 MET A 1 48.713 -15.647 15.281 1.00 0.00 H new ATOM 20 N THR A 2 49.585 -13.413 19.319 1.00 0.00 N ATOM 21 CA THR A 2 50.988 -13.009 19.274 1.00 0.00 C ATOM 22 C THR A 2 51.725 -13.751 18.171 1.00 0.00 C ATOM 23 O THR A 2 51.431 -14.914 17.896 1.00 0.00 O ATOM 24 CB THR A 2 51.670 -13.333 20.611 1.00 0.00 C ATOM 25 OG1 THR A 2 50.687 -13.709 21.565 1.00 0.00 O ATOM 26 CG2 THR A 2 52.434 -12.111 21.118 1.00 0.00 C ATOM 0 H THR A 2 49.418 -14.392 19.086 1.00 0.00 H new ATOM 0 HA THR A 2 51.023 -11.937 19.081 1.00 0.00 H new ATOM 0 HB THR A 2 52.371 -14.155 20.465 1.00 0.00 H new ATOM 0 HG1 THR A 2 51.122 -13.917 22.418 1.00 0.00 H new ATOM 0 HG21 THR A 2 52.914 -12.350 22.067 1.00 0.00 H new ATOM 0 HG22 THR A 2 53.193 -11.828 20.388 1.00 0.00 H new ATOM 0 HG23 THR A 2 51.741 -11.282 21.261 1.00 0.00 H new ATOM 34 N VAL A 3 52.720 -13.101 17.573 1.00 0.00 N ATOM 35 CA VAL A 3 53.511 -13.735 16.562 1.00 0.00 C ATOM 36 C VAL A 3 54.931 -13.311 16.735 1.00 0.00 C ATOM 37 O VAL A 3 55.228 -12.135 16.935 1.00 0.00 O ATOM 38 CB VAL A 3 53.061 -13.361 15.176 1.00 0.00 C ATOM 39 CG1 VAL A 3 51.999 -14.337 14.726 1.00 0.00 C ATOM 40 CG2 VAL A 3 52.498 -11.944 15.180 1.00 0.00 C ATOM 0 H VAL A 3 52.985 -12.138 17.781 1.00 0.00 H new ATOM 0 HA VAL A 3 53.400 -14.814 16.672 1.00 0.00 H new ATOM 0 HB VAL A 3 53.908 -13.399 14.490 1.00 0.00 H new ATOM 0 HG11 VAL A 3 51.666 -14.075 13.722 1.00 0.00 H new ATOM 0 HG12 VAL A 3 52.411 -15.346 14.719 1.00 0.00 H new ATOM 0 HG13 VAL A 3 51.153 -14.295 15.412 1.00 0.00 H new ATOM 0 HG21 VAL A 3 52.174 -11.678 14.174 1.00 0.00 H new ATOM 0 HG22 VAL A 3 51.648 -11.892 15.861 1.00 0.00 H new ATOM 0 HG23 VAL A 3 53.269 -11.247 15.508 1.00 0.00 H new ATOM 50 N LYS A 4 55.795 -14.276 16.662 1.00 0.00 N ATOM 51 CA LYS A 4 57.190 -14.029 16.816 1.00 0.00 C ATOM 52 C LYS A 4 57.981 -15.053 16.054 1.00 0.00 C ATOM 53 O LYS A 4 57.677 -16.245 16.087 1.00 0.00 O ATOM 54 CB LYS A 4 57.560 -14.076 18.281 1.00 0.00 C ATOM 55 CG LYS A 4 57.069 -15.396 18.909 1.00 0.00 C ATOM 56 CD LYS A 4 55.854 -15.152 19.830 1.00 0.00 C ATOM 57 CE LYS A 4 54.536 -15.201 19.032 1.00 0.00 C ATOM 58 NZ LYS A 4 53.558 -16.062 19.757 1.00 0.00 N ATOM 0 H LYS A 4 55.552 -15.252 16.495 1.00 0.00 H new ATOM 0 HA LYS A 4 57.422 -13.040 16.421 1.00 0.00 H new ATOM 0 HB2 LYS A 4 58.641 -13.990 18.394 1.00 0.00 H new ATOM 0 HB3 LYS A 4 57.117 -13.228 18.804 1.00 0.00 H new ATOM 0 HG2 LYS A 4 56.797 -16.099 18.121 1.00 0.00 H new ATOM 0 HG3 LYS A 4 57.877 -15.854 19.480 1.00 0.00 H new ATOM 0 HD2 LYS A 4 55.834 -15.905 20.618 1.00 0.00 H new ATOM 0 HD3 LYS A 4 55.952 -14.182 20.318 1.00 0.00 H new ATOM 0 HE2 LYS A 4 54.133 -14.196 18.909 1.00 0.00 H new ATOM 0 HE3 LYS A 4 54.716 -15.596 18.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 52.627 -15.992 19.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 53.882 -17.050 19.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 53.482 -15.745 20.745 1.00 0.00 H new ATOM 72 N GLN A 5 58.975 -14.584 15.332 1.00 0.00 N ATOM 73 CA GLN A 5 59.763 -15.493 14.527 1.00 0.00 C ATOM 74 C GLN A 5 61.209 -15.059 14.391 1.00 0.00 C ATOM 75 O GLN A 5 61.538 -13.877 14.429 1.00 0.00 O ATOM 76 CB GLN A 5 59.153 -15.555 13.143 1.00 0.00 C ATOM 77 CG GLN A 5 57.626 -15.561 13.251 1.00 0.00 C ATOM 78 CD GLN A 5 57.013 -15.742 11.866 1.00 0.00 C ATOM 79 OE1 GLN A 5 57.778 -16.093 10.867 1.00 0.00 O flip ATOM 80 NE2 GLN A 5 55.809 -15.560 11.690 1.00 0.00 N flip ATOM 0 H GLN A 5 59.253 -13.604 15.284 1.00 0.00 H new ATOM 0 HA GLN A 5 59.756 -16.463 15.024 1.00 0.00 H new ATOM 0 HB2 GLN A 5 59.482 -14.700 12.552 1.00 0.00 H new ATOM 0 HB3 GLN A 5 59.494 -16.451 12.625 1.00 0.00 H new ATOM 0 HG2 GLN A 5 57.302 -16.366 13.911 1.00 0.00 H new ATOM 0 HG3 GLN A 5 57.279 -14.627 13.693 1.00 0.00 H new ATOM 0 HE21 GLN A 5 55.215 -15.286 12.473 1.00 0.00 H new ATOM 0 HE22 GLN A 5 55.405 -15.683 10.762 1.00 0.00 H new ATOM 89 N THR A 6 62.058 -16.040 14.186 1.00 0.00 N ATOM 90 CA THR A 6 63.458 -15.800 13.986 1.00 0.00 C ATOM 91 C THR A 6 63.739 -15.802 12.493 1.00 0.00 C ATOM 92 O THR A 6 63.749 -16.858 11.859 1.00 0.00 O ATOM 93 CB THR A 6 64.263 -16.896 14.673 1.00 0.00 C ATOM 94 OG1 THR A 6 63.593 -17.303 15.858 1.00 0.00 O ATOM 95 CG2 THR A 6 65.634 -16.352 15.024 1.00 0.00 C ATOM 0 H THR A 6 61.792 -17.024 14.154 1.00 0.00 H new ATOM 0 HA THR A 6 63.743 -14.838 14.411 1.00 0.00 H new ATOM 0 HB THR A 6 64.367 -17.753 14.008 1.00 0.00 H new ATOM 0 HG1 THR A 6 64.109 -18.009 16.300 1.00 0.00 H new ATOM 0 HG21 THR A 6 66.219 -17.129 15.517 1.00 0.00 H new ATOM 0 HG22 THR A 6 66.144 -16.036 14.114 1.00 0.00 H new ATOM 0 HG23 THR A 6 65.526 -15.499 15.694 1.00 0.00 H new ATOM 103 N VAL A 7 63.944 -14.620 11.927 1.00 0.00 N ATOM 104 CA VAL A 7 64.194 -14.522 10.491 1.00 0.00 C ATOM 105 C VAL A 7 65.685 -14.382 10.191 1.00 0.00 C ATOM 106 O VAL A 7 66.320 -13.402 10.578 1.00 0.00 O ATOM 107 CB VAL A 7 63.437 -13.317 9.904 1.00 0.00 C ATOM 108 CG1 VAL A 7 62.994 -13.615 8.462 1.00 0.00 C ATOM 109 CG2 VAL A 7 62.203 -13.008 10.761 1.00 0.00 C ATOM 0 H VAL A 7 63.943 -13.731 12.426 1.00 0.00 H new ATOM 0 HA VAL A 7 63.837 -15.442 10.029 1.00 0.00 H new ATOM 0 HB VAL A 7 64.105 -12.456 9.901 1.00 0.00 H new ATOM 0 HG11 VAL A 7 62.460 -12.754 8.060 1.00 0.00 H new ATOM 0 HG12 VAL A 7 63.871 -13.818 7.847 1.00 0.00 H new ATOM 0 HG13 VAL A 7 62.337 -14.485 8.456 1.00 0.00 H new ATOM 0 HG21 VAL A 7 61.672 -12.154 10.340 1.00 0.00 H new ATOM 0 HG22 VAL A 7 61.543 -13.875 10.774 1.00 0.00 H new ATOM 0 HG23 VAL A 7 62.516 -12.775 11.779 1.00 0.00 H new ATOM 119 N GLU A 8 66.234 -15.354 9.470 1.00 0.00 N ATOM 120 CA GLU A 8 67.642 -15.300 9.098 1.00 0.00 C ATOM 121 C GLU A 8 67.830 -14.201 8.064 1.00 0.00 C ATOM 122 O GLU A 8 67.027 -14.074 7.139 1.00 0.00 O ATOM 123 CB GLU A 8 68.091 -16.643 8.519 1.00 0.00 C ATOM 124 CG GLU A 8 67.824 -17.754 9.536 1.00 0.00 C ATOM 125 CD GLU A 8 68.548 -19.028 9.117 1.00 0.00 C ATOM 126 OE1 GLU A 8 69.655 -19.239 9.586 1.00 0.00 O ATOM 127 OE2 GLU A 8 67.985 -19.776 8.334 1.00 0.00 O ATOM 0 H GLU A 8 65.733 -16.177 9.136 1.00 0.00 H new ATOM 0 HA GLU A 8 68.245 -15.089 9.981 1.00 0.00 H new ATOM 0 HB2 GLU A 8 67.556 -16.848 7.592 1.00 0.00 H new ATOM 0 HB3 GLU A 8 69.152 -16.608 8.273 1.00 0.00 H new ATOM 0 HG2 GLU A 8 68.161 -17.442 10.525 1.00 0.00 H new ATOM 0 HG3 GLU A 8 66.753 -17.942 9.609 1.00 0.00 H new ATOM 134 N ILE A 9 68.867 -13.387 8.223 1.00 0.00 N ATOM 135 CA ILE A 9 69.088 -12.295 7.283 1.00 0.00 C ATOM 136 C ILE A 9 69.985 -12.703 6.133 1.00 0.00 C ATOM 137 O ILE A 9 70.904 -13.507 6.286 1.00 0.00 O ATOM 138 CB ILE A 9 69.760 -11.082 7.951 1.00 0.00 C ATOM 139 CG1 ILE A 9 69.626 -11.131 9.477 1.00 0.00 C ATOM 140 CG2 ILE A 9 69.138 -9.796 7.406 1.00 0.00 C ATOM 141 CD1 ILE A 9 68.304 -10.510 9.922 1.00 0.00 C ATOM 0 H ILE A 9 69.553 -13.458 8.975 1.00 0.00 H new ATOM 0 HA ILE A 9 68.094 -12.034 6.921 1.00 0.00 H new ATOM 0 HB ILE A 9 70.824 -11.106 7.716 1.00 0.00 H new ATOM 0 HG12 ILE A 9 69.682 -12.164 9.819 1.00 0.00 H new ATOM 0 HG13 ILE A 9 70.458 -10.598 9.938 1.00 0.00 H new ATOM 0 HG21 ILE A 9 69.612 -8.935 7.877 1.00 0.00 H new ATOM 0 HG22 ILE A 9 69.288 -9.748 6.327 1.00 0.00 H new ATOM 0 HG23 ILE A 9 68.070 -9.787 7.624 1.00 0.00 H new ATOM 0 HD11 ILE A 9 68.228 -10.555 11.008 1.00 0.00 H new ATOM 0 HD12 ILE A 9 68.263 -9.470 9.598 1.00 0.00 H new ATOM 0 HD13 ILE A 9 67.475 -11.061 9.478 1.00 0.00 H new ATOM 153 N THR A 10 69.760 -12.049 5.007 1.00 0.00 N ATOM 154 CA THR A 10 70.596 -12.237 3.844 1.00 0.00 C ATOM 155 C THR A 10 71.509 -11.028 3.812 1.00 0.00 C ATOM 156 O THR A 10 72.268 -10.806 2.869 1.00 0.00 O ATOM 157 CB THR A 10 69.754 -12.316 2.566 1.00 0.00 C ATOM 158 OG1 THR A 10 70.589 -12.673 1.473 1.00 0.00 O ATOM 159 CG2 THR A 10 69.104 -10.958 2.292 1.00 0.00 C ATOM 0 H THR A 10 69.000 -11.381 4.878 1.00 0.00 H new ATOM 0 HA THR A 10 71.156 -13.171 3.897 1.00 0.00 H new ATOM 0 HB THR A 10 68.975 -13.068 2.691 1.00 0.00 H new ATOM 0 HG1 THR A 10 71.461 -12.238 1.572 1.00 0.00 H new ATOM 0 HG21 THR A 10 68.506 -11.018 1.383 1.00 0.00 H new ATOM 0 HG22 THR A 10 68.463 -10.686 3.130 1.00 0.00 H new ATOM 0 HG23 THR A 10 69.879 -10.202 2.167 1.00 0.00 H new ATOM 167 N ASN A 11 71.389 -10.258 4.903 1.00 0.00 N ATOM 168 CA ASN A 11 72.152 -9.036 5.132 1.00 0.00 C ATOM 169 C ASN A 11 71.260 -7.809 4.967 1.00 0.00 C ATOM 170 O ASN A 11 71.750 -6.691 4.805 1.00 0.00 O ATOM 171 CB ASN A 11 73.345 -8.936 4.184 1.00 0.00 C ATOM 172 CG ASN A 11 74.308 -7.858 4.671 1.00 0.00 C ATOM 173 OD1 ASN A 11 73.960 -7.088 5.666 1.00 0.00 O flip ATOM 174 ND2 ASN A 11 75.405 -7.714 4.132 1.00 0.00 N flip ATOM 0 H ASN A 11 70.744 -10.477 5.662 1.00 0.00 H new ATOM 0 HA ASN A 11 72.529 -9.073 6.154 1.00 0.00 H new ATOM 0 HB2 ASN A 11 73.858 -9.896 4.129 1.00 0.00 H new ATOM 0 HB3 ASN A 11 73.001 -8.700 3.177 1.00 0.00 H new ATOM 0 HD21 ASN A 11 75.674 -8.317 3.355 1.00 0.00 H new ATOM 0 HD22 ASN A 11 76.045 -6.992 4.463 1.00 0.00 H new ATOM 181 N LYS A 12 69.948 -8.026 5.015 1.00 0.00 N ATOM 182 CA LYS A 12 68.989 -6.935 4.877 1.00 0.00 C ATOM 183 C LYS A 12 68.324 -6.615 6.221 1.00 0.00 C ATOM 184 O LYS A 12 68.864 -5.839 7.010 1.00 0.00 O ATOM 185 CB LYS A 12 67.921 -7.297 3.829 1.00 0.00 C ATOM 186 CG LYS A 12 68.221 -6.576 2.505 1.00 0.00 C ATOM 187 CD LYS A 12 67.025 -6.703 1.553 1.00 0.00 C ATOM 188 CE LYS A 12 67.094 -8.038 0.809 1.00 0.00 C ATOM 189 NZ LYS A 12 68.267 -8.036 -0.109 1.00 0.00 N ATOM 0 H LYS A 12 69.526 -8.945 5.148 1.00 0.00 H new ATOM 0 HA LYS A 12 69.528 -6.048 4.544 1.00 0.00 H new ATOM 0 HB2 LYS A 12 67.906 -8.375 3.670 1.00 0.00 H new ATOM 0 HB3 LYS A 12 66.933 -7.014 4.191 1.00 0.00 H new ATOM 0 HG2 LYS A 12 68.434 -5.524 2.695 1.00 0.00 H new ATOM 0 HG3 LYS A 12 69.111 -7.003 2.043 1.00 0.00 H new ATOM 0 HD2 LYS A 12 66.093 -6.637 2.114 1.00 0.00 H new ATOM 0 HD3 LYS A 12 67.027 -5.878 0.840 1.00 0.00 H new ATOM 0 HE2 LYS A 12 67.178 -8.859 1.521 1.00 0.00 H new ATOM 0 HE3 LYS A 12 66.176 -8.199 0.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 68.064 -8.637 -0.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 68.457 -7.064 -0.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 69.100 -8.405 0.392 1.00 0.00 H new ATOM 203 N LEU A 13 67.137 -7.182 6.469 1.00 0.00 N ATOM 204 CA LEU A 13 66.416 -6.898 7.713 1.00 0.00 C ATOM 205 C LEU A 13 66.305 -5.387 7.862 1.00 0.00 C ATOM 206 O LEU A 13 65.824 -4.866 8.867 1.00 0.00 O ATOM 207 CB LEU A 13 67.158 -7.533 8.914 1.00 0.00 C ATOM 208 CG LEU A 13 67.004 -6.707 10.210 1.00 0.00 C ATOM 209 CD1 LEU A 13 65.539 -6.686 10.656 1.00 0.00 C ATOM 210 CD2 LEU A 13 67.845 -7.345 11.322 1.00 0.00 C ATOM 0 H LEU A 13 66.664 -7.828 5.837 1.00 0.00 H new ATOM 0 HA LEU A 13 65.416 -7.331 7.685 1.00 0.00 H new ATOM 0 HB2 LEU A 13 66.776 -8.540 9.082 1.00 0.00 H new ATOM 0 HB3 LEU A 13 68.217 -7.630 8.673 1.00 0.00 H new ATOM 0 HG LEU A 13 67.339 -5.688 10.017 1.00 0.00 H new ATOM 0 HD11 LEU A 13 65.445 -6.100 11.571 1.00 0.00 H new ATOM 0 HD12 LEU A 13 64.927 -6.237 9.874 1.00 0.00 H new ATOM 0 HD13 LEU A 13 65.201 -7.705 10.842 1.00 0.00 H new ATOM 0 HD21 LEU A 13 67.738 -6.764 12.238 1.00 0.00 H new ATOM 0 HD22 LEU A 13 67.503 -8.365 11.497 1.00 0.00 H new ATOM 0 HD23 LEU A 13 68.893 -7.360 11.022 1.00 0.00 H new ATOM 222 N GLY A 14 66.776 -4.689 6.840 1.00 0.00 N ATOM 223 CA GLY A 14 66.761 -3.241 6.853 1.00 0.00 C ATOM 224 C GLY A 14 68.020 -2.750 7.530 1.00 0.00 C ATOM 225 O GLY A 14 68.333 -1.563 7.489 1.00 0.00 O ATOM 0 H GLY A 14 67.171 -5.103 5.996 1.00 0.00 H new ATOM 0 HA2 GLY A 14 66.704 -2.854 5.835 1.00 0.00 H new ATOM 0 HA3 GLY A 14 65.881 -2.877 7.382 1.00 0.00 H new ATOM 229 N MET A 15 68.730 -3.699 8.153 1.00 0.00 N ATOM 230 CA MET A 15 69.974 -3.415 8.864 1.00 0.00 C ATOM 231 C MET A 15 70.530 -2.047 8.481 1.00 0.00 C ATOM 232 O MET A 15 71.598 -1.930 7.883 1.00 0.00 O ATOM 233 CB MET A 15 71.000 -4.527 8.583 1.00 0.00 C ATOM 234 CG MET A 15 71.555 -4.431 7.149 1.00 0.00 C ATOM 235 SD MET A 15 70.339 -3.677 6.038 1.00 0.00 S ATOM 236 CE MET A 15 71.492 -3.201 4.728 1.00 0.00 C ATOM 0 H MET A 15 68.456 -4.681 8.176 1.00 0.00 H new ATOM 0 HA MET A 15 69.765 -3.391 9.934 1.00 0.00 H new ATOM 0 HB2 MET A 15 71.820 -4.456 9.298 1.00 0.00 H new ATOM 0 HB3 MET A 15 70.533 -5.501 8.729 1.00 0.00 H new ATOM 0 HG2 MET A 15 72.471 -3.840 7.148 1.00 0.00 H new ATOM 0 HG3 MET A 15 71.817 -5.426 6.788 1.00 0.00 H new ATOM 0 HE1 MET A 15 70.946 -2.708 3.924 1.00 0.00 H new ATOM 0 HE2 MET A 15 72.239 -2.517 5.131 1.00 0.00 H new ATOM 0 HE3 MET A 15 71.987 -4.090 4.338 1.00 0.00 H new ATOM 246 N HIS A 16 69.767 -1.018 8.831 1.00 0.00 N ATOM 247 CA HIS A 16 70.128 0.359 8.533 1.00 0.00 C ATOM 248 C HIS A 16 68.951 1.263 8.882 1.00 0.00 C ATOM 249 O HIS A 16 69.004 2.014 9.856 1.00 0.00 O ATOM 250 CB HIS A 16 70.480 0.501 7.048 1.00 0.00 C ATOM 251 CG HIS A 16 70.547 1.958 6.674 1.00 0.00 C ATOM 252 ND1 HIS A 16 70.590 2.965 7.625 1.00 0.00 N ATOM 253 CD2 HIS A 16 70.585 2.591 5.456 1.00 0.00 C ATOM 254 CE1 HIS A 16 70.650 4.139 6.971 1.00 0.00 C ATOM 255 NE2 HIS A 16 70.651 3.968 5.646 1.00 0.00 N ATOM 0 H HIS A 16 68.882 -1.117 9.329 1.00 0.00 H new ATOM 0 HA HIS A 16 70.999 0.647 9.122 1.00 0.00 H new ATOM 0 HB2 HIS A 16 71.437 0.020 6.845 1.00 0.00 H new ATOM 0 HB3 HIS A 16 69.732 -0.006 6.438 1.00 0.00 H new ATOM 0 HD2 HIS A 16 70.566 2.096 4.497 1.00 0.00 H new ATOM 0 HE1 HIS A 16 70.692 5.102 7.458 1.00 0.00 H new ATOM 0 HE2 HIS A 16 70.691 4.691 4.928 1.00 0.00 H new ATOM 263 N ALA A 17 67.882 1.160 8.090 1.00 0.00 N ATOM 264 CA ALA A 17 66.670 1.950 8.324 1.00 0.00 C ATOM 265 C ALA A 17 65.885 2.165 7.028 1.00 0.00 C ATOM 266 O ALA A 17 66.017 3.201 6.378 1.00 0.00 O ATOM 267 CB ALA A 17 67.023 3.315 8.931 1.00 0.00 C ATOM 0 H ALA A 17 67.830 0.539 7.283 1.00 0.00 H new ATOM 0 HA ALA A 17 66.048 1.389 9.022 1.00 0.00 H new ATOM 0 HB1 ALA A 17 66.110 3.886 9.097 1.00 0.00 H new ATOM 0 HB2 ALA A 17 67.537 3.169 9.881 1.00 0.00 H new ATOM 0 HB3 ALA A 17 67.673 3.860 8.247 1.00 0.00 H new ATOM 273 N ARG A 18 65.046 1.192 6.676 1.00 0.00 N ATOM 274 CA ARG A 18 64.216 1.296 5.476 1.00 0.00 C ATOM 275 C ARG A 18 62.946 0.452 5.656 1.00 0.00 C ATOM 276 O ARG A 18 61.869 1.004 5.896 1.00 0.00 O ATOM 277 CB ARG A 18 65.004 0.867 4.227 1.00 0.00 C ATOM 278 CG ARG A 18 65.599 2.098 3.535 1.00 0.00 C ATOM 279 CD ARG A 18 66.270 1.671 2.229 1.00 0.00 C ATOM 280 NE ARG A 18 66.618 2.841 1.433 1.00 0.00 N ATOM 281 CZ ARG A 18 67.480 2.754 0.426 1.00 0.00 C ATOM 282 NH1 ARG A 18 67.774 3.815 -0.275 1.00 0.00 N ATOM 283 NH2 ARG A 18 68.035 1.608 0.140 1.00 0.00 N ATOM 0 H ARG A 18 64.923 0.327 7.202 1.00 0.00 H new ATOM 0 HA ARG A 18 63.924 2.336 5.331 1.00 0.00 H new ATOM 0 HB2 ARG A 18 65.800 0.177 4.508 1.00 0.00 H new ATOM 0 HB3 ARG A 18 64.348 0.334 3.539 1.00 0.00 H new ATOM 0 HG2 ARG A 18 64.816 2.829 3.333 1.00 0.00 H new ATOM 0 HG3 ARG A 18 66.325 2.581 4.189 1.00 0.00 H new ATOM 0 HD2 ARG A 18 67.167 1.090 2.446 1.00 0.00 H new ATOM 0 HD3 ARG A 18 65.600 1.024 1.663 1.00 0.00 H new ATOM 0 HE ARG A 18 66.193 3.742 1.653 1.00 0.00 H new ATOM 0 HH11 ARG A 18 67.342 4.711 -0.050 1.00 0.00 H new ATOM 0 HH12 ARG A 18 68.436 3.748 -1.048 1.00 0.00 H new ATOM 0 HH21 ARG A 18 67.807 0.780 0.690 1.00 0.00 H new ATOM 0 HH22 ARG A 18 68.697 1.541 -0.633 1.00 0.00 H new ATOM 297 N PRO A 19 63.037 -0.859 5.599 1.00 0.00 N ATOM 298 CA PRO A 19 61.853 -1.739 5.813 1.00 0.00 C ATOM 299 C PRO A 19 61.507 -1.749 7.295 1.00 0.00 C ATOM 300 O PRO A 19 60.339 -1.656 7.702 1.00 0.00 O ATOM 301 CB PRO A 19 62.345 -3.107 5.352 1.00 0.00 C ATOM 302 CG PRO A 19 63.800 -3.085 5.648 1.00 0.00 C ATOM 303 CD PRO A 19 64.251 -1.656 5.341 1.00 0.00 C ATOM 0 HA PRO A 19 60.956 -1.423 5.281 1.00 0.00 H new ATOM 0 HB2 PRO A 19 61.841 -3.913 5.886 1.00 0.00 H new ATOM 0 HB3 PRO A 19 62.156 -3.262 4.290 1.00 0.00 H new ATOM 0 HG2 PRO A 19 63.994 -3.344 6.689 1.00 0.00 H new ATOM 0 HG3 PRO A 19 64.338 -3.808 5.034 1.00 0.00 H new ATOM 0 HD2 PRO A 19 65.078 -1.348 5.980 1.00 0.00 H new ATOM 0 HD3 PRO A 19 64.589 -1.553 4.310 1.00 0.00 H new ATOM 311 N ALA A 20 62.569 -1.824 8.091 1.00 0.00 N ATOM 312 CA ALA A 20 62.458 -1.810 9.536 1.00 0.00 C ATOM 313 C ALA A 20 61.687 -0.570 9.964 1.00 0.00 C ATOM 314 O ALA A 20 60.973 -0.576 10.962 1.00 0.00 O ATOM 315 CB ALA A 20 63.867 -1.790 10.142 1.00 0.00 C ATOM 0 H ALA A 20 63.527 -1.896 7.748 1.00 0.00 H new ATOM 0 HA ALA A 20 61.929 -2.697 9.884 1.00 0.00 H new ATOM 0 HB1 ALA A 20 63.795 -1.779 11.230 1.00 0.00 H new ATOM 0 HB2 ALA A 20 64.413 -2.678 9.823 1.00 0.00 H new ATOM 0 HB3 ALA A 20 64.396 -0.898 9.805 1.00 0.00 H new ATOM 321 N MET A 21 61.843 0.491 9.185 1.00 0.00 N ATOM 322 CA MET A 21 61.159 1.745 9.465 1.00 0.00 C ATOM 323 C MET A 21 59.676 1.621 9.131 1.00 0.00 C ATOM 324 O MET A 21 58.827 2.092 9.881 1.00 0.00 O ATOM 325 CB MET A 21 61.781 2.885 8.653 1.00 0.00 C ATOM 326 CG MET A 21 63.165 3.240 9.218 1.00 0.00 C ATOM 327 SD MET A 21 63.457 5.018 9.028 1.00 0.00 S ATOM 328 CE MET A 21 63.808 5.014 7.252 1.00 0.00 C ATOM 0 H MET A 21 62.436 0.508 8.355 1.00 0.00 H new ATOM 0 HA MET A 21 61.268 1.969 10.526 1.00 0.00 H new ATOM 0 HB2 MET A 21 61.871 2.590 7.607 1.00 0.00 H new ATOM 0 HB3 MET A 21 61.132 3.760 8.683 1.00 0.00 H new ATOM 0 HG2 MET A 21 63.222 2.962 10.270 1.00 0.00 H new ATOM 0 HG3 MET A 21 63.938 2.676 8.696 1.00 0.00 H new ATOM 0 HE1 MET A 21 64.843 5.314 7.085 1.00 0.00 H new ATOM 0 HE2 MET A 21 63.651 4.012 6.852 1.00 0.00 H new ATOM 0 HE3 MET A 21 63.142 5.714 6.748 1.00 0.00 H new ATOM 338 N LYS A 22 59.358 0.973 8.012 1.00 0.00 N ATOM 339 CA LYS A 22 57.952 0.805 7.641 1.00 0.00 C ATOM 340 C LYS A 22 57.171 0.354 8.860 1.00 0.00 C ATOM 341 O LYS A 22 56.224 1.008 9.276 1.00 0.00 O ATOM 342 CB LYS A 22 57.795 -0.235 6.532 1.00 0.00 C ATOM 343 CG LYS A 22 58.865 -0.010 5.475 1.00 0.00 C ATOM 344 CD LYS A 22 58.618 1.322 4.762 1.00 0.00 C ATOM 345 CE LYS A 22 59.464 1.386 3.488 1.00 0.00 C ATOM 346 NZ LYS A 22 58.803 0.595 2.411 1.00 0.00 N ATOM 0 H LYS A 22 60.031 0.566 7.363 1.00 0.00 H new ATOM 0 HA LYS A 22 57.573 1.759 7.274 1.00 0.00 H new ATOM 0 HB2 LYS A 22 57.882 -1.240 6.945 1.00 0.00 H new ATOM 0 HB3 LYS A 22 56.804 -0.159 6.084 1.00 0.00 H new ATOM 0 HG2 LYS A 22 59.852 -0.008 5.938 1.00 0.00 H new ATOM 0 HG3 LYS A 22 58.854 -0.827 4.753 1.00 0.00 H new ATOM 0 HD2 LYS A 22 57.561 1.423 4.515 1.00 0.00 H new ATOM 0 HD3 LYS A 22 58.872 2.152 5.422 1.00 0.00 H new ATOM 0 HE2 LYS A 22 59.585 2.422 3.171 1.00 0.00 H new ATOM 0 HE3 LYS A 22 60.462 0.993 3.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 59.527 0.112 1.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 58.170 -0.111 2.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 58.251 1.232 1.802 1.00 0.00 H new ATOM 360 N LEU A 23 57.614 -0.750 9.447 1.00 0.00 N ATOM 361 CA LEU A 23 56.994 -1.296 10.645 1.00 0.00 C ATOM 362 C LEU A 23 56.455 -0.173 11.511 1.00 0.00 C ATOM 363 O LEU A 23 55.361 -0.250 12.062 1.00 0.00 O ATOM 364 CB LEU A 23 58.081 -1.998 11.441 1.00 0.00 C ATOM 365 CG LEU A 23 58.078 -3.500 11.194 1.00 0.00 C ATOM 366 CD1 LEU A 23 58.672 -3.802 9.808 1.00 0.00 C ATOM 367 CD2 LEU A 23 58.942 -4.142 12.273 1.00 0.00 C ATOM 0 H LEU A 23 58.410 -1.290 9.107 1.00 0.00 H new ATOM 0 HA LEU A 23 56.184 -1.969 10.365 1.00 0.00 H new ATOM 0 HB2 LEU A 23 59.053 -1.587 11.171 1.00 0.00 H new ATOM 0 HB3 LEU A 23 57.937 -1.804 12.504 1.00 0.00 H new ATOM 0 HG LEU A 23 57.062 -3.893 11.227 1.00 0.00 H new ATOM 0 HD11 LEU A 23 58.667 -4.878 9.637 1.00 0.00 H new ATOM 0 HD12 LEU A 23 58.074 -3.310 9.041 1.00 0.00 H new ATOM 0 HD13 LEU A 23 59.696 -3.432 9.763 1.00 0.00 H new ATOM 0 HD21 LEU A 23 58.963 -5.222 12.127 1.00 0.00 H new ATOM 0 HD22 LEU A 23 59.956 -3.747 12.210 1.00 0.00 H new ATOM 0 HD23 LEU A 23 58.525 -3.916 13.255 1.00 0.00 H new ATOM 379 N PHE A 24 57.266 0.857 11.626 1.00 0.00 N ATOM 380 CA PHE A 24 56.933 2.013 12.425 1.00 0.00 C ATOM 381 C PHE A 24 55.815 2.817 11.747 1.00 0.00 C ATOM 382 O PHE A 24 54.714 2.974 12.288 1.00 0.00 O ATOM 383 CB PHE A 24 58.187 2.872 12.564 1.00 0.00 C ATOM 384 CG PHE A 24 59.311 2.106 13.261 1.00 0.00 C ATOM 385 CD1 PHE A 24 60.021 2.735 14.288 1.00 0.00 C ATOM 386 CD2 PHE A 24 59.671 0.794 12.878 1.00 0.00 C ATOM 387 CE1 PHE A 24 61.072 2.081 14.930 1.00 0.00 C ATOM 388 CE2 PHE A 24 60.724 0.140 13.532 1.00 0.00 C ATOM 389 CZ PHE A 24 61.424 0.786 14.556 1.00 0.00 C ATOM 0 H PHE A 24 58.175 0.915 11.167 1.00 0.00 H new ATOM 0 HA PHE A 24 56.581 1.702 13.408 1.00 0.00 H new ATOM 0 HB2 PHE A 24 58.521 3.194 11.578 1.00 0.00 H new ATOM 0 HB3 PHE A 24 57.952 3.773 13.131 1.00 0.00 H new ATOM 0 HD1 PHE A 24 59.753 3.737 14.587 1.00 0.00 H new ATOM 0 HD2 PHE A 24 59.136 0.296 12.083 1.00 0.00 H new ATOM 0 HE1 PHE A 24 61.615 2.580 15.719 1.00 0.00 H new ATOM 0 HE2 PHE A 24 60.995 -0.865 13.245 1.00 0.00 H new ATOM 0 HZ PHE A 24 62.237 0.281 15.057 1.00 0.00 H new ATOM 399 N GLU A 25 56.091 3.299 10.542 1.00 0.00 N ATOM 400 CA GLU A 25 55.090 4.053 9.795 1.00 0.00 C ATOM 401 C GLU A 25 53.928 3.136 9.460 1.00 0.00 C ATOM 402 O GLU A 25 52.786 3.572 9.323 1.00 0.00 O ATOM 403 CB GLU A 25 55.699 4.623 8.512 1.00 0.00 C ATOM 404 CG GLU A 25 56.727 5.698 8.869 1.00 0.00 C ATOM 405 CD GLU A 25 56.017 6.952 9.367 1.00 0.00 C ATOM 406 OE1 GLU A 25 56.091 7.218 10.556 1.00 0.00 O ATOM 407 OE2 GLU A 25 55.410 7.628 8.553 1.00 0.00 O ATOM 0 H GLU A 25 56.986 3.184 10.066 1.00 0.00 H new ATOM 0 HA GLU A 25 54.736 4.885 10.403 1.00 0.00 H new ATOM 0 HB2 GLU A 25 56.174 3.828 7.937 1.00 0.00 H new ATOM 0 HB3 GLU A 25 54.917 5.048 7.883 1.00 0.00 H new ATOM 0 HG2 GLU A 25 57.405 5.324 9.637 1.00 0.00 H new ATOM 0 HG3 GLU A 25 57.335 5.936 7.996 1.00 0.00 H new ATOM 414 N LEU A 26 54.236 1.852 9.365 1.00 0.00 N ATOM 415 CA LEU A 26 53.232 0.845 9.090 1.00 0.00 C ATOM 416 C LEU A 26 52.538 0.497 10.391 1.00 0.00 C ATOM 417 O LEU A 26 51.354 0.175 10.408 1.00 0.00 O ATOM 418 CB LEU A 26 53.888 -0.382 8.439 1.00 0.00 C ATOM 419 CG LEU A 26 53.049 -1.632 8.669 1.00 0.00 C ATOM 420 CD1 LEU A 26 53.198 -2.064 10.138 1.00 0.00 C ATOM 421 CD2 LEU A 26 51.571 -1.352 8.307 1.00 0.00 C ATOM 0 H LEU A 26 55.181 1.484 9.476 1.00 0.00 H new ATOM 0 HA LEU A 26 52.487 1.220 8.388 1.00 0.00 H new ATOM 0 HB2 LEU A 26 54.007 -0.211 7.369 1.00 0.00 H new ATOM 0 HB3 LEU A 26 54.886 -0.528 8.852 1.00 0.00 H new ATOM 0 HG LEU A 26 53.395 -2.443 8.028 1.00 0.00 H new ATOM 0 HD11 LEU A 26 52.602 -2.959 10.316 1.00 0.00 H new ATOM 0 HD12 LEU A 26 54.246 -2.278 10.350 1.00 0.00 H new ATOM 0 HD13 LEU A 26 52.852 -1.262 10.790 1.00 0.00 H new ATOM 0 HD21 LEU A 26 50.979 -2.252 8.475 1.00 0.00 H new ATOM 0 HD22 LEU A 26 51.190 -0.545 8.932 1.00 0.00 H new ATOM 0 HD23 LEU A 26 51.502 -1.062 7.259 1.00 0.00 H new ATOM 433 N MET A 27 53.272 0.599 11.492 1.00 0.00 N ATOM 434 CA MET A 27 52.682 0.329 12.792 1.00 0.00 C ATOM 435 C MET A 27 51.428 1.172 12.884 1.00 0.00 C ATOM 436 O MET A 27 50.428 0.770 13.478 1.00 0.00 O ATOM 437 CB MET A 27 53.652 0.688 13.933 1.00 0.00 C ATOM 438 CG MET A 27 54.404 -0.563 14.428 1.00 0.00 C ATOM 439 SD MET A 27 53.854 -0.977 16.103 1.00 0.00 S ATOM 440 CE MET A 27 54.604 0.437 16.953 1.00 0.00 C ATOM 0 H MET A 27 54.257 0.862 11.510 1.00 0.00 H new ATOM 0 HA MET A 27 52.456 -0.733 12.893 1.00 0.00 H new ATOM 0 HB2 MET A 27 54.367 1.434 13.587 1.00 0.00 H new ATOM 0 HB3 MET A 27 53.099 1.136 14.759 1.00 0.00 H new ATOM 0 HG2 MET A 27 54.219 -1.401 13.756 1.00 0.00 H new ATOM 0 HG3 MET A 27 55.479 -0.380 14.422 1.00 0.00 H new ATOM 0 HE1 MET A 27 54.815 0.169 17.988 1.00 0.00 H new ATOM 0 HE2 MET A 27 55.533 0.711 16.453 1.00 0.00 H new ATOM 0 HE3 MET A 27 53.916 1.282 16.930 1.00 0.00 H new ATOM 450 N GLN A 28 51.480 2.334 12.238 1.00 0.00 N ATOM 451 CA GLN A 28 50.320 3.209 12.203 1.00 0.00 C ATOM 452 C GLN A 28 49.279 2.573 11.287 1.00 0.00 C ATOM 453 O GLN A 28 48.112 2.966 11.272 1.00 0.00 O ATOM 454 CB GLN A 28 50.707 4.599 11.681 1.00 0.00 C ATOM 455 CG GLN A 28 51.095 5.501 12.856 1.00 0.00 C ATOM 456 CD GLN A 28 51.560 6.858 12.338 1.00 0.00 C ATOM 457 OE1 GLN A 28 52.091 6.952 11.231 1.00 0.00 O ATOM 458 NE2 GLN A 28 51.390 7.920 13.076 1.00 0.00 N ATOM 0 H GLN A 28 52.299 2.684 11.741 1.00 0.00 H new ATOM 0 HA GLN A 28 49.917 3.333 13.208 1.00 0.00 H new ATOM 0 HB2 GLN A 28 51.540 4.517 10.982 1.00 0.00 H new ATOM 0 HB3 GLN A 28 49.873 5.038 11.133 1.00 0.00 H new ATOM 0 HG2 GLN A 28 50.243 5.629 13.524 1.00 0.00 H new ATOM 0 HG3 GLN A 28 51.889 5.033 13.438 1.00 0.00 H new ATOM 0 HE21 GLN A 28 50.950 7.839 13.993 1.00 0.00 H new ATOM 0 HE22 GLN A 28 51.697 8.831 12.737 1.00 0.00 H new ATOM 467 N GLY A 29 49.729 1.565 10.536 1.00 0.00 N ATOM 468 CA GLY A 29 48.856 0.834 9.616 1.00 0.00 C ATOM 469 C GLY A 29 48.264 -0.388 10.309 1.00 0.00 C ATOM 470 O GLY A 29 47.050 -0.594 10.299 1.00 0.00 O ATOM 0 H GLY A 29 50.695 1.236 10.547 1.00 0.00 H new ATOM 0 HA2 GLY A 29 48.056 1.486 9.267 1.00 0.00 H new ATOM 0 HA3 GLY A 29 49.421 0.524 8.737 1.00 0.00 H new ATOM 474 N PHE A 30 49.130 -1.178 10.941 1.00 0.00 N ATOM 475 CA PHE A 30 48.684 -2.360 11.676 1.00 0.00 C ATOM 476 C PHE A 30 48.773 -2.072 13.161 1.00 0.00 C ATOM 477 O PHE A 30 49.705 -1.408 13.611 1.00 0.00 O ATOM 478 CB PHE A 30 49.563 -3.584 11.395 1.00 0.00 C ATOM 479 CG PHE A 30 49.669 -3.874 9.919 1.00 0.00 C ATOM 480 CD1 PHE A 30 50.926 -4.087 9.367 1.00 0.00 C ATOM 481 CD2 PHE A 30 48.532 -3.968 9.116 1.00 0.00 C ATOM 482 CE1 PHE A 30 51.069 -4.389 8.018 1.00 0.00 C ATOM 483 CE2 PHE A 30 48.668 -4.267 7.757 1.00 0.00 C ATOM 484 CZ PHE A 30 49.941 -4.480 7.206 1.00 0.00 C ATOM 0 H PHE A 30 50.138 -1.023 10.959 1.00 0.00 H new ATOM 0 HA PHE A 30 47.665 -2.578 11.357 1.00 0.00 H new ATOM 0 HB2 PHE A 30 50.559 -3.417 11.805 1.00 0.00 H new ATOM 0 HB3 PHE A 30 49.149 -4.453 11.907 1.00 0.00 H new ATOM 0 HD1 PHE A 30 51.803 -4.017 9.994 1.00 0.00 H new ATOM 0 HD2 PHE A 30 47.552 -3.811 9.542 1.00 0.00 H new ATOM 0 HE1 PHE A 30 52.052 -4.553 7.601 1.00 0.00 H new ATOM 0 HE2 PHE A 30 47.791 -4.334 7.130 1.00 0.00 H new ATOM 0 HZ PHE A 30 50.046 -4.714 6.157 1.00 0.00 H new ATOM 494 N ASP A 31 47.839 -2.604 13.930 1.00 0.00 N ATOM 495 CA ASP A 31 47.881 -2.417 15.358 1.00 0.00 C ATOM 496 C ASP A 31 48.546 -3.635 15.931 1.00 0.00 C ATOM 497 O ASP A 31 47.931 -4.691 16.062 1.00 0.00 O ATOM 498 CB ASP A 31 46.476 -2.252 15.930 1.00 0.00 C ATOM 499 CG ASP A 31 46.551 -1.980 17.428 1.00 0.00 C ATOM 500 OD1 ASP A 31 45.506 -1.929 18.055 1.00 0.00 O ATOM 501 OD2 ASP A 31 47.654 -1.826 17.927 1.00 0.00 O ATOM 0 H ASP A 31 47.055 -3.161 13.590 1.00 0.00 H new ATOM 0 HA ASP A 31 48.432 -1.512 15.613 1.00 0.00 H new ATOM 0 HB2 ASP A 31 45.964 -1.431 15.428 1.00 0.00 H new ATOM 0 HB3 ASP A 31 45.891 -3.153 15.745 1.00 0.00 H new ATOM 506 N ALA A 32 49.821 -3.500 16.229 1.00 0.00 N ATOM 507 CA ALA A 32 50.563 -4.601 16.737 1.00 0.00 C ATOM 508 C ALA A 32 51.894 -4.116 17.240 1.00 0.00 C ATOM 509 O ALA A 32 52.435 -3.120 16.763 1.00 0.00 O ATOM 510 CB ALA A 32 50.754 -5.634 15.642 1.00 0.00 C ATOM 0 H ALA A 32 50.351 -2.635 16.124 1.00 0.00 H new ATOM 0 HA ALA A 32 50.021 -5.063 17.562 1.00 0.00 H new ATOM 0 HB1 ALA A 32 51.323 -6.478 16.033 1.00 0.00 H new ATOM 0 HB2 ALA A 32 49.781 -5.982 15.296 1.00 0.00 H new ATOM 0 HB3 ALA A 32 51.296 -5.186 14.809 1.00 0.00 H new ATOM 516 N GLU A 33 52.400 -4.816 18.216 1.00 0.00 N ATOM 517 CA GLU A 33 53.653 -4.471 18.819 1.00 0.00 C ATOM 518 C GLU A 33 54.701 -5.467 18.407 1.00 0.00 C ATOM 519 O GLU A 33 54.934 -6.480 19.068 1.00 0.00 O ATOM 520 CB GLU A 33 53.458 -4.471 20.309 1.00 0.00 C ATOM 521 CG GLU A 33 54.052 -3.196 20.883 1.00 0.00 C ATOM 522 CD GLU A 33 54.045 -3.246 22.407 1.00 0.00 C ATOM 523 OE1 GLU A 33 53.313 -2.472 23.002 1.00 0.00 O ATOM 524 OE2 GLU A 33 54.770 -4.058 22.957 1.00 0.00 O ATOM 0 H GLU A 33 51.954 -5.642 18.615 1.00 0.00 H new ATOM 0 HA GLU A 33 53.988 -3.486 18.495 1.00 0.00 H new ATOM 0 HB2 GLU A 33 52.397 -4.534 20.550 1.00 0.00 H new ATOM 0 HB3 GLU A 33 53.938 -5.343 20.752 1.00 0.00 H new ATOM 0 HG2 GLU A 33 55.072 -3.068 20.522 1.00 0.00 H new ATOM 0 HG3 GLU A 33 53.481 -2.334 20.538 1.00 0.00 H new ATOM 531 N VAL A 34 55.302 -5.170 17.287 1.00 0.00 N ATOM 532 CA VAL A 34 56.310 -6.030 16.722 1.00 0.00 C ATOM 533 C VAL A 34 57.693 -5.628 17.184 1.00 0.00 C ATOM 534 O VAL A 34 58.169 -4.538 16.899 1.00 0.00 O ATOM 535 CB VAL A 34 56.179 -6.032 15.198 1.00 0.00 C ATOM 536 CG1 VAL A 34 54.714 -5.796 14.813 1.00 0.00 C ATOM 537 CG2 VAL A 34 57.035 -4.942 14.579 1.00 0.00 C ATOM 0 H VAL A 34 55.109 -4.330 16.742 1.00 0.00 H new ATOM 0 HA VAL A 34 56.157 -7.050 17.075 1.00 0.00 H new ATOM 0 HB VAL A 34 56.518 -6.998 14.825 1.00 0.00 H new ATOM 0 HG11 VAL A 34 54.618 -5.797 13.727 1.00 0.00 H new ATOM 0 HG12 VAL A 34 54.095 -6.589 15.232 1.00 0.00 H new ATOM 0 HG13 VAL A 34 54.385 -4.834 15.205 1.00 0.00 H new ATOM 0 HG21 VAL A 34 56.925 -4.964 13.495 1.00 0.00 H new ATOM 0 HG22 VAL A 34 56.716 -3.970 14.956 1.00 0.00 H new ATOM 0 HG23 VAL A 34 58.080 -5.108 14.841 1.00 0.00 H new ATOM 547 N LEU A 35 58.328 -6.521 17.928 1.00 0.00 N ATOM 548 CA LEU A 35 59.653 -6.249 18.447 1.00 0.00 C ATOM 549 C LEU A 35 60.707 -6.989 17.633 1.00 0.00 C ATOM 550 O LEU A 35 60.517 -8.140 17.241 1.00 0.00 O ATOM 551 CB LEU A 35 59.732 -6.670 19.918 1.00 0.00 C ATOM 552 CG LEU A 35 61.192 -6.943 20.308 1.00 0.00 C ATOM 553 CD1 LEU A 35 61.335 -6.835 21.825 1.00 0.00 C ATOM 554 CD2 LEU A 35 61.613 -8.352 19.843 1.00 0.00 C ATOM 0 H LEU A 35 57.948 -7.433 18.183 1.00 0.00 H new ATOM 0 HA LEU A 35 59.846 -5.179 18.371 1.00 0.00 H new ATOM 0 HB2 LEU A 35 59.318 -5.886 20.552 1.00 0.00 H new ATOM 0 HB3 LEU A 35 59.130 -7.564 20.082 1.00 0.00 H new ATOM 0 HG LEU A 35 61.837 -6.209 19.825 1.00 0.00 H new ATOM 0 HD11 LEU A 35 62.370 -7.028 22.108 1.00 0.00 H new ATOM 0 HD12 LEU A 35 61.052 -5.833 22.147 1.00 0.00 H new ATOM 0 HD13 LEU A 35 60.685 -7.567 22.305 1.00 0.00 H new ATOM 0 HD21 LEU A 35 62.650 -8.534 20.125 1.00 0.00 H new ATOM 0 HD22 LEU A 35 60.973 -9.097 20.315 1.00 0.00 H new ATOM 0 HD23 LEU A 35 61.514 -8.422 18.760 1.00 0.00 H new ATOM 566 N LEU A 36 61.810 -6.305 17.375 1.00 0.00 N ATOM 567 CA LEU A 36 62.902 -6.864 16.600 1.00 0.00 C ATOM 568 C LEU A 36 64.131 -7.112 17.465 1.00 0.00 C ATOM 569 O LEU A 36 64.612 -6.203 18.125 1.00 0.00 O ATOM 570 CB LEU A 36 63.280 -5.852 15.538 1.00 0.00 C ATOM 571 CG LEU A 36 62.369 -5.997 14.325 1.00 0.00 C ATOM 572 CD1 LEU A 36 60.904 -5.920 14.767 1.00 0.00 C ATOM 573 CD2 LEU A 36 62.659 -4.855 13.363 1.00 0.00 C ATOM 0 H LEU A 36 61.972 -5.350 17.696 1.00 0.00 H new ATOM 0 HA LEU A 36 62.578 -7.813 16.173 1.00 0.00 H new ATOM 0 HB2 LEU A 36 63.201 -4.843 15.942 1.00 0.00 H new ATOM 0 HB3 LEU A 36 64.319 -5.996 15.241 1.00 0.00 H new ATOM 0 HG LEU A 36 62.549 -6.957 13.841 1.00 0.00 H new ATOM 0 HD11 LEU A 36 60.256 -6.024 13.897 1.00 0.00 H new ATOM 0 HD12 LEU A 36 60.695 -6.723 15.474 1.00 0.00 H new ATOM 0 HD13 LEU A 36 60.718 -4.958 15.245 1.00 0.00 H new ATOM 0 HD21 LEU A 36 62.015 -4.944 12.488 1.00 0.00 H new ATOM 0 HD22 LEU A 36 62.468 -3.904 13.859 1.00 0.00 H new ATOM 0 HD23 LEU A 36 63.703 -4.898 13.051 1.00 0.00 H new ATOM 585 N ARG A 37 64.662 -8.326 17.432 1.00 0.00 N ATOM 586 CA ARG A 37 65.853 -8.633 18.187 1.00 0.00 C ATOM 587 C ARG A 37 66.694 -9.649 17.457 1.00 0.00 C ATOM 588 O ARG A 37 66.193 -10.403 16.633 1.00 0.00 O ATOM 589 CB ARG A 37 65.501 -9.198 19.550 1.00 0.00 C ATOM 590 CG ARG A 37 64.661 -10.456 19.386 1.00 0.00 C ATOM 591 CD ARG A 37 64.023 -10.854 20.725 1.00 0.00 C ATOM 592 NE ARG A 37 62.702 -11.429 20.498 1.00 0.00 N ATOM 593 CZ ARG A 37 62.077 -12.117 21.448 1.00 0.00 C ATOM 594 NH1 ARG A 37 60.895 -12.621 21.217 1.00 0.00 N ATOM 595 NH2 ARG A 37 62.644 -12.288 22.611 1.00 0.00 N ATOM 0 H ARG A 37 64.285 -9.105 16.892 1.00 0.00 H new ATOM 0 HA ARG A 37 66.410 -7.704 18.308 1.00 0.00 H new ATOM 0 HB2 ARG A 37 66.411 -9.427 20.105 1.00 0.00 H new ATOM 0 HB3 ARG A 37 64.952 -8.456 20.130 1.00 0.00 H new ATOM 0 HG2 ARG A 37 63.883 -10.287 18.642 1.00 0.00 H new ATOM 0 HG3 ARG A 37 65.284 -11.271 19.016 1.00 0.00 H new ATOM 0 HD2 ARG A 37 64.658 -11.575 21.240 1.00 0.00 H new ATOM 0 HD3 ARG A 37 63.942 -9.981 21.372 1.00 0.00 H new ATOM 0 HE ARG A 37 62.249 -11.301 19.593 1.00 0.00 H new ATOM 0 HH11 ARG A 37 60.452 -12.487 20.308 1.00 0.00 H new ATOM 0 HH12 ARG A 37 60.415 -13.149 21.945 1.00 0.00 H new ATOM 0 HH21 ARG A 37 63.567 -11.894 22.791 1.00 0.00 H new ATOM 0 HH22 ARG A 37 62.164 -12.816 23.340 1.00 0.00 H new ATOM 609 N ASN A 38 67.966 -9.688 17.796 1.00 0.00 N ATOM 610 CA ASN A 38 68.868 -10.648 17.185 1.00 0.00 C ATOM 611 C ASN A 38 69.144 -11.778 18.143 1.00 0.00 C ATOM 612 O ASN A 38 69.471 -11.541 19.314 1.00 0.00 O ATOM 613 CB ASN A 38 70.222 -10.042 16.861 1.00 0.00 C ATOM 614 CG ASN A 38 70.156 -9.048 15.730 1.00 0.00 C ATOM 615 OD1 ASN A 38 69.382 -9.204 14.788 1.00 0.00 O ATOM 616 ND2 ASN A 38 70.959 -8.032 15.767 1.00 0.00 N ATOM 0 H ASN A 38 68.398 -9.073 18.485 1.00 0.00 H new ATOM 0 HA ASN A 38 68.377 -10.984 16.272 1.00 0.00 H new ATOM 0 HB2 ASN A 38 70.618 -9.550 17.750 1.00 0.00 H new ATOM 0 HB3 ASN A 38 70.919 -10.838 16.600 1.00 0.00 H new ATOM 0 HD21 ASN A 38 70.954 -7.350 15.009 1.00 0.00 H new ATOM 0 HD22 ASN A 38 71.596 -7.914 16.555 1.00 0.00 H new ATOM 623 N ASP A 39 69.083 -12.995 17.628 1.00 0.00 N ATOM 624 CA ASP A 39 69.392 -14.160 18.443 1.00 0.00 C ATOM 625 C ASP A 39 70.745 -13.939 19.107 1.00 0.00 C ATOM 626 O ASP A 39 71.171 -14.707 19.970 1.00 0.00 O ATOM 627 CB ASP A 39 69.434 -15.421 17.576 1.00 0.00 C ATOM 628 CG ASP A 39 69.729 -16.640 18.444 1.00 0.00 C ATOM 629 OD1 ASP A 39 69.161 -16.727 19.520 1.00 0.00 O ATOM 630 OD2 ASP A 39 70.518 -17.468 18.019 1.00 0.00 O ATOM 0 H ASP A 39 68.826 -13.202 16.663 1.00 0.00 H new ATOM 0 HA ASP A 39 68.620 -14.294 19.201 1.00 0.00 H new ATOM 0 HB2 ASP A 39 68.481 -15.552 17.063 1.00 0.00 H new ATOM 0 HB3 ASP A 39 70.199 -15.318 16.807 1.00 0.00 H new ATOM 635 N GLU A 40 71.404 -12.858 18.691 1.00 0.00 N ATOM 636 CA GLU A 40 72.704 -12.486 19.227 1.00 0.00 C ATOM 637 C GLU A 40 72.539 -11.895 20.616 1.00 0.00 C ATOM 638 O GLU A 40 73.482 -11.861 21.408 1.00 0.00 O ATOM 639 CB GLU A 40 73.334 -11.419 18.329 1.00 0.00 C ATOM 640 CG GLU A 40 73.936 -12.068 17.083 1.00 0.00 C ATOM 641 CD GLU A 40 75.149 -12.911 17.464 1.00 0.00 C ATOM 642 OE1 GLU A 40 74.992 -14.113 17.596 1.00 0.00 O ATOM 643 OE2 GLU A 40 76.216 -12.341 17.619 1.00 0.00 O ATOM 0 H GLU A 40 71.050 -12.221 17.977 1.00 0.00 H new ATOM 0 HA GLU A 40 73.335 -13.374 19.270 1.00 0.00 H new ATOM 0 HB2 GLU A 40 72.581 -10.686 18.039 1.00 0.00 H new ATOM 0 HB3 GLU A 40 74.107 -10.881 18.878 1.00 0.00 H new ATOM 0 HG2 GLU A 40 73.189 -12.692 16.592 1.00 0.00 H new ATOM 0 HG3 GLU A 40 74.228 -11.299 16.368 1.00 0.00 H new ATOM 650 N GLY A 41 71.336 -11.411 20.893 1.00 0.00 N ATOM 651 CA GLY A 41 71.045 -10.796 22.175 1.00 0.00 C ATOM 652 C GLY A 41 70.648 -9.342 21.975 1.00 0.00 C ATOM 653 O GLY A 41 70.332 -8.640 22.936 1.00 0.00 O ATOM 0 H GLY A 41 70.548 -11.434 20.246 1.00 0.00 H new ATOM 0 HA2 GLY A 41 70.240 -11.336 22.673 1.00 0.00 H new ATOM 0 HA3 GLY A 41 71.919 -10.857 22.824 1.00 0.00 H new ATOM 657 N THR A 42 70.645 -8.893 20.717 1.00 0.00 N ATOM 658 CA THR A 42 70.253 -7.508 20.435 1.00 0.00 C ATOM 659 C THR A 42 68.737 -7.427 20.383 1.00 0.00 C ATOM 660 O THR A 42 68.099 -8.210 19.688 1.00 0.00 O ATOM 661 CB THR A 42 70.856 -6.997 19.111 1.00 0.00 C ATOM 662 OG1 THR A 42 72.119 -6.403 19.373 1.00 0.00 O ATOM 663 CG2 THR A 42 69.926 -5.950 18.478 1.00 0.00 C ATOM 0 H THR A 42 70.901 -9.447 19.900 1.00 0.00 H new ATOM 0 HA THR A 42 70.639 -6.872 21.231 1.00 0.00 H new ATOM 0 HB THR A 42 70.972 -7.834 18.423 1.00 0.00 H new ATOM 0 HG1 THR A 42 72.508 -6.078 18.534 1.00 0.00 H new ATOM 0 HG21 THR A 42 70.360 -5.595 17.543 1.00 0.00 H new ATOM 0 HG22 THR A 42 68.954 -6.400 18.278 1.00 0.00 H new ATOM 0 HG23 THR A 42 69.803 -5.111 19.163 1.00 0.00 H new ATOM 671 N GLU A 43 68.167 -6.486 21.128 1.00 0.00 N ATOM 672 CA GLU A 43 66.715 -6.328 21.162 1.00 0.00 C ATOM 673 C GLU A 43 66.306 -4.962 20.639 1.00 0.00 C ATOM 674 O GLU A 43 66.867 -3.942 21.041 1.00 0.00 O ATOM 675 CB GLU A 43 66.203 -6.509 22.594 1.00 0.00 C ATOM 676 CG GLU A 43 67.193 -5.879 23.578 1.00 0.00 C ATOM 677 CD GLU A 43 68.359 -6.829 23.827 1.00 0.00 C ATOM 678 OE1 GLU A 43 69.467 -6.491 23.442 1.00 0.00 O ATOM 679 OE2 GLU A 43 68.128 -7.882 24.398 1.00 0.00 O ATOM 0 H GLU A 43 68.681 -5.826 21.712 1.00 0.00 H new ATOM 0 HA GLU A 43 66.273 -7.090 20.520 1.00 0.00 H new ATOM 0 HB2 GLU A 43 65.223 -6.045 22.702 1.00 0.00 H new ATOM 0 HB3 GLU A 43 66.080 -7.569 22.815 1.00 0.00 H new ATOM 0 HG2 GLU A 43 67.562 -4.934 23.180 1.00 0.00 H new ATOM 0 HG3 GLU A 43 66.690 -5.654 24.518 1.00 0.00 H new ATOM 686 N ALA A 44 65.334 -4.943 19.725 1.00 0.00 N ATOM 687 CA ALA A 44 64.885 -3.687 19.153 1.00 0.00 C ATOM 688 C ALA A 44 63.367 -3.601 19.053 1.00 0.00 C ATOM 689 O ALA A 44 62.728 -4.411 18.385 1.00 0.00 O ATOM 690 CB ALA A 44 65.478 -3.526 17.756 1.00 0.00 C ATOM 0 H ALA A 44 64.854 -5.772 19.374 1.00 0.00 H new ATOM 0 HA ALA A 44 65.222 -2.891 19.817 1.00 0.00 H new ATOM 0 HB1 ALA A 44 65.142 -2.583 17.325 1.00 0.00 H new ATOM 0 HB2 ALA A 44 66.566 -3.528 17.820 1.00 0.00 H new ATOM 0 HB3 ALA A 44 65.150 -4.351 17.124 1.00 0.00 H new ATOM 696 N GLU A 45 62.808 -2.581 19.687 1.00 0.00 N ATOM 697 CA GLU A 45 61.377 -2.349 19.635 1.00 0.00 C ATOM 698 C GLU A 45 61.040 -1.583 18.357 1.00 0.00 C ATOM 699 O GLU A 45 61.493 -0.455 18.164 1.00 0.00 O ATOM 700 CB GLU A 45 60.934 -1.537 20.853 1.00 0.00 C ATOM 701 CG GLU A 45 60.836 -2.454 22.073 1.00 0.00 C ATOM 702 CD GLU A 45 60.454 -1.641 23.305 1.00 0.00 C ATOM 703 OE1 GLU A 45 59.343 -1.808 23.780 1.00 0.00 O ATOM 704 OE2 GLU A 45 61.278 -0.862 23.755 1.00 0.00 O ATOM 0 H GLU A 45 63.327 -1.901 20.243 1.00 0.00 H new ATOM 0 HA GLU A 45 60.855 -3.306 19.640 1.00 0.00 H new ATOM 0 HB2 GLU A 45 61.645 -0.734 21.045 1.00 0.00 H new ATOM 0 HB3 GLU A 45 59.969 -1.069 20.659 1.00 0.00 H new ATOM 0 HG2 GLU A 45 60.093 -3.232 21.895 1.00 0.00 H new ATOM 0 HG3 GLU A 45 61.789 -2.956 22.239 1.00 0.00 H new ATOM 711 N ALA A 46 60.267 -2.215 17.482 1.00 0.00 N ATOM 712 CA ALA A 46 59.881 -1.612 16.205 1.00 0.00 C ATOM 713 C ALA A 46 59.434 -0.152 16.336 1.00 0.00 C ATOM 714 O ALA A 46 58.978 0.441 15.359 1.00 0.00 O ATOM 715 CB ALA A 46 58.734 -2.407 15.601 1.00 0.00 C ATOM 0 H ALA A 46 59.891 -3.151 17.632 1.00 0.00 H new ATOM 0 HA ALA A 46 60.767 -1.632 15.570 1.00 0.00 H new ATOM 0 HB1 ALA A 46 58.443 -1.961 14.650 1.00 0.00 H new ATOM 0 HB2 ALA A 46 59.052 -3.437 15.437 1.00 0.00 H new ATOM 0 HB3 ALA A 46 57.884 -2.394 16.283 1.00 0.00 H new ATOM 721 N ASN A 47 59.550 0.430 17.524 1.00 0.00 N ATOM 722 CA ASN A 47 59.140 1.820 17.720 1.00 0.00 C ATOM 723 C ASN A 47 60.354 2.704 18.006 1.00 0.00 C ATOM 724 O ASN A 47 60.219 3.909 18.219 1.00 0.00 O ATOM 725 CB ASN A 47 58.121 1.901 18.865 1.00 0.00 C ATOM 726 CG ASN A 47 58.139 3.285 19.512 1.00 0.00 C ATOM 727 OD1 ASN A 47 58.956 3.547 20.395 1.00 0.00 O ATOM 728 ND2 ASN A 47 57.282 4.189 19.124 1.00 0.00 N ATOM 0 H ASN A 47 59.919 -0.029 18.357 1.00 0.00 H new ATOM 0 HA ASN A 47 58.671 2.185 16.807 1.00 0.00 H new ATOM 0 HB2 ASN A 47 57.122 1.686 18.485 1.00 0.00 H new ATOM 0 HB3 ASN A 47 58.348 1.142 19.614 1.00 0.00 H new ATOM 0 HD21 ASN A 47 57.288 5.115 19.552 1.00 0.00 H new ATOM 0 HD22 ASN A 47 56.606 3.970 18.392 1.00 0.00 H new ATOM 735 N SER A 48 61.542 2.103 17.993 1.00 0.00 N ATOM 736 CA SER A 48 62.770 2.849 18.238 1.00 0.00 C ATOM 737 C SER A 48 63.770 2.605 17.110 1.00 0.00 C ATOM 738 O SER A 48 64.007 1.464 16.716 1.00 0.00 O ATOM 739 CB SER A 48 63.379 2.415 19.571 1.00 0.00 C ATOM 740 OG SER A 48 62.897 3.263 20.606 1.00 0.00 O ATOM 0 H SER A 48 61.678 1.108 17.816 1.00 0.00 H new ATOM 0 HA SER A 48 62.535 3.913 18.277 1.00 0.00 H new ATOM 0 HB2 SER A 48 63.117 1.378 19.783 1.00 0.00 H new ATOM 0 HB3 SER A 48 64.467 2.465 19.521 1.00 0.00 H new ATOM 0 HG SER A 48 63.284 2.986 21.463 1.00 0.00 H new ATOM 746 N VAL A 49 64.355 3.682 16.594 1.00 0.00 N ATOM 747 CA VAL A 49 65.330 3.559 15.517 1.00 0.00 C ATOM 748 C VAL A 49 66.668 3.115 16.081 1.00 0.00 C ATOM 749 O VAL A 49 67.395 2.347 15.452 1.00 0.00 O ATOM 750 CB VAL A 49 65.484 4.890 14.790 1.00 0.00 C ATOM 751 CG1 VAL A 49 66.199 4.666 13.456 1.00 0.00 C ATOM 752 CG2 VAL A 49 64.097 5.481 14.533 1.00 0.00 C ATOM 0 H VAL A 49 64.174 4.638 16.900 1.00 0.00 H new ATOM 0 HA VAL A 49 64.978 2.812 14.806 1.00 0.00 H new ATOM 0 HB VAL A 49 66.070 5.577 15.401 1.00 0.00 H new ATOM 0 HG11 VAL A 49 66.308 5.618 12.937 1.00 0.00 H new ATOM 0 HG12 VAL A 49 67.184 4.237 13.639 1.00 0.00 H new ATOM 0 HG13 VAL A 49 65.614 3.983 12.840 1.00 0.00 H new ATOM 0 HG21 VAL A 49 64.198 6.434 14.013 1.00 0.00 H new ATOM 0 HG22 VAL A 49 63.516 4.792 13.919 1.00 0.00 H new ATOM 0 HG23 VAL A 49 63.587 5.639 15.483 1.00 0.00 H new ATOM 762 N ILE A 50 66.968 3.569 17.293 1.00 0.00 N ATOM 763 CA ILE A 50 68.183 3.184 17.956 1.00 0.00 C ATOM 764 C ILE A 50 68.214 1.671 17.983 1.00 0.00 C ATOM 765 O ILE A 50 69.257 1.033 17.838 1.00 0.00 O ATOM 766 CB ILE A 50 68.129 3.775 19.367 1.00 0.00 C ATOM 767 CG1 ILE A 50 69.382 4.608 19.639 1.00 0.00 C ATOM 768 CG2 ILE A 50 67.985 2.679 20.414 1.00 0.00 C ATOM 769 CD1 ILE A 50 70.642 3.757 19.435 1.00 0.00 C ATOM 0 H ILE A 50 66.377 4.205 17.828 1.00 0.00 H new ATOM 0 HA ILE A 50 69.082 3.545 17.456 1.00 0.00 H new ATOM 0 HB ILE A 50 67.254 4.421 19.432 1.00 0.00 H new ATOM 0 HG12 ILE A 50 69.405 5.470 18.973 1.00 0.00 H new ATOM 0 HG13 ILE A 50 69.356 4.994 20.658 1.00 0.00 H new ATOM 0 HG21 ILE A 50 67.949 3.127 21.407 1.00 0.00 H new ATOM 0 HG22 ILE A 50 67.065 2.122 20.234 1.00 0.00 H new ATOM 0 HG23 ILE A 50 68.837 2.002 20.352 1.00 0.00 H new ATOM 0 HD11 ILE A 50 71.526 4.363 19.632 1.00 0.00 H new ATOM 0 HD12 ILE A 50 70.623 2.909 20.120 1.00 0.00 H new ATOM 0 HD13 ILE A 50 70.673 3.393 18.408 1.00 0.00 H new ATOM 781 N ALA A 51 67.021 1.126 18.145 1.00 0.00 N ATOM 782 CA ALA A 51 66.813 -0.296 18.169 1.00 0.00 C ATOM 783 C ALA A 51 67.252 -0.891 16.836 1.00 0.00 C ATOM 784 O ALA A 51 68.113 -1.768 16.787 1.00 0.00 O ATOM 785 CB ALA A 51 65.322 -0.550 18.418 1.00 0.00 C ATOM 0 H ALA A 51 66.167 1.670 18.264 1.00 0.00 H new ATOM 0 HA ALA A 51 67.399 -0.766 18.959 1.00 0.00 H new ATOM 0 HB1 ALA A 51 65.135 -1.624 18.441 1.00 0.00 H new ATOM 0 HB2 ALA A 51 65.032 -0.110 19.372 1.00 0.00 H new ATOM 0 HB3 ALA A 51 64.737 -0.097 17.618 1.00 0.00 H new ATOM 791 N LEU A 52 66.661 -0.392 15.758 1.00 0.00 N ATOM 792 CA LEU A 52 67.001 -0.861 14.431 1.00 0.00 C ATOM 793 C LEU A 52 68.492 -0.662 14.180 1.00 0.00 C ATOM 794 O LEU A 52 69.150 -1.505 13.573 1.00 0.00 O ATOM 795 CB LEU A 52 66.185 -0.090 13.391 1.00 0.00 C ATOM 796 CG LEU A 52 64.681 -0.235 13.682 1.00 0.00 C ATOM 797 CD1 LEU A 52 63.895 0.797 12.861 1.00 0.00 C ATOM 798 CD2 LEU A 52 64.200 -1.649 13.315 1.00 0.00 C ATOM 0 H LEU A 52 65.946 0.335 15.781 1.00 0.00 H new ATOM 0 HA LEU A 52 66.769 -1.923 14.351 1.00 0.00 H new ATOM 0 HB2 LEU A 52 66.466 0.963 13.406 1.00 0.00 H new ATOM 0 HB3 LEU A 52 66.407 -0.465 12.392 1.00 0.00 H new ATOM 0 HG LEU A 52 64.512 -0.066 14.746 1.00 0.00 H new ATOM 0 HD11 LEU A 52 62.830 0.692 13.069 1.00 0.00 H new ATOM 0 HD12 LEU A 52 64.221 1.801 13.132 1.00 0.00 H new ATOM 0 HD13 LEU A 52 64.076 0.631 11.799 1.00 0.00 H new ATOM 0 HD21 LEU A 52 63.134 -1.737 13.526 1.00 0.00 H new ATOM 0 HD22 LEU A 52 64.376 -1.829 12.255 1.00 0.00 H new ATOM 0 HD23 LEU A 52 64.748 -2.384 13.904 1.00 0.00 H new ATOM 810 N LEU A 53 69.023 0.452 14.662 1.00 0.00 N ATOM 811 CA LEU A 53 70.441 0.737 14.491 1.00 0.00 C ATOM 812 C LEU A 53 71.278 -0.356 15.156 1.00 0.00 C ATOM 813 O LEU A 53 72.343 -0.729 14.664 1.00 0.00 O ATOM 814 CB LEU A 53 70.768 2.096 15.122 1.00 0.00 C ATOM 815 CG LEU A 53 71.889 2.799 14.340 1.00 0.00 C ATOM 816 CD1 LEU A 53 73.107 1.875 14.237 1.00 0.00 C ATOM 817 CD2 LEU A 53 71.398 3.168 12.929 1.00 0.00 C ATOM 0 H LEU A 53 68.501 1.167 15.169 1.00 0.00 H new ATOM 0 HA LEU A 53 70.676 0.764 13.427 1.00 0.00 H new ATOM 0 HB2 LEU A 53 69.876 2.722 15.132 1.00 0.00 H new ATOM 0 HB3 LEU A 53 71.072 1.958 16.159 1.00 0.00 H new ATOM 0 HG LEU A 53 72.170 3.710 14.868 1.00 0.00 H new ATOM 0 HD11 LEU A 53 73.899 2.378 13.682 1.00 0.00 H new ATOM 0 HD12 LEU A 53 73.464 1.631 15.237 1.00 0.00 H new ATOM 0 HD13 LEU A 53 72.826 0.959 13.718 1.00 0.00 H new ATOM 0 HD21 LEU A 53 72.200 3.666 12.383 1.00 0.00 H new ATOM 0 HD22 LEU A 53 71.105 2.263 12.397 1.00 0.00 H new ATOM 0 HD23 LEU A 53 70.541 3.838 13.005 1.00 0.00 H new ATOM 829 N MET A 54 70.786 -0.854 16.286 1.00 0.00 N ATOM 830 CA MET A 54 71.492 -1.895 17.031 1.00 0.00 C ATOM 831 C MET A 54 71.624 -3.182 16.216 1.00 0.00 C ATOM 832 O MET A 54 72.731 -3.671 15.994 1.00 0.00 O ATOM 833 CB MET A 54 70.742 -2.195 18.331 1.00 0.00 C ATOM 834 CG MET A 54 71.659 -2.959 19.288 1.00 0.00 C ATOM 835 SD MET A 54 72.839 -1.810 20.038 1.00 0.00 S ATOM 836 CE MET A 54 73.517 -2.952 21.267 1.00 0.00 C ATOM 0 H MET A 54 69.905 -0.556 16.706 1.00 0.00 H new ATOM 0 HA MET A 54 72.494 -1.527 17.249 1.00 0.00 H new ATOM 0 HB2 MET A 54 70.410 -1.266 18.794 1.00 0.00 H new ATOM 0 HB3 MET A 54 69.849 -2.783 18.120 1.00 0.00 H new ATOM 0 HG2 MET A 54 71.068 -3.447 20.063 1.00 0.00 H new ATOM 0 HG3 MET A 54 72.191 -3.744 18.750 1.00 0.00 H new ATOM 0 HE1 MET A 54 74.280 -2.442 21.855 1.00 0.00 H new ATOM 0 HE2 MET A 54 72.719 -3.293 21.926 1.00 0.00 H new ATOM 0 HE3 MET A 54 73.961 -3.809 20.761 1.00 0.00 H new ATOM 846 N LEU A 55 70.493 -3.731 15.781 1.00 0.00 N ATOM 847 CA LEU A 55 70.513 -4.969 15.000 1.00 0.00 C ATOM 848 C LEU A 55 71.186 -4.751 13.653 1.00 0.00 C ATOM 849 O LEU A 55 71.467 -5.702 12.927 1.00 0.00 O ATOM 850 CB LEU A 55 69.099 -5.541 14.810 1.00 0.00 C ATOM 851 CG LEU A 55 68.097 -4.439 14.407 1.00 0.00 C ATOM 852 CD1 LEU A 55 68.110 -4.234 12.882 1.00 0.00 C ATOM 853 CD2 LEU A 55 66.680 -4.846 14.855 1.00 0.00 C ATOM 0 H LEU A 55 69.563 -3.347 15.951 1.00 0.00 H new ATOM 0 HA LEU A 55 71.095 -5.699 15.563 1.00 0.00 H new ATOM 0 HB2 LEU A 55 69.118 -6.316 14.044 1.00 0.00 H new ATOM 0 HB3 LEU A 55 68.769 -6.015 15.734 1.00 0.00 H new ATOM 0 HG LEU A 55 68.386 -3.506 14.892 1.00 0.00 H new ATOM 0 HD11 LEU A 55 67.398 -3.454 12.614 1.00 0.00 H new ATOM 0 HD12 LEU A 55 69.110 -3.939 12.563 1.00 0.00 H new ATOM 0 HD13 LEU A 55 67.832 -5.165 12.387 1.00 0.00 H new ATOM 0 HD21 LEU A 55 65.971 -4.068 14.571 1.00 0.00 H new ATOM 0 HD22 LEU A 55 66.402 -5.784 14.374 1.00 0.00 H new ATOM 0 HD23 LEU A 55 66.663 -4.974 15.937 1.00 0.00 H new ATOM 865 N ASP A 56 71.454 -3.494 13.334 1.00 0.00 N ATOM 866 CA ASP A 56 72.113 -3.158 12.085 1.00 0.00 C ATOM 867 C ASP A 56 73.356 -4.011 11.945 1.00 0.00 C ATOM 868 O ASP A 56 73.702 -4.461 10.852 1.00 0.00 O ATOM 869 CB ASP A 56 72.490 -1.675 12.065 1.00 0.00 C ATOM 870 CG ASP A 56 72.814 -1.239 10.641 1.00 0.00 C ATOM 871 OD1 ASP A 56 72.978 -2.106 9.799 1.00 0.00 O ATOM 872 OD2 ASP A 56 72.893 -0.043 10.412 1.00 0.00 O ATOM 0 H ASP A 56 71.225 -2.693 13.922 1.00 0.00 H new ATOM 0 HA ASP A 56 71.436 -3.350 11.252 1.00 0.00 H new ATOM 0 HB2 ASP A 56 71.668 -1.077 12.459 1.00 0.00 H new ATOM 0 HB3 ASP A 56 73.350 -1.501 12.712 1.00 0.00 H new ATOM 877 N SER A 57 74.008 -4.253 13.075 1.00 0.00 N ATOM 878 CA SER A 57 75.195 -5.083 13.087 1.00 0.00 C ATOM 879 C SER A 57 74.826 -6.470 12.592 1.00 0.00 C ATOM 880 O SER A 57 75.697 -7.300 12.337 1.00 0.00 O ATOM 881 CB SER A 57 75.765 -5.170 14.503 1.00 0.00 C ATOM 882 OG SER A 57 77.027 -5.822 14.462 1.00 0.00 O ATOM 0 H SER A 57 73.734 -3.887 13.987 1.00 0.00 H new ATOM 0 HA SER A 57 75.953 -4.646 12.437 1.00 0.00 H new ATOM 0 HB2 SER A 57 75.872 -4.171 14.926 1.00 0.00 H new ATOM 0 HB3 SER A 57 75.080 -5.718 15.150 1.00 0.00 H new ATOM 0 HG SER A 57 77.016 -6.513 13.767 1.00 0.00 H new ATOM 888 N ALA A 58 73.516 -6.706 12.455 1.00 0.00 N ATOM 889 CA ALA A 58 73.020 -8.003 11.976 1.00 0.00 C ATOM 890 C ALA A 58 73.993 -8.607 10.964 1.00 0.00 C ATOM 891 O ALA A 58 75.010 -9.193 11.335 1.00 0.00 O ATOM 892 CB ALA A 58 71.643 -7.827 11.326 1.00 0.00 C ATOM 0 H ALA A 58 72.787 -6.025 12.666 1.00 0.00 H new ATOM 0 HA ALA A 58 72.935 -8.678 12.828 1.00 0.00 H new ATOM 0 HB1 ALA A 58 71.281 -8.793 10.973 1.00 0.00 H new ATOM 0 HB2 ALA A 58 70.944 -7.423 12.058 1.00 0.00 H new ATOM 0 HB3 ALA A 58 71.723 -7.140 10.484 1.00 0.00 H new ATOM 898 N LYS A 59 73.683 -8.444 9.686 1.00 0.00 N ATOM 899 CA LYS A 59 74.543 -8.956 8.626 1.00 0.00 C ATOM 900 C LYS A 59 74.773 -10.462 8.752 1.00 0.00 C ATOM 901 O LYS A 59 75.876 -10.901 9.075 1.00 0.00 O ATOM 902 CB LYS A 59 75.890 -8.235 8.667 1.00 0.00 C ATOM 903 CG LYS A 59 76.669 -8.537 7.387 1.00 0.00 C ATOM 904 CD LYS A 59 77.913 -7.651 7.324 1.00 0.00 C ATOM 905 CE LYS A 59 78.852 -8.167 6.233 1.00 0.00 C ATOM 906 NZ LYS A 59 80.125 -7.393 6.266 1.00 0.00 N ATOM 0 H LYS A 59 72.846 -7.963 9.357 1.00 0.00 H new ATOM 0 HA LYS A 59 74.041 -8.772 7.676 1.00 0.00 H new ATOM 0 HB2 LYS A 59 75.736 -7.161 8.767 1.00 0.00 H new ATOM 0 HB3 LYS A 59 76.461 -8.558 9.538 1.00 0.00 H new ATOM 0 HG2 LYS A 59 76.957 -9.588 7.364 1.00 0.00 H new ATOM 0 HG3 LYS A 59 76.039 -8.360 6.515 1.00 0.00 H new ATOM 0 HD2 LYS A 59 77.628 -6.620 7.115 1.00 0.00 H new ATOM 0 HD3 LYS A 59 78.422 -7.652 8.288 1.00 0.00 H new ATOM 0 HE2 LYS A 59 79.055 -9.227 6.384 1.00 0.00 H new ATOM 0 HE3 LYS A 59 78.380 -8.069 5.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 80.764 -7.744 5.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 79.923 -6.386 6.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 80.577 -7.508 7.195 1.00 0.00 H new ATOM 920 N GLY A 60 73.737 -11.251 8.472 1.00 0.00 N ATOM 921 CA GLY A 60 73.860 -12.708 8.536 1.00 0.00 C ATOM 922 C GLY A 60 73.241 -13.274 9.808 1.00 0.00 C ATOM 923 O GLY A 60 72.676 -14.368 9.798 1.00 0.00 O ATOM 0 H GLY A 60 72.814 -10.912 8.202 1.00 0.00 H new ATOM 0 HA2 GLY A 60 73.374 -13.152 7.667 1.00 0.00 H new ATOM 0 HA3 GLY A 60 74.913 -12.986 8.490 1.00 0.00 H new ATOM 927 N ARG A 61 73.352 -12.529 10.899 1.00 0.00 N ATOM 928 CA ARG A 61 72.800 -12.966 12.171 1.00 0.00 C ATOM 929 C ARG A 61 71.353 -13.404 11.995 1.00 0.00 C ATOM 930 O ARG A 61 70.856 -13.496 10.876 1.00 0.00 O ATOM 931 CB ARG A 61 72.866 -11.811 13.170 1.00 0.00 C ATOM 932 CG ARG A 61 74.320 -11.356 13.319 1.00 0.00 C ATOM 933 CD ARG A 61 75.131 -12.402 14.098 1.00 0.00 C ATOM 934 NE ARG A 61 75.849 -13.274 13.177 1.00 0.00 N ATOM 935 CZ ARG A 61 76.863 -14.026 13.594 1.00 0.00 C ATOM 936 NH1 ARG A 61 77.488 -14.804 12.753 1.00 0.00 N ATOM 937 NH2 ARG A 61 77.235 -13.984 14.844 1.00 0.00 N ATOM 0 H ARG A 61 73.818 -11.622 10.928 1.00 0.00 H new ATOM 0 HA ARG A 61 73.380 -13.811 12.542 1.00 0.00 H new ATOM 0 HB2 ARG A 61 72.247 -10.982 12.827 1.00 0.00 H new ATOM 0 HB3 ARG A 61 72.471 -12.127 14.135 1.00 0.00 H new ATOM 0 HG2 ARG A 61 74.762 -11.203 12.335 1.00 0.00 H new ATOM 0 HG3 ARG A 61 74.357 -10.398 13.838 1.00 0.00 H new ATOM 0 HD2 ARG A 61 75.837 -11.904 14.763 1.00 0.00 H new ATOM 0 HD3 ARG A 61 74.465 -12.994 14.726 1.00 0.00 H new ATOM 0 HE ARG A 61 75.569 -13.308 12.197 1.00 0.00 H new ATOM 0 HH11 ARG A 61 77.199 -14.835 11.775 1.00 0.00 H new ATOM 0 HH12 ARG A 61 78.266 -15.381 13.073 1.00 0.00 H new ATOM 0 HH21 ARG A 61 76.748 -13.374 15.501 1.00 0.00 H new ATOM 0 HH22 ARG A 61 78.013 -14.561 15.164 1.00 0.00 H new ATOM 951 N GLN A 62 70.678 -13.662 13.107 1.00 0.00 N ATOM 952 CA GLN A 62 69.281 -14.070 13.067 1.00 0.00 C ATOM 953 C GLN A 62 68.461 -13.147 13.936 1.00 0.00 C ATOM 954 O GLN A 62 68.826 -12.868 15.076 1.00 0.00 O ATOM 955 CB GLN A 62 69.126 -15.508 13.565 1.00 0.00 C ATOM 956 CG GLN A 62 70.332 -16.317 13.106 1.00 0.00 C ATOM 957 CD GLN A 62 69.948 -17.782 12.920 1.00 0.00 C ATOM 958 OE1 GLN A 62 68.911 -18.260 13.553 1.00 0.00 O flip ATOM 959 NE2 GLN A 62 70.610 -18.509 12.180 1.00 0.00 N flip ATOM 0 H GLN A 62 71.074 -13.596 14.045 1.00 0.00 H new ATOM 0 HA GLN A 62 68.931 -14.016 12.036 1.00 0.00 H new ATOM 0 HB2 GLN A 62 69.051 -15.525 14.652 1.00 0.00 H new ATOM 0 HB3 GLN A 62 68.207 -15.946 13.175 1.00 0.00 H new ATOM 0 HG2 GLN A 62 70.714 -15.913 12.169 1.00 0.00 H new ATOM 0 HG3 GLN A 62 71.134 -16.235 13.839 1.00 0.00 H new ATOM 0 HE21 GLN A 62 71.420 -18.133 11.687 1.00 0.00 H new ATOM 0 HE22 GLN A 62 70.349 -19.488 12.060 1.00 0.00 H new ATOM 968 N ILE A 63 67.353 -12.676 13.395 1.00 0.00 N ATOM 969 CA ILE A 63 66.491 -11.785 14.131 1.00 0.00 C ATOM 970 C ILE A 63 65.282 -12.528 14.627 1.00 0.00 C ATOM 971 O ILE A 63 64.768 -13.419 13.961 1.00 0.00 O ATOM 972 CB ILE A 63 66.039 -10.640 13.242 1.00 0.00 C ATOM 973 CG1 ILE A 63 65.361 -9.568 14.096 1.00 0.00 C ATOM 974 CG2 ILE A 63 65.044 -11.162 12.202 1.00 0.00 C ATOM 975 CD1 ILE A 63 66.400 -8.564 14.588 1.00 0.00 C ATOM 0 H ILE A 63 67.034 -12.897 12.452 1.00 0.00 H new ATOM 0 HA ILE A 63 67.049 -11.388 14.979 1.00 0.00 H new ATOM 0 HB ILE A 63 66.904 -10.211 12.737 1.00 0.00 H new ATOM 0 HG12 ILE A 63 64.595 -9.056 13.513 1.00 0.00 H new ATOM 0 HG13 ILE A 63 64.859 -10.031 14.945 1.00 0.00 H new ATOM 0 HG21 ILE A 63 64.720 -10.340 11.564 1.00 0.00 H new ATOM 0 HG22 ILE A 63 65.523 -11.927 11.592 1.00 0.00 H new ATOM 0 HG23 ILE A 63 64.179 -11.591 12.709 1.00 0.00 H new ATOM 0 HD11 ILE A 63 65.911 -7.803 15.196 1.00 0.00 H new ATOM 0 HD12 ILE A 63 67.150 -9.080 15.187 1.00 0.00 H new ATOM 0 HD13 ILE A 63 66.882 -8.091 13.733 1.00 0.00 H new ATOM 987 N GLU A 64 64.825 -12.120 15.787 1.00 0.00 N ATOM 988 CA GLU A 64 63.650 -12.708 16.393 1.00 0.00 C ATOM 989 C GLU A 64 62.561 -11.662 16.405 1.00 0.00 C ATOM 990 O GLU A 64 62.614 -10.697 17.164 1.00 0.00 O ATOM 991 CB GLU A 64 63.974 -13.198 17.811 1.00 0.00 C ATOM 992 CG GLU A 64 63.483 -14.635 17.997 1.00 0.00 C ATOM 993 CD GLU A 64 61.959 -14.669 18.017 1.00 0.00 C ATOM 994 OE1 GLU A 64 61.411 -15.209 18.964 1.00 0.00 O ATOM 995 OE2 GLU A 64 61.362 -14.156 17.085 1.00 0.00 O ATOM 0 H GLU A 64 65.253 -11.375 16.337 1.00 0.00 H new ATOM 0 HA GLU A 64 63.314 -13.574 15.823 1.00 0.00 H new ATOM 0 HB2 GLU A 64 65.049 -13.148 17.985 1.00 0.00 H new ATOM 0 HB3 GLU A 64 63.502 -12.546 18.546 1.00 0.00 H new ATOM 0 HG2 GLU A 64 63.858 -15.263 17.189 1.00 0.00 H new ATOM 0 HG3 GLU A 64 63.876 -15.044 18.928 1.00 0.00 H new ATOM 1002 N VAL A 65 61.594 -11.829 15.524 1.00 0.00 N ATOM 1003 CA VAL A 65 60.529 -10.868 15.420 1.00 0.00 C ATOM 1004 C VAL A 65 59.396 -11.221 16.348 1.00 0.00 C ATOM 1005 O VAL A 65 59.065 -12.390 16.491 1.00 0.00 O ATOM 1006 CB VAL A 65 60.002 -10.880 13.988 1.00 0.00 C ATOM 1007 CG1 VAL A 65 59.203 -12.165 13.737 1.00 0.00 C ATOM 1008 CG2 VAL A 65 59.099 -9.668 13.779 1.00 0.00 C ATOM 0 H VAL A 65 61.529 -12.616 14.878 1.00 0.00 H new ATOM 0 HA VAL A 65 60.914 -9.885 15.690 1.00 0.00 H new ATOM 0 HB VAL A 65 60.840 -10.841 13.292 1.00 0.00 H new ATOM 0 HG11 VAL A 65 58.830 -12.167 12.713 1.00 0.00 H new ATOM 0 HG12 VAL A 65 59.848 -13.030 13.890 1.00 0.00 H new ATOM 0 HG13 VAL A 65 58.363 -12.212 14.430 1.00 0.00 H new ATOM 0 HG21 VAL A 65 58.718 -9.670 12.758 1.00 0.00 H new ATOM 0 HG22 VAL A 65 58.263 -9.712 14.478 1.00 0.00 H new ATOM 0 HG23 VAL A 65 59.669 -8.755 13.952 1.00 0.00 H new ATOM 1018 N GLU A 66 58.766 -10.217 16.941 1.00 0.00 N ATOM 1019 CA GLU A 66 57.614 -10.502 17.781 1.00 0.00 C ATOM 1020 C GLU A 66 56.565 -9.397 17.657 1.00 0.00 C ATOM 1021 O GLU A 66 56.792 -8.283 18.116 1.00 0.00 O ATOM 1022 CB GLU A 66 58.012 -10.652 19.247 1.00 0.00 C ATOM 1023 CG GLU A 66 56.742 -10.760 20.100 1.00 0.00 C ATOM 1024 CD GLU A 66 57.082 -11.317 21.478 1.00 0.00 C ATOM 1025 OE1 GLU A 66 56.170 -11.753 22.161 1.00 0.00 O ATOM 1026 OE2 GLU A 66 58.250 -11.300 21.831 1.00 0.00 O ATOM 0 H GLU A 66 59.021 -9.233 16.861 1.00 0.00 H new ATOM 0 HA GLU A 66 57.192 -11.445 17.434 1.00 0.00 H new ATOM 0 HB2 GLU A 66 58.632 -11.539 19.380 1.00 0.00 H new ATOM 0 HB3 GLU A 66 58.608 -9.796 19.565 1.00 0.00 H new ATOM 0 HG2 GLU A 66 56.277 -9.779 20.200 1.00 0.00 H new ATOM 0 HG3 GLU A 66 56.017 -11.407 19.606 1.00 0.00 H new ATOM 1033 N ALA A 67 55.406 -9.720 17.065 1.00 0.00 N ATOM 1034 CA ALA A 67 54.323 -8.752 16.908 1.00 0.00 C ATOM 1035 C ALA A 67 53.147 -9.144 17.786 1.00 0.00 C ATOM 1036 O ALA A 67 52.916 -10.327 18.031 1.00 0.00 O ATOM 1037 CB ALA A 67 53.911 -8.683 15.437 1.00 0.00 C ATOM 0 H ALA A 67 55.199 -10.645 16.689 1.00 0.00 H new ATOM 0 HA ALA A 67 54.664 -7.765 17.220 1.00 0.00 H new ATOM 0 HB1 ALA A 67 53.103 -7.961 15.319 1.00 0.00 H new ATOM 0 HB2 ALA A 67 54.765 -8.374 14.834 1.00 0.00 H new ATOM 0 HB3 ALA A 67 53.571 -9.665 15.108 1.00 0.00 H new ATOM 1043 N THR A 68 52.420 -8.149 18.294 1.00 0.00 N ATOM 1044 CA THR A 68 51.300 -8.435 19.169 1.00 0.00 C ATOM 1045 C THR A 68 50.222 -7.355 19.090 1.00 0.00 C ATOM 1046 O THR A 68 50.359 -6.280 19.674 1.00 0.00 O ATOM 1047 CB THR A 68 51.799 -8.522 20.607 1.00 0.00 C ATOM 1048 OG1 THR A 68 52.833 -9.490 20.695 1.00 0.00 O ATOM 1049 CG2 THR A 68 50.642 -8.913 21.517 1.00 0.00 C ATOM 0 H THR A 68 52.587 -7.159 18.115 1.00 0.00 H new ATOM 0 HA THR A 68 50.860 -9.379 18.848 1.00 0.00 H new ATOM 0 HB THR A 68 52.192 -7.554 20.918 1.00 0.00 H new ATOM 0 HG1 THR A 68 53.153 -9.543 21.620 1.00 0.00 H new ATOM 0 HG21 THR A 68 50.994 -8.976 22.547 1.00 0.00 H new ATOM 0 HG22 THR A 68 49.855 -8.162 21.448 1.00 0.00 H new ATOM 0 HG23 THR A 68 50.247 -9.881 21.208 1.00 0.00 H new ATOM 1057 N GLY A 69 49.144 -7.666 18.387 1.00 0.00 N ATOM 1058 CA GLY A 69 48.024 -6.742 18.250 1.00 0.00 C ATOM 1059 C GLY A 69 47.079 -7.194 17.141 1.00 0.00 C ATOM 1060 O GLY A 69 47.337 -8.168 16.444 1.00 0.00 O ATOM 0 H GLY A 69 49.019 -8.554 17.900 1.00 0.00 H new ATOM 0 HA2 GLY A 69 47.481 -6.680 19.193 1.00 0.00 H new ATOM 0 HA3 GLY A 69 48.397 -5.742 18.030 1.00 0.00 H new ATOM 1064 N PRO A 70 45.990 -6.510 16.969 1.00 0.00 N ATOM 1065 CA PRO A 70 44.984 -6.846 15.927 1.00 0.00 C ATOM 1066 C PRO A 70 45.598 -7.348 14.625 1.00 0.00 C ATOM 1067 O PRO A 70 45.169 -8.366 14.081 1.00 0.00 O ATOM 1068 CB PRO A 70 44.286 -5.513 15.715 1.00 0.00 C ATOM 1069 CG PRO A 70 44.275 -4.890 17.070 1.00 0.00 C ATOM 1070 CD PRO A 70 45.579 -5.330 17.749 1.00 0.00 C ATOM 0 HA PRO A 70 44.330 -7.662 16.236 1.00 0.00 H new ATOM 0 HB2 PRO A 70 44.820 -4.893 14.995 1.00 0.00 H new ATOM 0 HB3 PRO A 70 43.275 -5.649 15.330 1.00 0.00 H new ATOM 0 HG2 PRO A 70 44.219 -3.804 16.999 1.00 0.00 H new ATOM 0 HG3 PRO A 70 43.407 -5.217 17.643 1.00 0.00 H new ATOM 0 HD2 PRO A 70 46.334 -4.544 17.716 1.00 0.00 H new ATOM 0 HD3 PRO A 70 45.422 -5.577 18.799 1.00 0.00 H new ATOM 1078 N GLN A 71 46.572 -6.609 14.111 1.00 0.00 N ATOM 1079 CA GLN A 71 47.203 -6.980 12.836 1.00 0.00 C ATOM 1080 C GLN A 71 48.719 -7.192 12.960 1.00 0.00 C ATOM 1081 O GLN A 71 49.495 -6.698 12.143 1.00 0.00 O ATOM 1082 CB GLN A 71 46.902 -5.892 11.797 1.00 0.00 C ATOM 1083 CG GLN A 71 45.478 -6.088 11.247 1.00 0.00 C ATOM 1084 CD GLN A 71 44.818 -4.737 10.975 1.00 0.00 C ATOM 1085 OE1 GLN A 71 45.557 -3.669 10.865 1.00 0.00 O flip ATOM 1086 NE2 GLN A 71 43.595 -4.655 10.862 1.00 0.00 N flip ATOM 0 H GLN A 71 46.943 -5.762 14.542 1.00 0.00 H new ATOM 0 HA GLN A 71 46.783 -7.936 12.522 1.00 0.00 H new ATOM 0 HB2 GLN A 71 46.996 -4.905 12.250 1.00 0.00 H new ATOM 0 HB3 GLN A 71 47.627 -5.940 10.984 1.00 0.00 H new ATOM 0 HG2 GLN A 71 45.514 -6.673 10.328 1.00 0.00 H new ATOM 0 HG3 GLN A 71 44.881 -6.654 11.962 1.00 0.00 H new ATOM 0 HE21 GLN A 71 43.018 -5.491 10.948 1.00 0.00 H new ATOM 0 HE22 GLN A 71 43.159 -3.751 10.682 1.00 0.00 H new ATOM 1095 N GLU A 72 49.124 -7.949 13.973 1.00 0.00 N ATOM 1096 CA GLU A 72 50.539 -8.255 14.199 1.00 0.00 C ATOM 1097 C GLU A 72 51.070 -9.213 13.153 1.00 0.00 C ATOM 1098 O GLU A 72 52.233 -9.138 12.760 1.00 0.00 O ATOM 1099 CB GLU A 72 50.697 -8.902 15.584 1.00 0.00 C ATOM 1100 CG GLU A 72 49.442 -9.709 15.910 1.00 0.00 C ATOM 1101 CD GLU A 72 49.769 -10.852 16.862 1.00 0.00 C ATOM 1102 OE1 GLU A 72 50.927 -10.998 17.202 1.00 0.00 O ATOM 1103 OE2 GLU A 72 48.853 -11.566 17.236 1.00 0.00 O ATOM 0 H GLU A 72 48.492 -8.366 14.656 1.00 0.00 H new ATOM 0 HA GLU A 72 51.103 -7.325 14.137 1.00 0.00 H new ATOM 0 HB2 GLU A 72 51.574 -9.550 15.598 1.00 0.00 H new ATOM 0 HB3 GLU A 72 50.856 -8.134 16.341 1.00 0.00 H new ATOM 0 HG2 GLU A 72 48.692 -9.058 16.359 1.00 0.00 H new ATOM 0 HG3 GLU A 72 49.010 -10.106 14.991 1.00 0.00 H new ATOM 1110 N GLU A 73 50.222 -10.115 12.722 1.00 0.00 N ATOM 1111 CA GLU A 73 50.625 -11.095 11.736 1.00 0.00 C ATOM 1112 C GLU A 73 50.926 -10.418 10.415 1.00 0.00 C ATOM 1113 O GLU A 73 51.970 -10.653 9.821 1.00 0.00 O ATOM 1114 CB GLU A 73 49.522 -12.140 11.546 1.00 0.00 C ATOM 1115 CG GLU A 73 49.439 -13.034 12.792 1.00 0.00 C ATOM 1116 CD GLU A 73 49.635 -14.499 12.409 1.00 0.00 C ATOM 1117 OE1 GLU A 73 50.618 -14.792 11.750 1.00 0.00 O ATOM 1118 OE2 GLU A 73 48.798 -15.306 12.781 1.00 0.00 O ATOM 0 H GLU A 73 49.254 -10.193 13.034 1.00 0.00 H new ATOM 0 HA GLU A 73 51.527 -11.593 12.091 1.00 0.00 H new ATOM 0 HB2 GLU A 73 48.565 -11.647 11.376 1.00 0.00 H new ATOM 0 HB3 GLU A 73 49.729 -12.746 10.664 1.00 0.00 H new ATOM 0 HG2 GLU A 73 50.200 -12.735 13.513 1.00 0.00 H new ATOM 0 HG3 GLU A 73 48.471 -12.904 13.277 1.00 0.00 H new ATOM 1125 N GLU A 74 50.018 -9.562 9.967 1.00 0.00 N ATOM 1126 CA GLU A 74 50.224 -8.856 8.712 1.00 0.00 C ATOM 1127 C GLU A 74 51.486 -8.006 8.804 1.00 0.00 C ATOM 1128 O GLU A 74 52.347 -8.034 7.925 1.00 0.00 O ATOM 1129 CB GLU A 74 49.020 -7.970 8.405 1.00 0.00 C ATOM 1130 CG GLU A 74 49.208 -7.350 7.026 1.00 0.00 C ATOM 1131 CD GLU A 74 49.113 -8.425 5.949 1.00 0.00 C ATOM 1132 OE1 GLU A 74 48.134 -9.153 5.951 1.00 0.00 O ATOM 1133 OE2 GLU A 74 50.020 -8.504 5.137 1.00 0.00 O ATOM 0 H GLU A 74 49.145 -9.342 10.446 1.00 0.00 H new ATOM 0 HA GLU A 74 50.338 -9.583 7.908 1.00 0.00 H new ATOM 0 HB2 GLU A 74 48.102 -8.557 8.433 1.00 0.00 H new ATOM 0 HB3 GLU A 74 48.923 -7.190 9.160 1.00 0.00 H new ATOM 0 HG2 GLU A 74 48.449 -6.586 6.856 1.00 0.00 H new ATOM 0 HG3 GLU A 74 50.177 -6.854 6.971 1.00 0.00 H new ATOM 1140 N ALA A 75 51.577 -7.269 9.897 1.00 0.00 N ATOM 1141 CA ALA A 75 52.722 -6.407 10.168 1.00 0.00 C ATOM 1142 C ALA A 75 53.983 -7.238 10.145 1.00 0.00 C ATOM 1143 O ALA A 75 54.882 -7.001 9.347 1.00 0.00 O ATOM 1144 CB ALA A 75 52.550 -5.740 11.550 1.00 0.00 C ATOM 0 H ALA A 75 50.861 -7.249 10.624 1.00 0.00 H new ATOM 0 HA ALA A 75 52.789 -5.629 9.407 1.00 0.00 H new ATOM 0 HB1 ALA A 75 53.406 -5.096 11.752 1.00 0.00 H new ATOM 0 HB2 ALA A 75 51.638 -5.144 11.555 1.00 0.00 H new ATOM 0 HB3 ALA A 75 52.485 -6.509 12.320 1.00 0.00 H new ATOM 1150 N LEU A 76 54.008 -8.235 11.000 1.00 0.00 N ATOM 1151 CA LEU A 76 55.121 -9.153 11.082 1.00 0.00 C ATOM 1152 C LEU A 76 55.317 -9.832 9.734 1.00 0.00 C ATOM 1153 O LEU A 76 56.432 -9.960 9.234 1.00 0.00 O ATOM 1154 CB LEU A 76 54.766 -10.179 12.150 1.00 0.00 C ATOM 1155 CG LEU A 76 55.827 -11.278 12.243 1.00 0.00 C ATOM 1156 CD1 LEU A 76 56.038 -11.637 13.717 1.00 0.00 C ATOM 1157 CD2 LEU A 76 55.355 -12.523 11.481 1.00 0.00 C ATOM 0 H LEU A 76 53.255 -8.433 11.660 1.00 0.00 H new ATOM 0 HA LEU A 76 56.048 -8.639 11.338 1.00 0.00 H new ATOM 0 HB2 LEU A 76 54.669 -9.683 13.115 1.00 0.00 H new ATOM 0 HB3 LEU A 76 53.798 -10.624 11.921 1.00 0.00 H new ATOM 0 HG LEU A 76 56.760 -10.924 11.805 1.00 0.00 H new ATOM 0 HD11 LEU A 76 56.792 -12.420 13.796 1.00 0.00 H new ATOM 0 HD12 LEU A 76 56.372 -10.754 14.262 1.00 0.00 H new ATOM 0 HD13 LEU A 76 55.100 -11.993 14.143 1.00 0.00 H new ATOM 0 HD21 LEU A 76 56.114 -13.302 11.551 1.00 0.00 H new ATOM 0 HD22 LEU A 76 54.423 -12.885 11.916 1.00 0.00 H new ATOM 0 HD23 LEU A 76 55.191 -12.268 10.434 1.00 0.00 H new ATOM 1169 N ALA A 77 54.205 -10.251 9.156 1.00 0.00 N ATOM 1170 CA ALA A 77 54.207 -10.915 7.861 1.00 0.00 C ATOM 1171 C ALA A 77 54.691 -9.976 6.764 1.00 0.00 C ATOM 1172 O ALA A 77 55.130 -10.420 5.703 1.00 0.00 O ATOM 1173 CB ALA A 77 52.783 -11.351 7.537 1.00 0.00 C ATOM 0 H ALA A 77 53.278 -10.142 9.568 1.00 0.00 H new ATOM 0 HA ALA A 77 54.880 -11.771 7.908 1.00 0.00 H new ATOM 0 HB1 ALA A 77 52.767 -11.851 6.569 1.00 0.00 H new ATOM 0 HB2 ALA A 77 52.429 -12.038 8.306 1.00 0.00 H new ATOM 0 HB3 ALA A 77 52.133 -10.476 7.505 1.00 0.00 H new ATOM 1179 N ALA A 78 54.603 -8.680 7.023 1.00 0.00 N ATOM 1180 CA ALA A 78 55.030 -7.688 6.046 1.00 0.00 C ATOM 1181 C ALA A 78 56.531 -7.486 6.155 1.00 0.00 C ATOM 1182 O ALA A 78 57.223 -7.276 5.156 1.00 0.00 O ATOM 1183 CB ALA A 78 54.295 -6.363 6.279 1.00 0.00 C ATOM 0 H ALA A 78 54.243 -8.292 7.895 1.00 0.00 H new ATOM 0 HA ALA A 78 54.788 -8.042 5.044 1.00 0.00 H new ATOM 0 HB1 ALA A 78 54.623 -5.630 5.542 1.00 0.00 H new ATOM 0 HB2 ALA A 78 53.221 -6.520 6.180 1.00 0.00 H new ATOM 0 HB3 ALA A 78 54.517 -5.995 7.281 1.00 0.00 H new ATOM 1189 N VAL A 79 57.036 -7.590 7.377 1.00 0.00 N ATOM 1190 CA VAL A 79 58.456 -7.451 7.611 1.00 0.00 C ATOM 1191 C VAL A 79 59.135 -8.726 7.167 1.00 0.00 C ATOM 1192 O VAL A 79 60.126 -8.704 6.450 1.00 0.00 O ATOM 1193 CB VAL A 79 58.721 -7.220 9.106 1.00 0.00 C ATOM 1194 CG1 VAL A 79 57.414 -6.895 9.810 1.00 0.00 C ATOM 1195 CG2 VAL A 79 59.316 -8.483 9.726 1.00 0.00 C ATOM 0 H VAL A 79 56.482 -7.769 8.214 1.00 0.00 H new ATOM 0 HA VAL A 79 58.845 -6.599 7.052 1.00 0.00 H new ATOM 0 HB VAL A 79 59.419 -6.391 9.219 1.00 0.00 H new ATOM 0 HG11 VAL A 79 57.603 -6.731 10.871 1.00 0.00 H new ATOM 0 HG12 VAL A 79 56.981 -5.994 9.375 1.00 0.00 H new ATOM 0 HG13 VAL A 79 56.719 -7.726 9.689 1.00 0.00 H new ATOM 0 HG21 VAL A 79 59.502 -8.315 10.787 1.00 0.00 H new ATOM 0 HG22 VAL A 79 58.617 -9.311 9.607 1.00 0.00 H new ATOM 0 HG23 VAL A 79 60.254 -8.726 9.227 1.00 0.00 H new ATOM 1205 N ILE A 80 58.577 -9.839 7.616 1.00 0.00 N ATOM 1206 CA ILE A 80 59.105 -11.139 7.287 1.00 0.00 C ATOM 1207 C ILE A 80 59.308 -11.229 5.811 1.00 0.00 C ATOM 1208 O ILE A 80 60.429 -11.377 5.341 1.00 0.00 O ATOM 1209 CB ILE A 80 58.134 -12.186 7.796 1.00 0.00 C ATOM 1210 CG1 ILE A 80 58.236 -12.162 9.329 1.00 0.00 C ATOM 1211 CG2 ILE A 80 58.484 -13.569 7.223 1.00 0.00 C ATOM 1212 CD1 ILE A 80 58.622 -13.533 9.870 1.00 0.00 C ATOM 0 H ILE A 80 57.751 -9.860 8.214 1.00 0.00 H new ATOM 0 HA ILE A 80 60.073 -11.307 7.759 1.00 0.00 H new ATOM 0 HB ILE A 80 57.112 -11.975 7.480 1.00 0.00 H new ATOM 0 HG12 ILE A 80 58.976 -11.424 9.637 1.00 0.00 H new ATOM 0 HG13 ILE A 80 57.282 -11.854 9.756 1.00 0.00 H new ATOM 0 HG21 ILE A 80 57.777 -14.308 7.599 1.00 0.00 H new ATOM 0 HG22 ILE A 80 58.430 -13.536 6.135 1.00 0.00 H new ATOM 0 HG23 ILE A 80 59.493 -13.845 7.528 1.00 0.00 H new ATOM 0 HD11 ILE A 80 58.688 -13.490 10.957 1.00 0.00 H new ATOM 0 HD12 ILE A 80 57.867 -14.264 9.581 1.00 0.00 H new ATOM 0 HD13 ILE A 80 59.588 -13.827 9.460 1.00 0.00 H new ATOM 1224 N ALA A 81 58.240 -11.076 5.069 1.00 0.00 N ATOM 1225 CA ALA A 81 58.378 -11.088 3.637 1.00 0.00 C ATOM 1226 C ALA A 81 59.509 -10.151 3.283 1.00 0.00 C ATOM 1227 O ALA A 81 60.143 -10.284 2.237 1.00 0.00 O ATOM 1228 CB ALA A 81 57.103 -10.614 2.968 1.00 0.00 C ATOM 0 H ALA A 81 57.291 -10.945 5.421 1.00 0.00 H new ATOM 0 HA ALA A 81 58.581 -12.102 3.293 1.00 0.00 H new ATOM 0 HB1 ALA A 81 57.232 -10.632 1.886 1.00 0.00 H new ATOM 0 HB2 ALA A 81 56.280 -11.272 3.246 1.00 0.00 H new ATOM 0 HB3 ALA A 81 56.879 -9.597 3.290 1.00 0.00 H new ATOM 1234 N LEU A 82 59.783 -9.213 4.196 1.00 0.00 N ATOM 1235 CA LEU A 82 60.870 -8.288 3.984 1.00 0.00 C ATOM 1236 C LEU A 82 62.125 -8.858 4.617 1.00 0.00 C ATOM 1237 O LEU A 82 63.201 -8.842 4.019 1.00 0.00 O ATOM 1238 CB LEU A 82 60.530 -6.923 4.578 1.00 0.00 C ATOM 1239 CG LEU A 82 61.015 -5.831 3.627 1.00 0.00 C ATOM 1240 CD1 LEU A 82 62.521 -6.010 3.379 1.00 0.00 C ATOM 1241 CD2 LEU A 82 60.249 -5.931 2.295 1.00 0.00 C ATOM 0 H LEU A 82 59.271 -9.085 5.069 1.00 0.00 H new ATOM 0 HA LEU A 82 61.037 -8.150 2.916 1.00 0.00 H new ATOM 0 HB2 LEU A 82 59.454 -6.837 4.732 1.00 0.00 H new ATOM 0 HB3 LEU A 82 61.002 -6.809 5.554 1.00 0.00 H new ATOM 0 HG LEU A 82 60.835 -4.851 4.068 1.00 0.00 H new ATOM 0 HD11 LEU A 82 62.873 -5.233 2.700 1.00 0.00 H new ATOM 0 HD12 LEU A 82 63.057 -5.936 4.325 1.00 0.00 H new ATOM 0 HD13 LEU A 82 62.703 -6.989 2.935 1.00 0.00 H new ATOM 0 HD21 LEU A 82 60.596 -5.151 1.617 1.00 0.00 H new ATOM 0 HD22 LEU A 82 60.426 -6.908 1.846 1.00 0.00 H new ATOM 0 HD23 LEU A 82 59.182 -5.804 2.478 1.00 0.00 H new ATOM 1253 N PHE A 83 61.969 -9.394 5.822 1.00 0.00 N ATOM 1254 CA PHE A 83 63.086 -9.999 6.504 1.00 0.00 C ATOM 1255 C PHE A 83 63.534 -11.195 5.691 1.00 0.00 C ATOM 1256 O PHE A 83 64.723 -11.497 5.583 1.00 0.00 O ATOM 1257 CB PHE A 83 62.696 -10.437 7.907 1.00 0.00 C ATOM 1258 CG PHE A 83 62.660 -9.264 8.859 1.00 0.00 C ATOM 1259 CD1 PHE A 83 62.801 -9.503 10.230 1.00 0.00 C ATOM 1260 CD2 PHE A 83 62.484 -7.948 8.393 1.00 0.00 C ATOM 1261 CE1 PHE A 83 62.770 -8.443 11.132 1.00 0.00 C ATOM 1262 CE2 PHE A 83 62.454 -6.890 9.304 1.00 0.00 C ATOM 1263 CZ PHE A 83 62.599 -7.143 10.670 1.00 0.00 C ATOM 0 H PHE A 83 61.087 -9.418 6.335 1.00 0.00 H new ATOM 0 HA PHE A 83 63.895 -9.275 6.600 1.00 0.00 H new ATOM 0 HB2 PHE A 83 61.718 -10.917 7.881 1.00 0.00 H new ATOM 0 HB3 PHE A 83 63.407 -11.180 8.269 1.00 0.00 H new ATOM 0 HD1 PHE A 83 62.934 -10.513 10.590 1.00 0.00 H new ATOM 0 HD2 PHE A 83 62.373 -7.757 7.336 1.00 0.00 H new ATOM 0 HE1 PHE A 83 62.879 -8.631 12.190 1.00 0.00 H new ATOM 0 HE2 PHE A 83 62.319 -5.878 8.953 1.00 0.00 H new ATOM 0 HZ PHE A 83 62.578 -6.323 11.372 1.00 0.00 H new ATOM 1273 N ASN A 84 62.548 -11.843 5.089 1.00 0.00 N ATOM 1274 CA ASN A 84 62.785 -12.983 4.235 1.00 0.00 C ATOM 1275 C ASN A 84 63.161 -12.466 2.873 1.00 0.00 C ATOM 1276 O ASN A 84 63.665 -13.186 2.011 1.00 0.00 O ATOM 1277 CB ASN A 84 61.503 -13.809 4.142 1.00 0.00 C ATOM 1278 CG ASN A 84 61.804 -15.298 4.279 1.00 0.00 C ATOM 1279 OD1 ASN A 84 62.691 -15.819 3.603 1.00 0.00 O ATOM 1280 ND2 ASN A 84 61.113 -16.015 5.122 1.00 0.00 N ATOM 0 H ASN A 84 61.565 -11.589 5.182 1.00 0.00 H new ATOM 0 HA ASN A 84 63.583 -13.611 4.632 1.00 0.00 H new ATOM 0 HB2 ASN A 84 60.809 -13.501 4.924 1.00 0.00 H new ATOM 0 HB3 ASN A 84 61.012 -13.619 3.188 1.00 0.00 H new ATOM 0 HD21 ASN A 84 61.307 -17.011 5.223 1.00 0.00 H new ATOM 0 HD22 ASN A 84 60.379 -15.579 5.680 1.00 0.00 H new ATOM 1287 N SER A 85 62.890 -11.192 2.718 1.00 0.00 N ATOM 1288 CA SER A 85 63.171 -10.486 1.471 1.00 0.00 C ATOM 1289 C SER A 85 62.133 -10.840 0.410 1.00 0.00 C ATOM 1290 O SER A 85 61.289 -11.676 0.691 1.00 0.00 O ATOM 1291 CB SER A 85 64.568 -10.849 0.963 1.00 0.00 C ATOM 1292 OG SER A 85 65.451 -10.978 2.070 1.00 0.00 O ATOM 1293 OXT SER A 85 62.197 -10.271 -0.666 1.00 0.00 O ATOM 0 H SER A 85 62.471 -10.610 3.443 1.00 0.00 H new ATOM 0 HA SER A 85 63.126 -9.415 1.666 1.00 0.00 H new ATOM 0 HB2 SER A 85 64.532 -11.782 0.401 1.00 0.00 H new ATOM 0 HB3 SER A 85 64.931 -10.080 0.281 1.00 0.00 H new ATOM 0 HG SER A 85 66.347 -11.212 1.748 1.00 0.00 H new TER 1299 SER A 85