USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 967 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 71 MET CE :methyl -107:sc= -0.373 (180deg=-3.43!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -106:sc= 0.485 USER MOD Single : A 28 THR OG1 : rot -68:sc= 1.17 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0771 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 70:sc= 0.561 USER MOD Single : A 36 MET CE :methyl 179:sc= 0 (180deg=-0.00208) USER MOD Single : A 38 SER OG : rot -21:sc=0.000376 USER MOD Single : A 41 GLN : amide:sc= -0.547 K(o=-0.55,f=-1.2) USER MOD Single : A 42 ASN : amide:sc= 0.419 K(o=0.42,f=-3.8!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.0041) USER MOD Single : A 53 ASN : amide:sc= -0.0474 K(o=-0.047,f=-2!) USER MOD Single : A 60 ASN : amide:sc= -0.207 K(o=-0.21,f=-1.8) USER MOD Single : A 62 THR OG1 : rot -150:sc= 0 USER MOD Single : A 70 THR OG1 : rot 72:sc= 0.506 USER MOD Single : A 72 MET CE :methyl -155:sc= -0.143 (180deg=-0.193) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0.294 K(o=0.29,f=-2.8!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -59:sc= 1.2 USER MOD Single : A 107 HIS : no HD1:sc=-0.000766 X(o=-0.00077,f=0) USER MOD Single : A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot 101:sc= 1.22 USER MOD Single : A 111 ASN : amide:sc= -0.0717 K(o=-0.072,f=-2.1!) USER MOD Single : A 115 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0769) USER MOD Single : A 117 THR OG1 : rot 150:sc= 1.23 USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 GLN : amide:sc= 0.0364 X(o=0.036,f=-0.23) USER MOD Single : A 137 ASN : amide:sc= -0.507 K(o=-0.51,f=-5.3!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.991 K(o=-0.99,f=-0.019) USER MOD Single : A 144 MET CE :methyl -155:sc= -0.0858 (180deg=-1.13) USER MOD Single : A 145 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -12.393 16.341 1.329 1.00 0.00 N ATOM 59 CA THR A 5 -13.174 17.411 0.790 1.00 0.00 C ATOM 60 C THR A 5 -14.528 16.939 0.384 1.00 0.00 C ATOM 61 O THR A 5 -14.781 15.749 0.206 1.00 0.00 O ATOM 62 CB THR A 5 -12.570 18.107 -0.393 1.00 0.00 C ATOM 63 OG1 THR A 5 -12.243 17.273 -1.495 1.00 0.00 O ATOM 64 CG2 THR A 5 -11.278 18.802 0.068 1.00 0.00 C ATOM 0 HA THR A 5 -13.222 18.129 1.608 1.00 0.00 H new ATOM 0 HB THR A 5 -13.336 18.795 -0.752 1.00 0.00 H new ATOM 0 HG1 THR A 5 -11.858 17.817 -2.214 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.820 19.316 -0.777 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.513 19.525 0.849 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.584 18.058 0.459 1.00 0.00 H new ATOM 72 N GLU A 6 -15.531 17.804 0.147 1.00 0.00 N ATOM 73 CA GLU A 6 -16.859 17.414 -0.212 1.00 0.00 C ATOM 74 C GLU A 6 -16.977 16.958 -1.626 1.00 0.00 C ATOM 75 O GLU A 6 -17.923 16.276 -2.018 1.00 0.00 O ATOM 76 CB GLU A 6 -17.764 18.645 -0.030 1.00 0.00 C ATOM 77 CG GLU A 6 -19.260 18.327 0.012 1.00 0.00 C ATOM 78 CD GLU A 6 -19.958 19.661 0.235 1.00 0.00 C ATOM 79 OE1 GLU A 6 -19.804 20.616 -0.572 1.00 0.00 O ATOM 80 OE2 GLU A 6 -20.649 19.920 1.256 1.00 0.00 O ATOM 0 H GLU A 6 -15.412 18.815 0.208 1.00 0.00 H new ATOM 0 HA GLU A 6 -17.145 16.575 0.422 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -17.486 19.152 0.894 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -17.576 19.343 -0.846 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -19.588 17.864 -0.919 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -19.489 17.626 0.815 1.00 0.00 H new ATOM 87 N GLU A 7 -15.928 17.267 -2.409 1.00 0.00 N ATOM 88 CA GLU A 7 -15.753 16.903 -3.781 1.00 0.00 C ATOM 89 C GLU A 7 -15.344 15.479 -3.933 1.00 0.00 C ATOM 90 O GLU A 7 -15.861 14.702 -4.734 1.00 0.00 O ATOM 91 CB GLU A 7 -14.775 17.804 -4.553 1.00 0.00 C ATOM 92 CG GLU A 7 -14.940 19.302 -4.285 1.00 0.00 C ATOM 93 CD GLU A 7 -14.095 20.201 -5.176 1.00 0.00 C ATOM 94 OE1 GLU A 7 -14.576 20.504 -6.301 1.00 0.00 O ATOM 95 OE2 GLU A 7 -12.941 20.591 -4.853 1.00 0.00 O ATOM 0 H GLU A 7 -15.143 17.813 -2.054 1.00 0.00 H new ATOM 0 HA GLU A 7 -16.738 17.048 -4.225 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -13.756 17.513 -4.299 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -14.901 17.623 -5.621 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -15.989 19.568 -4.414 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -14.686 19.502 -3.244 1.00 0.00 H new ATOM 102 N GLN A 8 -14.298 15.073 -3.190 1.00 0.00 N ATOM 103 CA GLN A 8 -13.882 13.715 -3.026 1.00 0.00 C ATOM 104 C GLN A 8 -14.942 12.840 -2.450 1.00 0.00 C ATOM 105 O GLN A 8 -15.003 11.717 -2.948 1.00 0.00 O ATOM 106 CB GLN A 8 -12.744 13.636 -1.994 1.00 0.00 C ATOM 107 CG GLN A 8 -11.414 14.123 -2.573 1.00 0.00 C ATOM 108 CD GLN A 8 -10.360 13.912 -1.495 1.00 0.00 C ATOM 109 OE1 GLN A 8 -10.639 14.150 -0.321 1.00 0.00 O ATOM 110 NE2 GLN A 8 -9.189 13.303 -1.821 1.00 0.00 N ATOM 0 H GLN A 8 -13.711 15.730 -2.676 1.00 0.00 H new ATOM 0 HA GLN A 8 -13.603 13.385 -4.027 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -13.002 14.237 -1.122 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.636 12.607 -1.651 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -11.159 13.568 -3.476 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -11.476 15.175 -2.852 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -8.969 13.111 -2.798 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.531 13.038 -1.088 1.00 0.00 H new ATOM 119 N ILE A 9 -15.768 13.305 -1.496 1.00 0.00 N ATOM 120 CA ILE A 9 -16.824 12.561 -0.884 1.00 0.00 C ATOM 121 C ILE A 9 -17.880 12.328 -1.909 1.00 0.00 C ATOM 122 O ILE A 9 -18.472 11.252 -1.976 1.00 0.00 O ATOM 123 CB ILE A 9 -17.340 13.327 0.298 1.00 0.00 C ATOM 124 CG1 ILE A 9 -16.299 13.213 1.425 1.00 0.00 C ATOM 125 CG2 ILE A 9 -18.776 12.897 0.642 1.00 0.00 C ATOM 126 CD1 ILE A 9 -16.857 13.672 2.771 1.00 0.00 C ATOM 0 H ILE A 9 -15.694 14.255 -1.132 1.00 0.00 H new ATOM 0 HA ILE A 9 -16.477 11.594 -0.521 1.00 0.00 H new ATOM 0 HB ILE A 9 -17.447 14.392 0.091 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.964 12.179 1.505 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.424 13.812 1.172 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -19.130 13.465 1.502 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -19.427 13.087 -0.211 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -18.790 11.833 0.879 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -16.087 13.574 3.537 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -17.167 14.715 2.700 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -17.715 13.056 3.038 1.00 0.00 H new ATOM 138 N ALA A 10 -18.248 13.306 -2.755 1.00 0.00 N ATOM 139 CA ALA A 10 -18.988 13.160 -3.970 1.00 0.00 C ATOM 140 C ALA A 10 -18.460 12.207 -4.986 1.00 0.00 C ATOM 141 O ALA A 10 -19.210 11.470 -5.625 1.00 0.00 O ATOM 142 CB ALA A 10 -19.442 14.505 -4.562 1.00 0.00 C ATOM 0 H ALA A 10 -18.007 14.280 -2.572 1.00 0.00 H new ATOM 0 HA ALA A 10 -19.883 12.637 -3.633 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -19.998 14.328 -5.483 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -20.081 15.021 -3.845 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -18.569 15.121 -4.778 1.00 0.00 H new ATOM 148 N GLU A 11 -17.129 12.092 -5.139 1.00 0.00 N ATOM 149 CA GLU A 11 -16.474 11.225 -6.069 1.00 0.00 C ATOM 150 C GLU A 11 -16.626 9.827 -5.575 1.00 0.00 C ATOM 151 O GLU A 11 -16.964 8.885 -6.290 1.00 0.00 O ATOM 152 CB GLU A 11 -14.989 11.589 -6.236 1.00 0.00 C ATOM 153 CG GLU A 11 -14.356 10.781 -7.371 1.00 0.00 C ATOM 154 CD GLU A 11 -12.852 10.928 -7.549 1.00 0.00 C ATOM 155 OE1 GLU A 11 -12.405 12.095 -7.714 1.00 0.00 O ATOM 156 OE2 GLU A 11 -12.160 9.876 -7.541 1.00 0.00 O ATOM 0 H GLU A 11 -16.472 12.636 -4.580 1.00 0.00 H new ATOM 0 HA GLU A 11 -16.931 11.332 -7.053 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -14.892 12.655 -6.444 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.456 11.396 -5.305 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -14.579 9.727 -7.206 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -14.840 11.067 -8.305 1.00 0.00 H new ATOM 163 N PHE A 12 -16.440 9.615 -4.260 1.00 0.00 N ATOM 164 CA PHE A 12 -16.593 8.431 -3.474 1.00 0.00 C ATOM 165 C PHE A 12 -18.016 7.992 -3.515 1.00 0.00 C ATOM 166 O PHE A 12 -18.191 6.792 -3.722 1.00 0.00 O ATOM 167 CB PHE A 12 -16.172 8.567 -2.001 1.00 0.00 C ATOM 168 CG PHE A 12 -14.740 8.972 -1.927 1.00 0.00 C ATOM 169 CD1 PHE A 12 -13.759 8.672 -2.842 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.299 9.701 -0.848 1.00 0.00 C ATOM 171 CE1 PHE A 12 -12.538 9.302 -2.899 1.00 0.00 C ATOM 172 CE2 PHE A 12 -13.009 10.159 -0.720 1.00 0.00 C ATOM 173 CZ PHE A 12 -12.186 10.077 -1.819 1.00 0.00 C ATOM 0 H PHE A 12 -16.139 10.390 -3.669 1.00 0.00 H new ATOM 0 HA PHE A 12 -15.918 7.700 -3.921 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.796 9.307 -1.500 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.320 7.621 -1.481 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -13.960 7.892 -3.562 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -15.003 9.926 -0.060 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -11.886 9.193 -3.753 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.653 10.570 0.213 1.00 0.00 H new ATOM 0 HZ PHE A 12 -11.256 10.626 -1.834 1.00 0.00 H new ATOM 183 N LYS A 13 -19.028 8.865 -3.359 1.00 0.00 N ATOM 184 CA LYS A 13 -20.413 8.508 -3.363 1.00 0.00 C ATOM 185 C LYS A 13 -20.837 7.875 -4.643 1.00 0.00 C ATOM 186 O LYS A 13 -21.608 6.918 -4.687 1.00 0.00 O ATOM 187 CB LYS A 13 -21.321 9.723 -3.108 1.00 0.00 C ATOM 188 CG LYS A 13 -22.833 9.525 -2.979 1.00 0.00 C ATOM 189 CD LYS A 13 -23.359 8.846 -1.713 1.00 0.00 C ATOM 190 CE LYS A 13 -24.773 8.265 -1.648 1.00 0.00 C ATOM 191 NZ LYS A 13 -25.814 9.311 -1.544 1.00 0.00 N ATOM 0 H LYS A 13 -18.873 9.864 -3.224 1.00 0.00 H new ATOM 0 HA LYS A 13 -20.523 7.787 -2.553 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -20.976 10.201 -2.191 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -21.153 10.431 -3.920 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -23.306 10.504 -3.055 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -23.168 8.941 -3.836 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -22.671 8.033 -1.480 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -23.278 9.574 -0.906 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -24.956 7.663 -2.538 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -24.848 7.597 -0.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -26.752 8.864 -1.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -25.659 9.870 -0.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -25.764 9.935 -2.375 1.00 0.00 H new ATOM 205 N GLU A 14 -20.307 8.451 -5.737 1.00 0.00 N ATOM 206 CA GLU A 14 -20.607 7.976 -7.052 1.00 0.00 C ATOM 207 C GLU A 14 -20.055 6.608 -7.258 1.00 0.00 C ATOM 208 O GLU A 14 -20.762 5.805 -7.865 1.00 0.00 O ATOM 209 CB GLU A 14 -20.126 9.010 -8.084 1.00 0.00 C ATOM 210 CG GLU A 14 -20.373 8.752 -9.572 1.00 0.00 C ATOM 211 CD GLU A 14 -21.854 8.726 -9.922 1.00 0.00 C ATOM 212 OE1 GLU A 14 -22.525 9.654 -9.395 1.00 0.00 O ATOM 213 OE2 GLU A 14 -22.340 7.930 -10.769 1.00 0.00 O ATOM 0 H GLU A 14 -19.670 9.247 -5.711 1.00 0.00 H new ATOM 0 HA GLU A 14 -21.684 7.872 -7.185 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -20.592 9.963 -7.835 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -19.052 9.135 -7.947 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -19.878 9.526 -10.159 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -19.920 7.801 -9.852 1.00 0.00 H new ATOM 220 N ALA A 15 -18.821 6.241 -6.872 1.00 0.00 N ATOM 221 CA ALA A 15 -18.370 4.886 -6.957 1.00 0.00 C ATOM 222 C ALA A 15 -19.169 3.980 -6.085 1.00 0.00 C ATOM 223 O ALA A 15 -19.500 2.867 -6.492 1.00 0.00 O ATOM 224 CB ALA A 15 -16.862 4.834 -6.661 1.00 0.00 C ATOM 0 H ALA A 15 -18.129 6.889 -6.497 1.00 0.00 H new ATOM 0 HA ALA A 15 -18.526 4.517 -7.970 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.514 3.803 -6.725 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.327 5.443 -7.390 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.674 5.219 -5.659 1.00 0.00 H new ATOM 230 N PHE A 16 -19.529 4.276 -4.823 1.00 0.00 N ATOM 231 CA PHE A 16 -20.322 3.519 -3.905 1.00 0.00 C ATOM 232 C PHE A 16 -21.624 3.092 -4.491 1.00 0.00 C ATOM 233 O PHE A 16 -21.922 1.900 -4.466 1.00 0.00 O ATOM 234 CB PHE A 16 -20.533 4.327 -2.614 1.00 0.00 C ATOM 235 CG PHE A 16 -21.097 3.521 -1.495 1.00 0.00 C ATOM 236 CD1 PHE A 16 -22.466 3.388 -1.488 1.00 0.00 C ATOM 237 CD2 PHE A 16 -20.264 2.922 -0.579 1.00 0.00 C ATOM 238 CE1 PHE A 16 -23.007 2.606 -0.494 1.00 0.00 C ATOM 239 CE2 PHE A 16 -20.886 2.263 0.455 1.00 0.00 C ATOM 240 CZ PHE A 16 -22.245 2.065 0.514 1.00 0.00 C ATOM 0 H PHE A 16 -19.225 5.153 -4.399 1.00 0.00 H new ATOM 0 HA PHE A 16 -19.778 2.603 -3.672 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -19.579 4.752 -2.301 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -21.201 5.162 -2.823 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -23.086 3.874 -2.227 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -19.188 2.967 -0.666 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -24.069 2.410 -0.506 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -20.276 1.882 1.261 1.00 0.00 H new ATOM 0 HZ PHE A 16 -22.696 1.506 1.321 1.00 0.00 H new ATOM 250 N SER A 17 -22.456 4.006 -5.022 1.00 0.00 N ATOM 251 CA SER A 17 -23.716 3.684 -5.619 1.00 0.00 C ATOM 252 C SER A 17 -23.528 3.003 -6.931 1.00 0.00 C ATOM 253 O SER A 17 -24.495 2.503 -7.504 1.00 0.00 O ATOM 254 CB SER A 17 -24.397 5.026 -5.937 1.00 0.00 C ATOM 255 OG SER A 17 -24.990 5.626 -4.795 1.00 0.00 O ATOM 0 H SER A 17 -22.245 5.004 -5.036 1.00 0.00 H new ATOM 0 HA SER A 17 -24.283 3.041 -4.946 1.00 0.00 H new ATOM 0 HB2 SER A 17 -23.662 5.710 -6.361 1.00 0.00 H new ATOM 0 HB3 SER A 17 -25.162 4.869 -6.698 1.00 0.00 H new ATOM 0 HG SER A 17 -25.407 6.475 -5.051 1.00 0.00 H new ATOM 261 N LEU A 18 -22.352 3.017 -7.582 1.00 0.00 N ATOM 262 CA LEU A 18 -22.031 2.104 -8.635 1.00 0.00 C ATOM 263 C LEU A 18 -21.911 0.682 -8.204 1.00 0.00 C ATOM 264 O LEU A 18 -22.208 -0.224 -8.981 1.00 0.00 O ATOM 265 CB LEU A 18 -20.740 2.510 -9.365 1.00 0.00 C ATOM 266 CG LEU A 18 -20.887 2.544 -10.896 1.00 0.00 C ATOM 267 CD1 LEU A 18 -21.884 3.581 -11.439 1.00 0.00 C ATOM 268 CD2 LEU A 18 -19.483 2.717 -11.499 1.00 0.00 C ATOM 0 H LEU A 18 -21.605 3.679 -7.372 1.00 0.00 H new ATOM 0 HA LEU A 18 -22.884 2.167 -9.310 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -20.428 3.494 -9.016 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.946 1.812 -9.099 1.00 0.00 H new ATOM 0 HG LEU A 18 -21.332 1.598 -11.205 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -21.913 3.523 -12.527 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -22.877 3.376 -11.038 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -21.570 4.580 -11.137 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -19.555 2.745 -12.586 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -19.045 3.649 -11.140 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -18.852 1.880 -11.198 1.00 0.00 H new ATOM 280 N PHE A 19 -21.454 0.358 -6.981 1.00 0.00 N ATOM 281 CA PHE A 19 -21.098 -0.924 -6.459 1.00 0.00 C ATOM 282 C PHE A 19 -22.211 -1.577 -5.714 1.00 0.00 C ATOM 283 O PHE A 19 -22.216 -2.787 -5.490 1.00 0.00 O ATOM 284 CB PHE A 19 -19.906 -0.788 -5.497 1.00 0.00 C ATOM 285 CG PHE A 19 -18.595 -0.423 -6.105 1.00 0.00 C ATOM 286 CD1 PHE A 19 -18.260 -0.682 -7.413 1.00 0.00 C ATOM 287 CD2 PHE A 19 -17.535 -0.131 -5.279 1.00 0.00 C ATOM 288 CE1 PHE A 19 -17.014 -0.468 -7.953 1.00 0.00 C ATOM 289 CE2 PHE A 19 -16.276 0.108 -5.779 1.00 0.00 C ATOM 290 CZ PHE A 19 -16.025 0.012 -7.127 1.00 0.00 C ATOM 0 H PHE A 19 -21.320 1.085 -6.278 1.00 0.00 H new ATOM 0 HA PHE A 19 -20.848 -1.544 -7.320 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.156 -0.035 -4.749 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -19.785 -1.734 -4.969 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -19.028 -1.080 -8.060 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -17.695 -0.088 -4.212 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -16.818 -0.671 -8.995 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -15.476 0.374 -5.105 1.00 0.00 H new ATOM 0 HZ PHE A 19 -15.068 0.308 -7.530 1.00 0.00 H new ATOM 300 N ASP A 20 -23.113 -0.722 -5.200 1.00 0.00 N ATOM 301 CA ASP A 20 -24.470 -0.997 -4.844 1.00 0.00 C ATOM 302 C ASP A 20 -25.336 -1.455 -5.966 1.00 0.00 C ATOM 303 O ASP A 20 -25.826 -0.712 -6.815 1.00 0.00 O ATOM 304 CB ASP A 20 -24.953 0.258 -4.098 1.00 0.00 C ATOM 305 CG ASP A 20 -26.180 -0.056 -3.254 1.00 0.00 C ATOM 306 OD1 ASP A 20 -26.579 -1.250 -3.311 1.00 0.00 O ATOM 307 OD2 ASP A 20 -26.750 0.840 -2.575 1.00 0.00 O ATOM 0 H ASP A 20 -22.867 0.251 -5.018 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.537 -1.872 -4.198 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.155 0.638 -3.461 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -25.190 1.044 -4.815 1.00 0.00 H new ATOM 312 N LYS A 21 -25.707 -2.745 -6.059 1.00 0.00 N ATOM 313 CA LYS A 21 -26.365 -3.443 -7.119 1.00 0.00 C ATOM 314 C LYS A 21 -27.819 -3.119 -7.097 1.00 0.00 C ATOM 315 O LYS A 21 -28.400 -2.593 -8.045 1.00 0.00 O ATOM 316 CB LYS A 21 -26.039 -4.909 -6.787 1.00 0.00 C ATOM 317 CG LYS A 21 -26.660 -5.910 -7.764 1.00 0.00 C ATOM 318 CD LYS A 21 -26.434 -7.349 -7.295 1.00 0.00 C ATOM 319 CE LYS A 21 -26.371 -8.347 -8.452 1.00 0.00 C ATOM 320 NZ LYS A 21 -26.302 -9.784 -8.103 1.00 0.00 N ATOM 0 H LYS A 21 -25.517 -3.379 -5.283 1.00 0.00 H new ATOM 0 HA LYS A 21 -26.049 -3.186 -8.130 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -24.957 -5.040 -6.784 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -26.390 -5.132 -5.779 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -27.729 -5.718 -7.856 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -26.225 -5.774 -8.754 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -25.505 -7.399 -6.727 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -27.238 -7.636 -6.617 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -27.249 -8.193 -9.079 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -25.499 -8.105 -9.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -26.264 -10.351 -8.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -25.449 -9.963 -7.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -27.145 -10.049 -7.554 1.00 0.00 H new ATOM 334 N ASP A 22 -28.365 -3.249 -5.875 1.00 0.00 N ATOM 335 CA ASP A 22 -29.770 -3.152 -5.627 1.00 0.00 C ATOM 336 C ASP A 22 -30.259 -1.788 -5.282 1.00 0.00 C ATOM 337 O ASP A 22 -31.428 -1.484 -5.517 1.00 0.00 O ATOM 338 CB ASP A 22 -30.194 -4.256 -4.644 1.00 0.00 C ATOM 339 CG ASP A 22 -29.338 -4.620 -3.439 1.00 0.00 C ATOM 340 OD1 ASP A 22 -28.439 -3.797 -3.122 1.00 0.00 O ATOM 341 OD2 ASP A 22 -29.668 -5.601 -2.721 1.00 0.00 O ATOM 0 H ASP A 22 -27.814 -3.427 -5.035 1.00 0.00 H new ATOM 0 HA ASP A 22 -30.283 -3.328 -6.572 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -31.177 -3.980 -4.262 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -30.323 -5.167 -5.228 1.00 0.00 H new ATOM 346 N GLY A 23 -29.445 -0.927 -4.646 1.00 0.00 N ATOM 347 CA GLY A 23 -29.648 0.468 -4.407 1.00 0.00 C ATOM 348 C GLY A 23 -30.031 0.740 -2.993 1.00 0.00 C ATOM 349 O GLY A 23 -30.707 1.686 -2.591 1.00 0.00 O ATOM 0 H GLY A 23 -28.555 -1.243 -4.261 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -28.736 1.014 -4.647 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -30.427 0.841 -5.072 1.00 0.00 H new ATOM 353 N ASP A 24 -29.552 -0.077 -2.039 1.00 0.00 N ATOM 354 CA ASP A 24 -30.151 -0.169 -0.744 1.00 0.00 C ATOM 355 C ASP A 24 -29.450 0.779 0.166 1.00 0.00 C ATOM 356 O ASP A 24 -29.946 1.218 1.202 1.00 0.00 O ATOM 357 CB ASP A 24 -30.175 -1.634 -0.274 1.00 0.00 C ATOM 358 CG ASP A 24 -28.833 -2.150 0.225 1.00 0.00 C ATOM 359 OD1 ASP A 24 -27.757 -1.888 -0.375 1.00 0.00 O ATOM 360 OD2 ASP A 24 -28.879 -2.973 1.178 1.00 0.00 O ATOM 0 H ASP A 24 -28.740 -0.681 -2.167 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.199 0.132 -0.757 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -30.911 -1.736 0.524 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -30.510 -2.263 -1.099 1.00 0.00 H new ATOM 365 N GLY A 25 -28.178 1.057 -0.173 1.00 0.00 N ATOM 366 CA GLY A 25 -27.322 1.860 0.644 1.00 0.00 C ATOM 367 C GLY A 25 -26.168 1.133 1.244 1.00 0.00 C ATOM 368 O GLY A 25 -25.386 1.763 1.954 1.00 0.00 O ATOM 0 H GLY A 25 -27.737 0.719 -1.028 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -26.940 2.686 0.044 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -27.915 2.297 1.447 1.00 0.00 H new ATOM 372 N THR A 26 -26.015 -0.161 0.909 1.00 0.00 N ATOM 373 CA THR A 26 -24.990 -1.023 1.410 1.00 0.00 C ATOM 374 C THR A 26 -24.223 -1.627 0.284 1.00 0.00 C ATOM 375 O THR A 26 -24.791 -1.939 -0.762 1.00 0.00 O ATOM 376 CB THR A 26 -25.576 -2.108 2.264 1.00 0.00 C ATOM 377 OG1 THR A 26 -26.202 -3.129 1.501 1.00 0.00 O ATOM 378 CG2 THR A 26 -26.636 -1.590 3.251 1.00 0.00 C ATOM 0 H THR A 26 -26.640 -0.630 0.254 1.00 0.00 H new ATOM 0 HA THR A 26 -24.315 -0.424 2.021 1.00 0.00 H new ATOM 0 HB THR A 26 -24.717 -2.505 2.805 1.00 0.00 H new ATOM 0 HG1 THR A 26 -27.175 -3.044 1.577 1.00 0.00 H new ATOM 0 HG21 THR A 26 -27.022 -2.422 3.840 1.00 0.00 H new ATOM 0 HG22 THR A 26 -26.185 -0.853 3.916 1.00 0.00 H new ATOM 0 HG23 THR A 26 -27.453 -1.127 2.698 1.00 0.00 H new ATOM 386 N ILE A 27 -22.936 -1.887 0.576 1.00 0.00 N ATOM 387 CA ILE A 27 -22.075 -2.844 -0.047 1.00 0.00 C ATOM 388 C ILE A 27 -22.056 -4.070 0.800 1.00 0.00 C ATOM 389 O ILE A 27 -21.752 -4.052 1.992 1.00 0.00 O ATOM 390 CB ILE A 27 -20.693 -2.391 -0.411 1.00 0.00 C ATOM 391 CG1 ILE A 27 -20.641 -0.872 -0.652 1.00 0.00 C ATOM 392 CG2 ILE A 27 -20.232 -3.181 -1.648 1.00 0.00 C ATOM 393 CD1 ILE A 27 -19.368 -0.367 -1.330 1.00 0.00 C ATOM 0 H ILE A 27 -22.455 -1.378 1.318 1.00 0.00 H new ATOM 0 HA ILE A 27 -22.505 -3.036 -1.030 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.014 -2.589 0.418 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -21.497 -0.587 -1.263 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -20.750 -0.364 0.306 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.227 -2.865 -1.928 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -20.226 -4.246 -1.418 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -20.916 -2.992 -2.476 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -19.427 0.714 -1.456 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -18.504 -0.614 -0.712 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.263 -0.841 -2.306 1.00 0.00 H new ATOM 405 N THR A 28 -22.601 -5.171 0.254 1.00 0.00 N ATOM 406 CA THR A 28 -22.593 -6.442 0.910 1.00 0.00 C ATOM 407 C THR A 28 -21.448 -7.241 0.389 1.00 0.00 C ATOM 408 O THR A 28 -20.515 -6.772 -0.261 1.00 0.00 O ATOM 409 CB THR A 28 -23.866 -7.199 0.672 1.00 0.00 C ATOM 410 OG1 THR A 28 -24.170 -7.368 -0.705 1.00 0.00 O ATOM 411 CG2 THR A 28 -25.027 -6.418 1.310 1.00 0.00 C ATOM 0 H THR A 28 -23.055 -5.179 -0.659 1.00 0.00 H new ATOM 0 HA THR A 28 -22.498 -6.273 1.983 1.00 0.00 H new ATOM 0 HB THR A 28 -23.733 -8.188 1.110 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.394 -6.499 -1.100 1.00 0.00 H new ATOM 0 HG21 THR A 28 -25.961 -6.956 1.146 1.00 0.00 H new ATOM 0 HG22 THR A 28 -24.851 -6.315 2.381 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.093 -5.429 0.856 1.00 0.00 H new ATOM 419 N THR A 29 -21.319 -8.537 0.724 1.00 0.00 N ATOM 420 CA THR A 29 -20.298 -9.441 0.294 1.00 0.00 C ATOM 421 C THR A 29 -20.362 -9.776 -1.156 1.00 0.00 C ATOM 422 O THR A 29 -19.305 -10.025 -1.733 1.00 0.00 O ATOM 423 CB THR A 29 -20.422 -10.734 1.044 1.00 0.00 C ATOM 424 OG1 THR A 29 -21.788 -11.097 1.187 1.00 0.00 O ATOM 425 CG2 THR A 29 -19.748 -10.741 2.426 1.00 0.00 C ATOM 0 H THR A 29 -21.987 -8.989 1.349 1.00 0.00 H new ATOM 0 HA THR A 29 -19.355 -8.930 0.488 1.00 0.00 H new ATOM 0 HB THR A 29 -19.887 -11.465 0.438 1.00 0.00 H new ATOM 0 HG1 THR A 29 -21.852 -11.943 1.677 1.00 0.00 H new ATOM 0 HG21 THR A 29 -19.889 -11.715 2.894 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.682 -10.544 2.312 1.00 0.00 H new ATOM 0 HG23 THR A 29 -20.195 -9.969 3.053 1.00 0.00 H new ATOM 433 N LYS A 30 -21.527 -9.876 -1.822 1.00 0.00 N ATOM 434 CA LYS A 30 -21.762 -10.084 -3.217 1.00 0.00 C ATOM 435 C LYS A 30 -21.120 -9.066 -4.095 1.00 0.00 C ATOM 436 O LYS A 30 -20.527 -9.293 -5.149 1.00 0.00 O ATOM 437 CB LYS A 30 -23.281 -10.166 -3.444 1.00 0.00 C ATOM 438 CG LYS A 30 -24.168 -11.094 -2.613 1.00 0.00 C ATOM 439 CD LYS A 30 -25.651 -10.784 -2.826 1.00 0.00 C ATOM 440 CE LYS A 30 -26.634 -11.753 -2.164 1.00 0.00 C ATOM 441 NZ LYS A 30 -26.539 -13.161 -2.608 1.00 0.00 N ATOM 0 H LYS A 30 -22.409 -9.801 -1.316 1.00 0.00 H new ATOM 0 HA LYS A 30 -21.288 -11.022 -3.506 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -23.674 -9.157 -3.318 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -23.430 -10.438 -4.489 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -23.968 -12.131 -2.885 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -23.920 -10.988 -1.557 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -25.851 -9.780 -2.451 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -25.850 -10.769 -3.898 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -26.479 -11.719 -1.086 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -27.648 -11.399 -2.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -27.245 -13.733 -2.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -26.719 -13.215 -3.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -25.587 -13.526 -2.404 1.00 0.00 H new ATOM 455 N GLU A 31 -21.372 -7.821 -3.652 1.00 0.00 N ATOM 456 CA GLU A 31 -21.166 -6.555 -4.282 1.00 0.00 C ATOM 457 C GLU A 31 -19.730 -6.164 -4.202 1.00 0.00 C ATOM 458 O GLU A 31 -19.085 -5.645 -5.111 1.00 0.00 O ATOM 459 CB GLU A 31 -22.088 -5.536 -3.592 1.00 0.00 C ATOM 460 CG GLU A 31 -23.481 -5.507 -4.226 1.00 0.00 C ATOM 461 CD GLU A 31 -24.570 -4.915 -3.342 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.485 -5.038 -2.091 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.472 -4.218 -3.878 1.00 0.00 O ATOM 0 H GLU A 31 -21.775 -7.692 -2.724 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.413 -6.599 -5.343 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.176 -5.784 -2.534 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -21.641 -4.544 -3.651 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -23.432 -4.934 -5.152 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -23.764 -6.525 -4.496 1.00 0.00 H new ATOM 470 N LEU A 32 -19.044 -6.602 -3.130 1.00 0.00 N ATOM 471 CA LEU A 32 -17.617 -6.573 -3.054 1.00 0.00 C ATOM 472 C LEU A 32 -16.954 -7.723 -3.730 1.00 0.00 C ATOM 473 O LEU A 32 -15.906 -7.529 -4.344 1.00 0.00 O ATOM 474 CB LEU A 32 -17.167 -6.573 -1.583 1.00 0.00 C ATOM 475 CG LEU A 32 -16.900 -5.206 -0.930 1.00 0.00 C ATOM 476 CD1 LEU A 32 -16.288 -5.307 0.477 1.00 0.00 C ATOM 477 CD2 LEU A 32 -15.908 -4.385 -1.772 1.00 0.00 C ATOM 0 H LEU A 32 -19.492 -6.985 -2.298 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.317 -5.661 -3.571 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.930 -7.085 -0.996 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.256 -7.167 -1.508 1.00 0.00 H new ATOM 0 HG LEU A 32 -17.879 -4.732 -0.866 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -16.127 -4.306 0.876 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.968 -5.853 1.131 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.335 -5.834 0.422 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -15.733 -3.422 -1.292 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -14.965 -4.926 -1.854 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -16.322 -4.224 -2.768 1.00 0.00 H new ATOM 489 N GLY A 33 -17.649 -8.868 -3.855 1.00 0.00 N ATOM 490 CA GLY A 33 -17.261 -9.900 -4.765 1.00 0.00 C ATOM 491 C GLY A 33 -17.311 -9.664 -6.235 1.00 0.00 C ATOM 492 O GLY A 33 -16.337 -9.968 -6.922 1.00 0.00 O ATOM 0 H GLY A 33 -18.490 -9.080 -3.318 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.237 -10.180 -4.518 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.888 -10.767 -4.556 1.00 0.00 H new ATOM 496 N THR A 34 -18.280 -8.894 -6.763 1.00 0.00 N ATOM 497 CA THR A 34 -18.337 -8.384 -8.097 1.00 0.00 C ATOM 498 C THR A 34 -17.245 -7.468 -8.530 1.00 0.00 C ATOM 499 O THR A 34 -16.558 -7.683 -9.528 1.00 0.00 O ATOM 500 CB THR A 34 -19.715 -7.884 -8.415 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.701 -8.822 -8.011 1.00 0.00 O ATOM 502 CG2 THR A 34 -19.888 -7.660 -9.927 1.00 0.00 C ATOM 0 H THR A 34 -19.088 -8.606 -6.210 1.00 0.00 H new ATOM 0 HA THR A 34 -18.124 -9.248 -8.726 1.00 0.00 H new ATOM 0 HB THR A 34 -19.839 -6.944 -7.876 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.739 -8.855 -7.032 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.896 -7.298 -10.128 1.00 0.00 H new ATOM 0 HG22 THR A 34 -19.162 -6.923 -10.271 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.728 -8.600 -10.455 1.00 0.00 H new ATOM 510 N VAL A 35 -16.961 -6.481 -7.661 1.00 0.00 N ATOM 511 CA VAL A 35 -15.790 -5.665 -7.743 1.00 0.00 C ATOM 512 C VAL A 35 -14.496 -6.398 -7.651 1.00 0.00 C ATOM 513 O VAL A 35 -13.519 -6.152 -8.357 1.00 0.00 O ATOM 514 CB VAL A 35 -15.900 -4.610 -6.683 1.00 0.00 C ATOM 515 CG1 VAL A 35 -14.719 -3.630 -6.582 1.00 0.00 C ATOM 516 CG2 VAL A 35 -17.192 -3.861 -7.052 1.00 0.00 C ATOM 0 H VAL A 35 -17.567 -6.243 -6.875 1.00 0.00 H new ATOM 0 HA VAL A 35 -15.761 -5.230 -8.742 1.00 0.00 H new ATOM 0 HB VAL A 35 -15.902 -5.080 -5.699 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -14.908 -2.913 -5.783 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -13.805 -4.183 -6.365 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -14.605 -3.098 -7.527 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -17.367 -3.061 -6.333 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -17.093 -3.436 -8.051 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.032 -4.555 -7.034 1.00 0.00 H new ATOM 526 N MET A 36 -14.288 -7.446 -6.834 1.00 0.00 N ATOM 527 CA MET A 36 -13.146 -8.302 -6.763 1.00 0.00 C ATOM 528 C MET A 36 -13.009 -9.062 -8.038 1.00 0.00 C ATOM 529 O MET A 36 -11.973 -9.089 -8.700 1.00 0.00 O ATOM 530 CB MET A 36 -13.262 -9.238 -5.548 1.00 0.00 C ATOM 531 CG MET A 36 -12.855 -8.394 -4.338 1.00 0.00 C ATOM 532 SD MET A 36 -11.095 -8.216 -3.917 1.00 0.00 S ATOM 533 CE MET A 36 -11.421 -6.825 -2.795 1.00 0.00 C ATOM 0 H MET A 36 -14.997 -7.719 -6.153 1.00 0.00 H new ATOM 0 HA MET A 36 -12.245 -7.704 -6.630 1.00 0.00 H new ATOM 0 HB2 MET A 36 -14.279 -9.615 -5.439 1.00 0.00 H new ATOM 0 HB3 MET A 36 -12.611 -10.105 -5.658 1.00 0.00 H new ATOM 0 HG2 MET A 36 -13.257 -7.392 -4.489 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.358 -8.811 -3.466 1.00 0.00 H new ATOM 0 HE1 MET A 36 -10.485 -6.492 -2.347 1.00 0.00 H new ATOM 0 HE2 MET A 36 -11.868 -6.003 -3.355 1.00 0.00 H new ATOM 0 HE3 MET A 36 -12.106 -7.144 -2.010 1.00 0.00 H new ATOM 543 N ARG A 37 -14.028 -9.754 -8.579 1.00 0.00 N ATOM 544 CA ARG A 37 -13.951 -10.307 -9.896 1.00 0.00 C ATOM 545 C ARG A 37 -13.614 -9.431 -11.054 1.00 0.00 C ATOM 546 O ARG A 37 -12.938 -9.878 -11.979 1.00 0.00 O ATOM 547 CB ARG A 37 -15.209 -11.136 -10.204 1.00 0.00 C ATOM 548 CG ARG A 37 -15.586 -12.161 -9.133 1.00 0.00 C ATOM 549 CD ARG A 37 -14.486 -13.104 -8.641 1.00 0.00 C ATOM 550 NE ARG A 37 -15.254 -13.834 -7.594 1.00 0.00 N ATOM 551 CZ ARG A 37 -15.165 -15.137 -7.199 1.00 0.00 C ATOM 552 NH1 ARG A 37 -14.219 -15.985 -7.697 1.00 0.00 N ATOM 553 NH2 ARG A 37 -16.157 -15.571 -6.366 1.00 0.00 N ATOM 0 H ARG A 37 -14.911 -9.931 -8.100 1.00 0.00 H new ATOM 0 HA ARG A 37 -13.049 -10.914 -9.817 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -16.049 -10.455 -10.346 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -15.059 -11.658 -11.149 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -15.975 -11.619 -8.271 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -16.402 -12.770 -9.522 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -14.114 -13.762 -9.426 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.625 -12.572 -8.237 1.00 0.00 H new ATOM 0 HE ARG A 37 -15.950 -13.277 -7.099 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -13.548 -15.651 -8.388 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -14.183 -16.953 -7.378 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -16.899 -14.932 -6.080 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -16.156 -16.534 -6.030 1.00 0.00 H new ATOM 567 N SER A 38 -14.027 -8.154 -11.142 1.00 0.00 N ATOM 568 CA SER A 38 -13.601 -7.260 -12.172 1.00 0.00 C ATOM 569 C SER A 38 -12.188 -6.812 -12.020 1.00 0.00 C ATOM 570 O SER A 38 -11.574 -6.280 -12.944 1.00 0.00 O ATOM 571 CB SER A 38 -14.595 -6.118 -12.441 1.00 0.00 C ATOM 572 OG SER A 38 -14.654 -5.208 -11.352 1.00 0.00 O ATOM 0 H SER A 38 -14.676 -7.732 -10.478 1.00 0.00 H new ATOM 0 HA SER A 38 -13.606 -7.851 -13.088 1.00 0.00 H new ATOM 0 HB2 SER A 38 -14.302 -5.585 -13.345 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.586 -6.533 -12.623 1.00 0.00 H new ATOM 0 HG SER A 38 -14.331 -5.649 -10.539 1.00 0.00 H new ATOM 578 N LEU A 39 -11.554 -7.043 -10.856 1.00 0.00 N ATOM 579 CA LEU A 39 -10.159 -6.795 -10.664 1.00 0.00 C ATOM 580 C LEU A 39 -9.422 -8.075 -10.856 1.00 0.00 C ATOM 581 O LEU A 39 -8.227 -8.132 -10.569 1.00 0.00 O ATOM 582 CB LEU A 39 -9.871 -6.193 -9.278 1.00 0.00 C ATOM 583 CG LEU A 39 -10.596 -4.864 -9.005 1.00 0.00 C ATOM 584 CD1 LEU A 39 -10.862 -4.648 -7.506 1.00 0.00 C ATOM 585 CD2 LEU A 39 -9.695 -3.789 -9.636 1.00 0.00 C ATOM 0 H LEU A 39 -12.023 -7.411 -10.028 1.00 0.00 H new ATOM 0 HA LEU A 39 -9.822 -6.060 -11.395 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -10.159 -6.915 -8.514 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -8.797 -6.035 -9.179 1.00 0.00 H new ATOM 0 HG LEU A 39 -11.594 -4.836 -9.442 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.375 -3.697 -7.361 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.484 -5.458 -7.126 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.915 -4.635 -6.967 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -10.141 -2.806 -9.486 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.712 -3.817 -9.166 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -9.592 -3.981 -10.704 1.00 0.00 H new ATOM 597 N GLY A 40 -10.080 -9.158 -11.307 1.00 0.00 N ATOM 598 CA GLY A 40 -9.503 -10.412 -11.678 1.00 0.00 C ATOM 599 C GLY A 40 -9.346 -11.322 -10.508 1.00 0.00 C ATOM 600 O GLY A 40 -8.764 -12.401 -10.607 1.00 0.00 O ATOM 0 H GLY A 40 -11.094 -9.155 -11.420 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.131 -10.892 -12.429 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.530 -10.241 -12.138 1.00 0.00 H new ATOM 604 N GLN A 41 -9.873 -10.933 -9.334 1.00 0.00 N ATOM 605 CA GLN A 41 -9.594 -11.626 -8.114 1.00 0.00 C ATOM 606 C GLN A 41 -10.463 -12.828 -7.975 1.00 0.00 C ATOM 607 O GLN A 41 -11.531 -12.930 -8.576 1.00 0.00 O ATOM 608 CB GLN A 41 -9.597 -10.638 -6.936 1.00 0.00 C ATOM 609 CG GLN A 41 -8.528 -9.549 -7.050 1.00 0.00 C ATOM 610 CD GLN A 41 -7.141 -10.171 -6.983 1.00 0.00 C ATOM 611 OE1 GLN A 41 -6.658 -10.692 -7.987 1.00 0.00 O ATOM 612 NE2 GLN A 41 -6.452 -10.106 -5.812 1.00 0.00 N ATOM 0 H GLN A 41 -10.497 -10.133 -9.229 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.586 -12.040 -8.123 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.578 -10.168 -6.869 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.444 -11.190 -6.009 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.648 -9.008 -7.988 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.649 -8.823 -6.246 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.876 -9.668 -4.994 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.511 -10.495 -5.752 1.00 0.00 H new ATOM 621 N ASN A 42 -10.074 -13.693 -7.021 1.00 0.00 N ATOM 622 CA ASN A 42 -10.895 -14.731 -6.480 1.00 0.00 C ATOM 623 C ASN A 42 -10.892 -14.836 -4.994 1.00 0.00 C ATOM 624 O ASN A 42 -10.079 -15.599 -4.475 1.00 0.00 O ATOM 625 CB ASN A 42 -10.595 -16.167 -6.942 1.00 0.00 C ATOM 626 CG ASN A 42 -10.709 -16.315 -8.452 1.00 0.00 C ATOM 627 OD1 ASN A 42 -11.667 -15.903 -9.105 1.00 0.00 O ATOM 628 ND2 ASN A 42 -9.773 -17.012 -9.151 1.00 0.00 N ATOM 0 H ASN A 42 -9.142 -13.667 -6.607 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.851 -14.386 -6.875 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -9.591 -16.448 -6.625 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -11.286 -16.856 -6.457 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -9.892 -17.163 -10.153 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -8.952 -17.383 -8.673 1.00 0.00 H new ATOM 635 N PRO A 43 -11.647 -14.074 -4.259 1.00 0.00 N ATOM 636 CA PRO A 43 -11.767 -14.216 -2.837 1.00 0.00 C ATOM 637 C PRO A 43 -12.742 -15.270 -2.440 1.00 0.00 C ATOM 638 O PRO A 43 -13.435 -15.803 -3.304 1.00 0.00 O ATOM 639 CB PRO A 43 -12.358 -12.859 -2.462 1.00 0.00 C ATOM 640 CG PRO A 43 -13.350 -12.495 -3.579 1.00 0.00 C ATOM 641 CD PRO A 43 -12.461 -12.968 -4.740 1.00 0.00 C ATOM 0 HA PRO A 43 -10.824 -14.492 -2.365 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -12.861 -12.908 -1.496 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -11.576 -12.105 -2.376 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -14.297 -13.031 -3.511 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -13.588 -11.432 -3.619 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -13.073 -13.284 -5.585 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -11.828 -12.153 -5.092 1.00 0.00 H new ATOM 649 N THR A 44 -12.902 -15.626 -1.153 1.00 0.00 N ATOM 650 CA THR A 44 -13.931 -16.476 -0.639 1.00 0.00 C ATOM 651 C THR A 44 -14.848 -15.585 0.126 1.00 0.00 C ATOM 652 O THR A 44 -14.497 -14.413 0.256 1.00 0.00 O ATOM 653 CB THR A 44 -13.429 -17.577 0.247 1.00 0.00 C ATOM 654 OG1 THR A 44 -12.623 -17.117 1.322 1.00 0.00 O ATOM 655 CG2 THR A 44 -12.672 -18.658 -0.543 1.00 0.00 C ATOM 0 H THR A 44 -12.270 -15.298 -0.423 1.00 0.00 H new ATOM 0 HA THR A 44 -14.420 -16.986 -1.469 1.00 0.00 H new ATOM 0 HB THR A 44 -14.328 -18.018 0.678 1.00 0.00 H new ATOM 0 HG1 THR A 44 -12.330 -17.881 1.861 1.00 0.00 H new ATOM 0 HG21 THR A 44 -12.328 -19.434 0.141 1.00 0.00 H new ATOM 0 HG22 THR A 44 -13.337 -19.098 -1.286 1.00 0.00 H new ATOM 0 HG23 THR A 44 -11.814 -18.209 -1.044 1.00 0.00 H new ATOM 663 N GLU A 45 -16.062 -16.048 0.473 1.00 0.00 N ATOM 664 CA GLU A 45 -16.939 -15.242 1.266 1.00 0.00 C ATOM 665 C GLU A 45 -16.441 -15.042 2.656 1.00 0.00 C ATOM 666 O GLU A 45 -16.664 -13.973 3.223 1.00 0.00 O ATOM 667 CB GLU A 45 -18.309 -15.928 1.400 1.00 0.00 C ATOM 668 CG GLU A 45 -18.919 -16.351 0.062 1.00 0.00 C ATOM 669 CD GLU A 45 -18.580 -17.811 -0.207 1.00 0.00 C ATOM 670 OE1 GLU A 45 -17.455 -18.326 0.029 1.00 0.00 O ATOM 671 OE2 GLU A 45 -19.533 -18.479 -0.689 1.00 0.00 O ATOM 0 H GLU A 45 -16.432 -16.962 0.211 1.00 0.00 H new ATOM 0 HA GLU A 45 -17.001 -14.281 0.755 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -18.204 -16.807 2.036 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.997 -15.250 1.905 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -20.000 -16.215 0.083 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -18.534 -15.722 -0.741 1.00 0.00 H new ATOM 678 N ALA A 46 -15.691 -15.959 3.293 1.00 0.00 N ATOM 679 CA ALA A 46 -15.156 -15.717 4.597 1.00 0.00 C ATOM 680 C ALA A 46 -14.194 -14.588 4.738 1.00 0.00 C ATOM 681 O ALA A 46 -14.257 -13.787 5.669 1.00 0.00 O ATOM 682 CB ALA A 46 -14.630 -17.090 5.050 1.00 0.00 C ATOM 0 H ALA A 46 -15.454 -16.871 2.903 1.00 0.00 H new ATOM 0 HA ALA A 46 -15.932 -15.332 5.259 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -14.198 -17.003 6.047 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -15.452 -17.805 5.072 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -13.867 -17.435 4.353 1.00 0.00 H new ATOM 688 N GLU A 47 -13.279 -14.434 3.764 1.00 0.00 N ATOM 689 CA GLU A 47 -12.345 -13.351 3.799 1.00 0.00 C ATOM 690 C GLU A 47 -12.899 -12.017 3.434 1.00 0.00 C ATOM 691 O GLU A 47 -12.498 -11.006 4.009 1.00 0.00 O ATOM 692 CB GLU A 47 -11.160 -13.551 2.839 1.00 0.00 C ATOM 693 CG GLU A 47 -11.421 -13.718 1.341 1.00 0.00 C ATOM 694 CD GLU A 47 -10.186 -14.172 0.577 1.00 0.00 C ATOM 695 OE1 GLU A 47 -9.266 -13.320 0.460 1.00 0.00 O ATOM 696 OE2 GLU A 47 -10.156 -15.294 0.004 1.00 0.00 O ATOM 0 H GLU A 47 -13.186 -15.053 2.959 1.00 0.00 H new ATOM 0 HA GLU A 47 -12.047 -13.361 4.847 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -10.494 -12.697 2.961 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.613 -14.432 3.175 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -12.221 -14.444 1.194 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -11.770 -12.771 0.929 1.00 0.00 H new ATOM 703 N LEU A 48 -13.961 -12.006 2.609 1.00 0.00 N ATOM 704 CA LEU A 48 -14.793 -10.910 2.220 1.00 0.00 C ATOM 705 C LEU A 48 -15.483 -10.371 3.426 1.00 0.00 C ATOM 706 O LEU A 48 -15.390 -9.168 3.662 1.00 0.00 O ATOM 707 CB LEU A 48 -15.824 -11.312 1.152 1.00 0.00 C ATOM 708 CG LEU A 48 -15.352 -10.933 -0.262 1.00 0.00 C ATOM 709 CD1 LEU A 48 -16.130 -11.749 -1.308 1.00 0.00 C ATOM 710 CD2 LEU A 48 -15.579 -9.429 -0.494 1.00 0.00 C ATOM 0 H LEU A 48 -14.270 -12.870 2.164 1.00 0.00 H new ATOM 0 HA LEU A 48 -14.158 -10.144 1.775 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -16.000 -12.387 1.202 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -16.775 -10.823 1.362 1.00 0.00 H new ATOM 0 HG LEU A 48 -14.289 -11.155 -0.360 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -15.791 -11.476 -2.308 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -15.956 -12.812 -1.143 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -17.195 -11.538 -1.216 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -15.244 -9.161 -1.496 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -16.640 -9.201 -0.393 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -15.014 -8.858 0.242 1.00 0.00 H new ATOM 722 N GLN A 49 -16.158 -11.270 4.164 1.00 0.00 N ATOM 723 CA GLN A 49 -16.878 -11.001 5.370 1.00 0.00 C ATOM 724 C GLN A 49 -15.990 -10.495 6.454 1.00 0.00 C ATOM 725 O GLN A 49 -16.374 -9.613 7.221 1.00 0.00 O ATOM 726 CB GLN A 49 -17.740 -12.187 5.834 1.00 0.00 C ATOM 727 CG GLN A 49 -18.451 -11.919 7.162 1.00 0.00 C ATOM 728 CD GLN A 49 -19.454 -13.013 7.499 1.00 0.00 C ATOM 729 OE1 GLN A 49 -20.443 -13.129 6.777 1.00 0.00 O ATOM 730 NE2 GLN A 49 -19.235 -13.734 8.632 1.00 0.00 N ATOM 0 H GLN A 49 -16.203 -12.254 3.898 1.00 0.00 H new ATOM 0 HA GLN A 49 -17.576 -10.199 5.129 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -18.483 -12.412 5.068 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -17.110 -13.070 5.936 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -17.713 -11.845 7.961 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -18.964 -10.959 7.112 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -18.388 -13.580 9.179 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -19.918 -14.429 8.934 1.00 0.00 H new ATOM 739 N ASP A 50 -14.780 -11.061 6.607 1.00 0.00 N ATOM 740 CA ASP A 50 -13.818 -10.614 7.567 1.00 0.00 C ATOM 741 C ASP A 50 -13.413 -9.195 7.362 1.00 0.00 C ATOM 742 O ASP A 50 -13.334 -8.466 8.349 1.00 0.00 O ATOM 743 CB ASP A 50 -12.532 -11.457 7.525 1.00 0.00 C ATOM 744 CG ASP A 50 -11.950 -11.630 8.920 1.00 0.00 C ATOM 745 OD1 ASP A 50 -12.621 -12.113 9.872 1.00 0.00 O ATOM 746 OD2 ASP A 50 -10.770 -11.230 9.106 1.00 0.00 O ATOM 0 H ASP A 50 -14.461 -11.852 6.048 1.00 0.00 H new ATOM 0 HA ASP A 50 -14.319 -10.720 8.529 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -12.747 -12.434 7.093 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.798 -10.976 6.878 1.00 0.00 H new ATOM 751 N MET A 51 -13.193 -8.719 6.123 1.00 0.00 N ATOM 752 CA MET A 51 -12.906 -7.364 5.768 1.00 0.00 C ATOM 753 C MET A 51 -13.983 -6.390 6.096 1.00 0.00 C ATOM 754 O MET A 51 -13.762 -5.360 6.732 1.00 0.00 O ATOM 755 CB MET A 51 -12.582 -7.212 4.272 1.00 0.00 C ATOM 756 CG MET A 51 -11.928 -5.860 3.977 1.00 0.00 C ATOM 757 SD MET A 51 -10.236 -5.687 4.618 1.00 0.00 S ATOM 758 CE MET A 51 -10.167 -3.912 4.238 1.00 0.00 C ATOM 0 H MET A 51 -13.218 -9.331 5.307 1.00 0.00 H new ATOM 0 HA MET A 51 -12.037 -7.127 6.382 1.00 0.00 H new ATOM 0 HB2 MET A 51 -11.916 -8.016 3.959 1.00 0.00 H new ATOM 0 HB3 MET A 51 -13.497 -7.310 3.688 1.00 0.00 H new ATOM 0 HG2 MET A 51 -11.912 -5.706 2.898 1.00 0.00 H new ATOM 0 HG3 MET A 51 -12.547 -5.070 4.403 1.00 0.00 H new ATOM 0 HE1 MET A 51 -9.197 -3.513 4.537 1.00 0.00 H new ATOM 0 HE2 MET A 51 -10.306 -3.763 3.167 1.00 0.00 H new ATOM 0 HE3 MET A 51 -10.956 -3.393 4.782 1.00 0.00 H new ATOM 768 N ILE A 52 -15.235 -6.785 5.803 1.00 0.00 N ATOM 769 CA ILE A 52 -16.388 -6.012 6.145 1.00 0.00 C ATOM 770 C ILE A 52 -16.499 -5.840 7.621 1.00 0.00 C ATOM 771 O ILE A 52 -16.581 -4.701 8.078 1.00 0.00 O ATOM 772 CB ILE A 52 -17.626 -6.682 5.627 1.00 0.00 C ATOM 773 CG1 ILE A 52 -17.712 -6.884 4.105 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.882 -5.954 6.135 1.00 0.00 C ATOM 775 CD1 ILE A 52 -18.959 -7.669 3.699 1.00 0.00 C ATOM 0 H ILE A 52 -15.450 -7.657 5.320 1.00 0.00 H new ATOM 0 HA ILE A 52 -16.283 -5.028 5.687 1.00 0.00 H new ATOM 0 HB ILE A 52 -17.566 -7.693 6.030 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -17.719 -5.913 3.611 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -16.823 -7.412 3.759 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.772 -6.452 5.750 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.898 -5.973 7.225 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -18.868 -4.920 5.790 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -18.978 -7.787 2.616 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -18.940 -8.651 4.171 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -19.850 -7.129 4.020 1.00 0.00 H new ATOM 787 N ASN A 53 -16.443 -6.907 8.438 1.00 0.00 N ATOM 788 CA ASN A 53 -16.612 -6.871 9.857 1.00 0.00 C ATOM 789 C ASN A 53 -15.591 -6.060 10.578 1.00 0.00 C ATOM 790 O ASN A 53 -15.954 -5.274 11.452 1.00 0.00 O ATOM 791 CB ASN A 53 -16.648 -8.299 10.427 1.00 0.00 C ATOM 792 CG ASN A 53 -17.962 -8.956 10.029 1.00 0.00 C ATOM 793 OD1 ASN A 53 -18.859 -8.306 9.496 1.00 0.00 O ATOM 794 ND2 ASN A 53 -18.152 -10.249 10.407 1.00 0.00 N ATOM 0 H ASN A 53 -16.270 -7.849 8.087 1.00 0.00 H new ATOM 0 HA ASN A 53 -17.566 -6.371 10.026 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -15.807 -8.878 10.046 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -16.553 -8.274 11.513 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -19.054 -10.699 10.250 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -17.393 -10.768 10.848 1.00 0.00 H new ATOM 801 N GLU A 54 -14.355 -6.135 10.053 1.00 0.00 N ATOM 802 CA GLU A 54 -13.206 -5.442 10.548 1.00 0.00 C ATOM 803 C GLU A 54 -13.414 -3.984 10.774 1.00 0.00 C ATOM 804 O GLU A 54 -13.293 -3.486 11.892 1.00 0.00 O ATOM 805 CB GLU A 54 -12.051 -5.747 9.579 1.00 0.00 C ATOM 806 CG GLU A 54 -10.717 -5.085 9.928 1.00 0.00 C ATOM 807 CD GLU A 54 -10.053 -5.783 11.107 1.00 0.00 C ATOM 808 OE1 GLU A 54 -9.594 -6.947 10.957 1.00 0.00 O ATOM 809 OE2 GLU A 54 -9.915 -5.174 12.201 1.00 0.00 O ATOM 0 H GLU A 54 -14.146 -6.711 9.238 1.00 0.00 H new ATOM 0 HA GLU A 54 -12.972 -5.801 11.550 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.904 -6.826 9.542 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -12.344 -5.431 8.578 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.055 -5.115 9.063 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.880 -4.034 10.168 1.00 0.00 H new ATOM 816 N VAL A 55 -13.832 -3.229 9.742 1.00 0.00 N ATOM 817 CA VAL A 55 -14.148 -1.834 9.757 1.00 0.00 C ATOM 818 C VAL A 55 -15.495 -1.489 10.293 1.00 0.00 C ATOM 819 O VAL A 55 -15.849 -0.351 10.597 1.00 0.00 O ATOM 820 CB VAL A 55 -13.909 -1.159 8.440 1.00 0.00 C ATOM 821 CG1 VAL A 55 -12.426 -1.028 8.053 1.00 0.00 C ATOM 822 CG2 VAL A 55 -14.543 -2.034 7.346 1.00 0.00 C ATOM 0 H VAL A 55 -13.960 -3.633 8.814 1.00 0.00 H new ATOM 0 HA VAL A 55 -13.435 -1.434 10.478 1.00 0.00 H new ATOM 0 HB VAL A 55 -14.330 -0.158 8.531 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.345 -0.529 7.087 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -11.903 -0.443 8.809 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -11.978 -2.020 7.988 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -14.386 -1.570 6.372 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -14.080 -3.021 7.356 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -15.612 -2.133 7.533 1.00 0.00 H new ATOM 832 N ASP A 56 -16.456 -2.429 10.352 1.00 0.00 N ATOM 833 CA ASP A 56 -17.837 -2.261 10.683 1.00 0.00 C ATOM 834 C ASP A 56 -17.965 -1.760 12.080 1.00 0.00 C ATOM 835 O ASP A 56 -17.870 -2.496 13.061 1.00 0.00 O ATOM 836 CB ASP A 56 -18.580 -3.602 10.561 1.00 0.00 C ATOM 837 CG ASP A 56 -20.098 -3.505 10.586 1.00 0.00 C ATOM 838 OD1 ASP A 56 -20.676 -2.461 10.180 1.00 0.00 O ATOM 839 OD2 ASP A 56 -20.676 -4.415 11.239 1.00 0.00 O ATOM 0 H ASP A 56 -16.241 -3.405 10.146 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.274 -1.541 9.992 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -18.278 -4.083 9.631 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -18.260 -4.252 11.375 1.00 0.00 H new ATOM 844 N ALA A 57 -18.449 -0.507 12.145 1.00 0.00 N ATOM 845 CA ALA A 57 -18.694 0.218 13.353 1.00 0.00 C ATOM 846 C ALA A 57 -19.951 -0.165 14.055 1.00 0.00 C ATOM 847 O ALA A 57 -20.004 -0.469 15.246 1.00 0.00 O ATOM 848 CB ALA A 57 -18.625 1.745 13.185 1.00 0.00 C ATOM 0 H ALA A 57 -18.682 0.029 11.309 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.864 -0.085 13.992 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.821 2.226 14.143 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -17.633 2.028 12.834 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -19.372 2.065 12.459 1.00 0.00 H new ATOM 854 N ASP A 58 -21.036 -0.153 13.259 1.00 0.00 N ATOM 855 CA ASP A 58 -22.358 -0.162 13.804 1.00 0.00 C ATOM 856 C ASP A 58 -22.842 -1.518 14.187 1.00 0.00 C ATOM 857 O ASP A 58 -23.710 -1.744 15.029 1.00 0.00 O ATOM 858 CB ASP A 58 -23.372 0.506 12.860 1.00 0.00 C ATOM 859 CG ASP A 58 -23.110 0.118 11.412 1.00 0.00 C ATOM 860 OD1 ASP A 58 -23.137 -1.120 11.178 1.00 0.00 O ATOM 861 OD2 ASP A 58 -22.769 0.952 10.531 1.00 0.00 O ATOM 0 H ASP A 58 -20.998 -0.137 12.240 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.284 0.422 14.721 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -24.383 0.213 13.141 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -23.313 1.589 12.966 1.00 0.00 H new ATOM 866 N GLY A 59 -22.301 -2.527 13.480 1.00 0.00 N ATOM 867 CA GLY A 59 -22.674 -3.890 13.701 1.00 0.00 C ATOM 868 C GLY A 59 -23.631 -4.554 12.771 1.00 0.00 C ATOM 869 O GLY A 59 -23.976 -5.708 13.019 1.00 0.00 O ATOM 0 H GLY A 59 -21.600 -2.397 12.750 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -21.759 -4.482 13.703 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -23.097 -3.953 14.704 1.00 0.00 H new ATOM 873 N ASN A 60 -23.987 -3.909 11.645 1.00 0.00 N ATOM 874 CA ASN A 60 -24.959 -4.449 10.745 1.00 0.00 C ATOM 875 C ASN A 60 -24.484 -5.434 9.733 1.00 0.00 C ATOM 876 O ASN A 60 -25.288 -6.021 9.011 1.00 0.00 O ATOM 877 CB ASN A 60 -25.845 -3.375 10.092 1.00 0.00 C ATOM 878 CG ASN A 60 -25.147 -2.432 9.121 1.00 0.00 C ATOM 879 OD1 ASN A 60 -23.931 -2.498 8.951 1.00 0.00 O ATOM 880 ND2 ASN A 60 -25.824 -1.447 8.472 1.00 0.00 N ATOM 0 H ASN A 60 -23.600 -3.010 11.357 1.00 0.00 H new ATOM 0 HA ASN A 60 -25.565 -5.045 11.427 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -26.656 -3.875 9.562 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -26.300 -2.778 10.882 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -25.322 -0.795 7.869 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -26.834 -1.360 8.588 1.00 0.00 H new ATOM 887 N GLY A 61 -23.165 -5.694 9.783 1.00 0.00 N ATOM 888 CA GLY A 61 -22.465 -6.567 8.892 1.00 0.00 C ATOM 889 C GLY A 61 -22.468 -6.267 7.433 1.00 0.00 C ATOM 890 O GLY A 61 -22.174 -7.122 6.598 1.00 0.00 O ATOM 0 H GLY A 61 -22.555 -5.272 10.483 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -21.425 -6.604 9.218 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -22.876 -7.568 9.022 1.00 0.00 H new ATOM 894 N THR A 62 -22.893 -5.036 7.099 1.00 0.00 N ATOM 895 CA THR A 62 -22.663 -4.481 5.801 1.00 0.00 C ATOM 896 C THR A 62 -21.885 -3.212 5.866 1.00 0.00 C ATOM 897 O THR A 62 -22.010 -2.514 6.871 1.00 0.00 O ATOM 898 CB THR A 62 -23.888 -4.271 4.961 1.00 0.00 C ATOM 899 OG1 THR A 62 -24.735 -3.274 5.514 1.00 0.00 O ATOM 900 CG2 THR A 62 -24.659 -5.601 4.950 1.00 0.00 C ATOM 0 H THR A 62 -23.400 -4.420 7.734 1.00 0.00 H new ATOM 0 HA THR A 62 -22.080 -5.254 5.300 1.00 0.00 H new ATOM 0 HB THR A 62 -23.590 -3.950 3.963 1.00 0.00 H new ATOM 0 HG1 THR A 62 -25.666 -3.468 5.278 1.00 0.00 H new ATOM 0 HG21 THR A 62 -25.561 -5.494 4.348 1.00 0.00 H new ATOM 0 HG22 THR A 62 -24.030 -6.383 4.524 1.00 0.00 H new ATOM 0 HG23 THR A 62 -24.933 -5.871 5.970 1.00 0.00 H new ATOM 908 N ILE A 63 -21.235 -2.913 4.727 1.00 0.00 N ATOM 909 CA ILE A 63 -20.639 -1.633 4.502 1.00 0.00 C ATOM 910 C ILE A 63 -21.592 -0.598 4.010 1.00 0.00 C ATOM 911 O ILE A 63 -22.156 -0.702 2.922 1.00 0.00 O ATOM 912 CB ILE A 63 -19.405 -1.746 3.656 1.00 0.00 C ATOM 913 CG1 ILE A 63 -18.379 -2.813 4.073 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.779 -0.343 3.594 1.00 0.00 C ATOM 915 CD1 ILE A 63 -17.223 -2.984 3.089 1.00 0.00 C ATOM 0 H ILE A 63 -21.122 -3.567 3.953 1.00 0.00 H new ATOM 0 HA ILE A 63 -20.328 -1.266 5.480 1.00 0.00 H new ATOM 0 HB ILE A 63 -19.716 -2.109 2.676 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -17.974 -2.550 5.050 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -18.890 -3.769 4.186 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -17.874 -0.375 2.987 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -19.490 0.353 3.150 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -18.528 -0.012 4.602 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -16.544 -3.754 3.455 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -17.615 -3.279 2.115 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -16.684 -2.041 2.993 1.00 0.00 H new ATOM 927 N ASP A 64 -21.949 0.377 4.864 1.00 0.00 N ATOM 928 CA ASP A 64 -22.745 1.524 4.555 1.00 0.00 C ATOM 929 C ASP A 64 -21.805 2.560 4.043 1.00 0.00 C ATOM 930 O ASP A 64 -20.591 2.365 4.006 1.00 0.00 O ATOM 931 CB ASP A 64 -23.512 2.048 5.781 1.00 0.00 C ATOM 932 CG ASP A 64 -24.123 0.922 6.603 1.00 0.00 C ATOM 933 OD1 ASP A 64 -23.403 0.195 7.339 1.00 0.00 O ATOM 934 OD2 ASP A 64 -25.364 0.771 6.447 1.00 0.00 O ATOM 0 H ASP A 64 -21.660 0.362 5.842 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.505 1.266 3.817 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -22.836 2.628 6.409 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -24.301 2.724 5.452 1.00 0.00 H new ATOM 939 N PHE A 65 -22.230 3.708 3.487 1.00 0.00 N ATOM 940 CA PHE A 65 -21.377 4.772 3.054 1.00 0.00 C ATOM 941 C PHE A 65 -20.420 5.338 4.046 1.00 0.00 C ATOM 942 O PHE A 65 -19.308 5.576 3.577 1.00 0.00 O ATOM 943 CB PHE A 65 -22.093 5.812 2.177 1.00 0.00 C ATOM 944 CG PHE A 65 -21.223 6.794 1.472 1.00 0.00 C ATOM 945 CD1 PHE A 65 -20.270 6.379 0.571 1.00 0.00 C ATOM 946 CD2 PHE A 65 -21.464 8.134 1.666 1.00 0.00 C ATOM 947 CE1 PHE A 65 -19.618 7.314 -0.198 1.00 0.00 C ATOM 948 CE2 PHE A 65 -20.785 9.066 0.918 1.00 0.00 C ATOM 949 CZ PHE A 65 -19.872 8.654 -0.023 1.00 0.00 C ATOM 0 H PHE A 65 -23.219 3.904 3.331 1.00 0.00 H new ATOM 0 HA PHE A 65 -20.681 4.254 2.394 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -22.684 5.281 1.431 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -22.793 6.364 2.804 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.036 5.330 0.469 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.185 8.453 2.404 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -18.904 6.995 -0.942 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -20.968 10.119 1.069 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.353 9.384 -0.626 1.00 0.00 H new ATOM 959 N PRO A 66 -20.545 5.588 5.316 1.00 0.00 N ATOM 960 CA PRO A 66 -19.538 6.226 6.112 1.00 0.00 C ATOM 961 C PRO A 66 -18.337 5.375 6.343 1.00 0.00 C ATOM 962 O PRO A 66 -17.219 5.860 6.514 1.00 0.00 O ATOM 963 CB PRO A 66 -20.233 6.620 7.414 1.00 0.00 C ATOM 964 CG PRO A 66 -21.611 7.045 6.881 1.00 0.00 C ATOM 965 CD PRO A 66 -21.860 5.972 5.808 1.00 0.00 C ATOM 0 HA PRO A 66 -19.135 7.096 5.593 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -20.299 5.789 8.116 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -19.719 7.432 7.928 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -22.374 7.034 7.659 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -21.598 8.051 6.462 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.386 5.114 6.228 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.480 6.363 5.001 1.00 0.00 H new ATOM 973 N GLU A 67 -18.459 4.036 6.330 1.00 0.00 N ATOM 974 CA GLU A 67 -17.375 3.120 6.503 1.00 0.00 C ATOM 975 C GLU A 67 -16.540 3.078 5.270 1.00 0.00 C ATOM 976 O GLU A 67 -15.312 3.012 5.314 1.00 0.00 O ATOM 977 CB GLU A 67 -17.768 1.682 6.881 1.00 0.00 C ATOM 978 CG GLU A 67 -18.333 1.525 8.294 1.00 0.00 C ATOM 979 CD GLU A 67 -19.536 0.604 8.443 1.00 0.00 C ATOM 980 OE1 GLU A 67 -20.125 0.024 7.493 1.00 0.00 O ATOM 981 OE2 GLU A 67 -19.847 0.378 9.643 1.00 0.00 O ATOM 0 H GLU A 67 -19.356 3.570 6.192 1.00 0.00 H new ATOM 0 HA GLU A 67 -16.824 3.512 7.358 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -18.508 1.322 6.166 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -16.891 1.042 6.782 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -17.537 1.155 8.941 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -18.611 2.512 8.663 1.00 0.00 H new ATOM 988 N PHE A 68 -17.184 3.335 4.117 1.00 0.00 N ATOM 989 CA PHE A 68 -16.508 3.471 2.864 1.00 0.00 C ATOM 990 C PHE A 68 -15.714 4.731 2.903 1.00 0.00 C ATOM 991 O PHE A 68 -14.607 4.800 2.371 1.00 0.00 O ATOM 992 CB PHE A 68 -17.484 3.447 1.675 1.00 0.00 C ATOM 993 CG PHE A 68 -16.760 3.273 0.385 1.00 0.00 C ATOM 994 CD1 PHE A 68 -16.325 2.075 -0.131 1.00 0.00 C ATOM 995 CD2 PHE A 68 -16.696 4.371 -0.441 1.00 0.00 C ATOM 996 CE1 PHE A 68 -15.700 2.022 -1.355 1.00 0.00 C ATOM 997 CE2 PHE A 68 -16.019 4.372 -1.638 1.00 0.00 C ATOM 998 CZ PHE A 68 -15.526 3.171 -2.090 1.00 0.00 C ATOM 0 H PHE A 68 -18.195 3.451 4.054 1.00 0.00 H new ATOM 0 HA PHE A 68 -15.843 2.620 2.714 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.200 2.635 1.805 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.055 4.375 1.652 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -16.476 1.165 0.431 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.201 5.275 -0.135 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -15.346 1.077 -1.739 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -15.880 5.282 -2.202 1.00 0.00 H new ATOM 0 HZ PHE A 68 -14.997 3.130 -3.031 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.197 5.812 3.540 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.385 6.954 3.825 1.00 0.00 C ATOM 1010 C LEU A 69 -14.211 6.902 4.742 1.00 0.00 C ATOM 1011 O LEU A 69 -13.155 7.501 4.545 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.204 8.198 4.208 1.00 0.00 C ATOM 1013 CG LEU A 69 -17.283 8.583 3.182 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -18.083 9.789 3.704 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -16.745 8.715 1.747 1.00 0.00 C ATOM 0 H LEU A 69 -17.162 5.895 3.861 1.00 0.00 H new ATOM 0 HA LEU A 69 -14.921 6.990 2.839 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -16.681 8.022 5.172 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.525 9.041 4.338 1.00 0.00 H new ATOM 0 HG LEU A 69 -17.990 7.759 3.084 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -18.847 10.061 2.976 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.559 9.528 4.650 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -17.411 10.633 3.857 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.560 8.988 1.077 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -15.976 9.487 1.716 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -16.318 7.764 1.430 1.00 0.00 H new ATOM 1027 N THR A 70 -14.385 6.064 5.779 1.00 0.00 N ATOM 1028 CA THR A 70 -13.403 5.668 6.740 1.00 0.00 C ATOM 1029 C THR A 70 -12.229 5.020 6.092 1.00 0.00 C ATOM 1030 O THR A 70 -11.067 5.347 6.329 1.00 0.00 O ATOM 1031 CB THR A 70 -13.994 4.791 7.804 1.00 0.00 C ATOM 1032 OG1 THR A 70 -14.999 5.533 8.478 1.00 0.00 O ATOM 1033 CG2 THR A 70 -13.030 4.372 8.927 1.00 0.00 C ATOM 0 H THR A 70 -15.289 5.628 5.959 1.00 0.00 H new ATOM 0 HA THR A 70 -13.046 6.576 7.226 1.00 0.00 H new ATOM 0 HB THR A 70 -14.328 3.899 7.274 1.00 0.00 H new ATOM 0 HG1 THR A 70 -15.779 5.633 7.893 1.00 0.00 H new ATOM 0 HG21 THR A 70 -13.557 3.741 9.642 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.194 3.817 8.501 1.00 0.00 H new ATOM 0 HG23 THR A 70 -12.655 5.261 9.435 1.00 0.00 H new ATOM 1041 N MET A 71 -12.601 4.140 5.144 1.00 0.00 N ATOM 1042 CA MET A 71 -11.706 3.372 4.336 1.00 0.00 C ATOM 1043 C MET A 71 -10.940 4.347 3.510 1.00 0.00 C ATOM 1044 O MET A 71 -9.715 4.295 3.608 1.00 0.00 O ATOM 1045 CB MET A 71 -12.424 2.438 3.347 1.00 0.00 C ATOM 1046 CG MET A 71 -12.916 1.165 4.038 1.00 0.00 C ATOM 1047 SD MET A 71 -13.975 0.084 3.031 1.00 0.00 S ATOM 1048 CE MET A 71 -13.460 -1.472 3.811 1.00 0.00 C ATOM 0 H MET A 71 -13.581 3.955 4.931 1.00 0.00 H new ATOM 0 HA MET A 71 -11.098 2.758 5.000 1.00 0.00 H new ATOM 0 HB2 MET A 71 -13.269 2.960 2.899 1.00 0.00 H new ATOM 0 HB3 MET A 71 -11.746 2.174 2.535 1.00 0.00 H new ATOM 0 HG2 MET A 71 -12.048 0.592 4.365 1.00 0.00 H new ATOM 0 HG3 MET A 71 -13.466 1.449 4.935 1.00 0.00 H new ATOM 0 HE1 MET A 71 -12.820 -2.028 3.126 1.00 0.00 H new ATOM 0 HE2 MET A 71 -12.910 -1.255 4.727 1.00 0.00 H new ATOM 0 HE3 MET A 71 -14.341 -2.068 4.050 1.00 0.00 H new ATOM 1058 N MET A 72 -11.610 5.124 2.641 1.00 0.00 N ATOM 1059 CA MET A 72 -11.067 6.067 1.713 1.00 0.00 C ATOM 1060 C MET A 72 -10.248 7.145 2.336 1.00 0.00 C ATOM 1061 O MET A 72 -9.229 7.524 1.761 1.00 0.00 O ATOM 1062 CB MET A 72 -12.210 6.714 0.912 1.00 0.00 C ATOM 1063 CG MET A 72 -12.924 5.908 -0.174 1.00 0.00 C ATOM 1064 SD MET A 72 -11.648 5.249 -1.290 1.00 0.00 S ATOM 1065 CE MET A 72 -11.950 3.542 -0.750 1.00 0.00 C ATOM 0 H MET A 72 -12.628 5.087 2.584 1.00 0.00 H new ATOM 0 HA MET A 72 -10.394 5.498 1.072 1.00 0.00 H new ATOM 0 HB2 MET A 72 -12.966 7.038 1.627 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.810 7.612 0.441 1.00 0.00 H new ATOM 0 HG2 MET A 72 -13.503 5.097 0.268 1.00 0.00 H new ATOM 0 HG3 MET A 72 -13.625 6.538 -0.722 1.00 0.00 H new ATOM 0 HE1 MET A 72 -11.053 2.945 -0.912 1.00 0.00 H new ATOM 0 HE2 MET A 72 -12.204 3.535 0.310 1.00 0.00 H new ATOM 0 HE3 MET A 72 -12.775 3.120 -1.323 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.556 7.739 3.502 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.720 8.676 4.187 1.00 0.00 C ATOM 1077 C ALA A 73 -8.405 8.170 4.671 1.00 0.00 C ATOM 1078 O ALA A 73 -7.417 8.881 4.844 1.00 0.00 O ATOM 1079 CB ALA A 73 -10.619 9.212 5.313 1.00 0.00 C ATOM 0 H ALA A 73 -11.432 7.557 3.992 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.378 9.447 3.497 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.067 9.944 5.902 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.501 9.685 4.881 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.928 8.388 5.956 1.00 0.00 H new ATOM 1234 N GLU A 83 -0.846 2.753 -6.358 1.00 0.00 N ATOM 1235 CA GLU A 83 -0.781 2.428 -7.749 1.00 0.00 C ATOM 1236 C GLU A 83 0.550 1.969 -8.238 1.00 0.00 C ATOM 1237 O GLU A 83 0.682 1.115 -9.113 1.00 0.00 O ATOM 1238 CB GLU A 83 -1.104 3.661 -8.610 1.00 0.00 C ATOM 1239 CG GLU A 83 -2.549 4.150 -8.488 1.00 0.00 C ATOM 1240 CD GLU A 83 -2.929 4.850 -9.785 1.00 0.00 C ATOM 1241 OE1 GLU A 83 -2.361 5.937 -10.073 1.00 0.00 O ATOM 1242 OE2 GLU A 83 -3.875 4.307 -10.416 1.00 0.00 O ATOM 0 HA GLU A 83 -1.500 1.615 -7.845 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.433 4.472 -8.329 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.899 3.425 -9.654 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -3.219 3.311 -8.299 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -2.648 4.833 -7.645 1.00 0.00 H new ATOM 1249 N GLU A 84 1.625 2.489 -7.618 1.00 0.00 N ATOM 1250 CA GLU A 84 2.954 2.061 -7.926 1.00 0.00 C ATOM 1251 C GLU A 84 3.178 0.651 -7.501 1.00 0.00 C ATOM 1252 O GLU A 84 3.667 -0.109 -8.336 1.00 0.00 O ATOM 1253 CB GLU A 84 3.938 3.065 -7.300 1.00 0.00 C ATOM 1254 CG GLU A 84 5.328 3.119 -7.937 1.00 0.00 C ATOM 1255 CD GLU A 84 6.295 4.190 -7.453 1.00 0.00 C ATOM 1256 OE1 GLU A 84 6.585 4.070 -6.233 1.00 0.00 O ATOM 1257 OE2 GLU A 84 6.818 5.088 -8.166 1.00 0.00 O ATOM 0 H GLU A 84 1.572 3.210 -6.899 1.00 0.00 H new ATOM 0 HA GLU A 84 3.120 2.055 -9.003 1.00 0.00 H new ATOM 0 HB2 GLU A 84 3.496 4.060 -7.353 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.052 2.823 -6.243 1.00 0.00 H new ATOM 0 HG2 GLU A 84 5.802 2.149 -7.787 1.00 0.00 H new ATOM 0 HG3 GLU A 84 5.198 3.248 -9.012 1.00 0.00 H new ATOM 1264 N ILE A 85 2.755 0.239 -6.293 1.00 0.00 N ATOM 1265 CA ILE A 85 2.941 -1.088 -5.793 1.00 0.00 C ATOM 1266 C ILE A 85 2.058 -2.093 -6.448 1.00 0.00 C ATOM 1267 O ILE A 85 2.393 -3.259 -6.653 1.00 0.00 O ATOM 1268 CB ILE A 85 2.981 -1.305 -4.309 1.00 0.00 C ATOM 1269 CG1 ILE A 85 1.571 -1.345 -3.695 1.00 0.00 C ATOM 1270 CG2 ILE A 85 3.906 -0.200 -3.774 1.00 0.00 C ATOM 1271 CD1 ILE A 85 1.562 -1.249 -2.170 1.00 0.00 C ATOM 0 H ILE A 85 2.266 0.852 -5.641 1.00 0.00 H new ATOM 0 HA ILE A 85 3.977 -1.249 -6.090 1.00 0.00 H new ATOM 0 HB ILE A 85 3.379 -2.280 -4.027 1.00 0.00 H new ATOM 0 HG12 ILE A 85 0.982 -0.525 -4.105 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.080 -2.271 -3.995 1.00 0.00 H new ATOM 0 HG21 ILE A 85 3.989 -0.288 -2.691 1.00 0.00 H new ATOM 0 HG22 ILE A 85 4.894 -0.303 -4.223 1.00 0.00 H new ATOM 0 HG23 ILE A 85 3.492 0.776 -4.028 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.534 -1.284 -1.809 1.00 0.00 H new ATOM 0 HD12 ILE A 85 2.122 -2.084 -1.750 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.023 -0.311 -1.862 1.00 0.00 H new ATOM 1283 N ARG A 86 0.841 -1.757 -6.912 1.00 0.00 N ATOM 1284 CA ARG A 86 -0.038 -2.696 -7.537 1.00 0.00 C ATOM 1285 C ARG A 86 0.445 -3.074 -8.894 1.00 0.00 C ATOM 1286 O ARG A 86 0.445 -4.217 -9.348 1.00 0.00 O ATOM 1287 CB ARG A 86 -1.449 -2.085 -7.594 1.00 0.00 C ATOM 1288 CG ARG A 86 -2.359 -3.276 -7.899 1.00 0.00 C ATOM 1289 CD ARG A 86 -3.856 -2.983 -7.775 1.00 0.00 C ATOM 1290 NE ARG A 86 -4.509 -4.219 -8.288 1.00 0.00 N ATOM 1291 CZ ARG A 86 -4.861 -4.431 -9.590 1.00 0.00 C ATOM 1292 NH1 ARG A 86 -4.457 -3.569 -10.568 1.00 0.00 N ATOM 1293 NH2 ARG A 86 -5.511 -5.579 -9.940 1.00 0.00 N ATOM 0 H ARG A 86 0.460 -0.813 -6.852 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.063 -3.614 -6.950 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -1.716 -1.611 -6.650 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -1.521 -1.320 -8.367 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -2.153 -3.624 -8.911 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -2.105 -4.093 -7.223 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -4.139 -2.782 -6.742 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -4.141 -2.109 -8.360 1.00 0.00 H new ATOM 0 HE ARG A 86 -4.708 -4.962 -7.618 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -3.887 -2.758 -10.329 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -4.725 -3.736 -11.538 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -5.733 -6.276 -9.229 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -5.775 -5.740 -10.912 1.00 0.00 H new ATOM 1307 N GLU A 87 1.009 -2.060 -9.575 1.00 0.00 N ATOM 1308 CA GLU A 87 1.745 -2.478 -10.727 1.00 0.00 C ATOM 1309 C GLU A 87 3.055 -3.142 -10.476 1.00 0.00 C ATOM 1310 O GLU A 87 3.471 -3.995 -11.259 1.00 0.00 O ATOM 1311 CB GLU A 87 1.926 -1.282 -11.677 1.00 0.00 C ATOM 1312 CG GLU A 87 2.918 -1.463 -12.828 1.00 0.00 C ATOM 1313 CD GLU A 87 2.894 -0.208 -13.689 1.00 0.00 C ATOM 1314 OE1 GLU A 87 3.650 0.756 -13.395 1.00 0.00 O ATOM 1315 OE2 GLU A 87 2.052 -0.122 -14.623 1.00 0.00 O ATOM 0 H GLU A 87 0.969 -1.063 -9.365 1.00 0.00 H new ATOM 0 HA GLU A 87 1.138 -3.264 -11.176 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.953 -1.035 -12.102 1.00 0.00 H new ATOM 0 HB3 GLU A 87 2.243 -0.423 -11.086 1.00 0.00 H new ATOM 0 HG2 GLU A 87 3.921 -1.636 -12.439 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.652 -2.336 -13.424 1.00 0.00 H new ATOM 1322 N ALA A 88 3.725 -2.899 -9.336 1.00 0.00 N ATOM 1323 CA ALA A 88 4.985 -3.505 -9.033 1.00 0.00 C ATOM 1324 C ALA A 88 4.818 -4.939 -8.665 1.00 0.00 C ATOM 1325 O ALA A 88 5.607 -5.794 -9.064 1.00 0.00 O ATOM 1326 CB ALA A 88 5.651 -2.805 -7.837 1.00 0.00 C ATOM 0 H ALA A 88 3.385 -2.269 -8.609 1.00 0.00 H new ATOM 0 HA ALA A 88 5.601 -3.413 -9.928 1.00 0.00 H new ATOM 0 HB1 ALA A 88 6.608 -3.281 -7.623 1.00 0.00 H new ATOM 0 HB2 ALA A 88 5.814 -1.754 -8.075 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.004 -2.883 -6.963 1.00 0.00 H new ATOM 1332 N PHE A 89 3.730 -5.328 -7.976 1.00 0.00 N ATOM 1333 CA PHE A 89 3.347 -6.680 -7.714 1.00 0.00 C ATOM 1334 C PHE A 89 3.229 -7.516 -8.942 1.00 0.00 C ATOM 1335 O PHE A 89 3.695 -8.651 -9.030 1.00 0.00 O ATOM 1336 CB PHE A 89 1.964 -6.737 -7.044 1.00 0.00 C ATOM 1337 CG PHE A 89 1.607 -8.074 -6.491 1.00 0.00 C ATOM 1338 CD1 PHE A 89 2.328 -8.594 -5.442 1.00 0.00 C ATOM 1339 CD2 PHE A 89 0.578 -8.729 -7.125 1.00 0.00 C ATOM 1340 CE1 PHE A 89 1.945 -9.810 -4.927 1.00 0.00 C ATOM 1341 CE2 PHE A 89 0.227 -9.936 -6.567 1.00 0.00 C ATOM 1342 CZ PHE A 89 0.867 -10.468 -5.473 1.00 0.00 C ATOM 0 H PHE A 89 3.077 -4.654 -7.577 1.00 0.00 H new ATOM 0 HA PHE A 89 4.141 -7.068 -7.076 1.00 0.00 H new ATOM 0 HB2 PHE A 89 1.932 -6.003 -6.239 1.00 0.00 H new ATOM 0 HB3 PHE A 89 1.208 -6.444 -7.772 1.00 0.00 H new ATOM 0 HD1 PHE A 89 3.174 -8.061 -5.033 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.082 -8.326 -7.996 1.00 0.00 H new ATOM 0 HE1 PHE A 89 2.486 -10.245 -4.100 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -0.588 -10.491 -7.008 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.525 -11.398 -5.044 1.00 0.00 H new ATOM 1352 N ARG A 90 2.643 -6.928 -9.999 1.00 0.00 N ATOM 1353 CA ARG A 90 2.486 -7.543 -11.280 1.00 0.00 C ATOM 1354 C ARG A 90 3.710 -7.627 -12.126 1.00 0.00 C ATOM 1355 O ARG A 90 3.920 -8.579 -12.877 1.00 0.00 O ATOM 1356 CB ARG A 90 1.324 -6.877 -12.037 1.00 0.00 C ATOM 1357 CG ARG A 90 0.917 -7.676 -13.276 1.00 0.00 C ATOM 1358 CD ARG A 90 -0.199 -7.063 -14.125 1.00 0.00 C ATOM 1359 NE ARG A 90 0.513 -5.879 -14.683 1.00 0.00 N ATOM 1360 CZ ARG A 90 -0.050 -4.942 -15.501 1.00 0.00 C ATOM 1361 NH1 ARG A 90 -1.381 -4.878 -15.795 1.00 0.00 N ATOM 1362 NH2 ARG A 90 0.780 -3.987 -16.013 1.00 0.00 N ATOM 0 H ARG A 90 2.262 -5.983 -9.959 1.00 0.00 H new ATOM 0 HA ARG A 90 2.258 -8.588 -11.068 1.00 0.00 H new ATOM 0 HB2 ARG A 90 0.467 -6.778 -11.371 1.00 0.00 H new ATOM 0 HB3 ARG A 90 1.615 -5.869 -12.334 1.00 0.00 H new ATOM 0 HG2 ARG A 90 1.797 -7.807 -13.906 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.602 -8.670 -12.957 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.550 -7.741 -14.903 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.068 -6.783 -13.530 1.00 0.00 H new ATOM 0 HE ARG A 90 1.495 -5.759 -14.435 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -2.025 -5.560 -15.394 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -1.732 -4.148 -16.416 1.00 0.00 H new ATOM 0 HH21 ARG A 90 1.773 -3.996 -15.779 1.00 0.00 H new ATOM 0 HH22 ARG A 90 0.407 -3.265 -16.629 1.00 0.00 H new ATOM 1376 N VAL A 91 4.665 -6.714 -11.876 1.00 0.00 N ATOM 1377 CA VAL A 91 5.999 -6.762 -12.390 1.00 0.00 C ATOM 1378 C VAL A 91 6.728 -7.866 -11.706 1.00 0.00 C ATOM 1379 O VAL A 91 7.363 -8.725 -12.318 1.00 0.00 O ATOM 1380 CB VAL A 91 6.781 -5.505 -12.149 1.00 0.00 C ATOM 1381 CG1 VAL A 91 8.298 -5.676 -12.330 1.00 0.00 C ATOM 1382 CG2 VAL A 91 6.420 -4.436 -13.194 1.00 0.00 C ATOM 0 H VAL A 91 4.498 -5.900 -11.285 1.00 0.00 H new ATOM 0 HA VAL A 91 5.913 -6.905 -13.467 1.00 0.00 H new ATOM 0 HB VAL A 91 6.534 -5.233 -11.123 1.00 0.00 H new ATOM 0 HG11 VAL A 91 8.797 -4.726 -12.139 1.00 0.00 H new ATOM 0 HG12 VAL A 91 8.666 -6.426 -11.629 1.00 0.00 H new ATOM 0 HG13 VAL A 91 8.509 -5.998 -13.350 1.00 0.00 H new ATOM 0 HG21 VAL A 91 6.997 -3.531 -13.003 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.651 -4.810 -14.192 1.00 0.00 H new ATOM 0 HG23 VAL A 91 5.356 -4.208 -13.129 1.00 0.00 H new ATOM 1392 N PHE A 92 6.647 -7.991 -10.370 1.00 0.00 N ATOM 1393 CA PHE A 92 7.375 -8.963 -9.614 1.00 0.00 C ATOM 1394 C PHE A 92 6.815 -10.338 -9.728 1.00 0.00 C ATOM 1395 O PHE A 92 7.537 -11.308 -9.504 1.00 0.00 O ATOM 1396 CB PHE A 92 7.421 -8.570 -8.128 1.00 0.00 C ATOM 1397 CG PHE A 92 7.976 -7.216 -7.849 1.00 0.00 C ATOM 1398 CD1 PHE A 92 8.937 -6.737 -8.708 1.00 0.00 C ATOM 1399 CD2 PHE A 92 7.670 -6.486 -6.725 1.00 0.00 C ATOM 1400 CE1 PHE A 92 9.493 -5.492 -8.530 1.00 0.00 C ATOM 1401 CE2 PHE A 92 8.237 -5.245 -6.550 1.00 0.00 C ATOM 1402 CZ PHE A 92 9.164 -4.737 -7.429 1.00 0.00 C ATOM 0 H PHE A 92 6.053 -7.394 -9.795 1.00 0.00 H new ATOM 0 HA PHE A 92 8.379 -8.977 -10.038 1.00 0.00 H new ATOM 0 HB2 PHE A 92 6.410 -8.622 -7.723 1.00 0.00 H new ATOM 0 HB3 PHE A 92 8.018 -9.308 -7.591 1.00 0.00 H new ATOM 0 HD1 PHE A 92 9.261 -7.349 -9.537 1.00 0.00 H new ATOM 0 HD2 PHE A 92 6.990 -6.883 -5.986 1.00 0.00 H new ATOM 0 HE1 PHE A 92 10.191 -5.106 -9.258 1.00 0.00 H new ATOM 0 HE2 PHE A 92 7.945 -4.652 -5.696 1.00 0.00 H new ATOM 0 HZ PHE A 92 9.620 -3.773 -7.260 1.00 0.00 H new ATOM 1412 N ASP A 93 5.499 -10.532 -9.932 1.00 0.00 N ATOM 1413 CA ASP A 93 4.871 -11.780 -10.237 1.00 0.00 C ATOM 1414 C ASP A 93 5.204 -12.219 -11.622 1.00 0.00 C ATOM 1415 O ASP A 93 4.721 -11.708 -12.631 1.00 0.00 O ATOM 1416 CB ASP A 93 3.353 -11.628 -10.041 1.00 0.00 C ATOM 1417 CG ASP A 93 2.721 -13.011 -10.102 1.00 0.00 C ATOM 1418 OD1 ASP A 93 3.361 -14.079 -10.293 1.00 0.00 O ATOM 1419 OD2 ASP A 93 1.477 -12.994 -9.904 1.00 0.00 O ATOM 0 H ASP A 93 4.830 -9.764 -9.880 1.00 0.00 H new ATOM 0 HA ASP A 93 5.242 -12.554 -9.565 1.00 0.00 H new ATOM 0 HB2 ASP A 93 3.140 -11.155 -9.082 1.00 0.00 H new ATOM 0 HB3 ASP A 93 2.933 -10.985 -10.814 1.00 0.00 H new ATOM 1424 N LYS A 94 6.050 -13.260 -11.714 1.00 0.00 N ATOM 1425 CA LYS A 94 6.673 -13.586 -12.960 1.00 0.00 C ATOM 1426 C LYS A 94 5.712 -14.338 -13.815 1.00 0.00 C ATOM 1427 O LYS A 94 5.536 -14.068 -15.002 1.00 0.00 O ATOM 1428 CB LYS A 94 7.963 -14.360 -12.642 1.00 0.00 C ATOM 1429 CG LYS A 94 8.806 -14.752 -13.857 1.00 0.00 C ATOM 1430 CD LYS A 94 9.294 -13.578 -14.708 1.00 0.00 C ATOM 1431 CE LYS A 94 10.111 -12.518 -13.967 1.00 0.00 C ATOM 1432 NZ LYS A 94 10.548 -11.347 -14.759 1.00 0.00 N ATOM 0 H LYS A 94 6.301 -13.870 -10.936 1.00 0.00 H new ATOM 0 HA LYS A 94 6.947 -12.700 -13.532 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.576 -13.754 -11.975 1.00 0.00 H new ATOM 0 HB3 LYS A 94 7.699 -15.266 -12.096 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.672 -15.317 -13.513 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.219 -15.420 -14.488 1.00 0.00 H new ATOM 0 HD2 LYS A 94 9.899 -13.972 -15.525 1.00 0.00 H new ATOM 0 HD3 LYS A 94 8.427 -13.094 -15.158 1.00 0.00 H new ATOM 0 HE2 LYS A 94 9.519 -12.159 -13.125 1.00 0.00 H new ATOM 0 HE3 LYS A 94 10.997 -12.999 -13.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 11.091 -10.700 -14.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 11.146 -11.665 -15.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.714 -10.851 -15.134 1.00 0.00 H new ATOM 1446 N ASP A 95 4.971 -15.312 -13.257 1.00 0.00 N ATOM 1447 CA ASP A 95 4.160 -16.270 -13.942 1.00 0.00 C ATOM 1448 C ASP A 95 2.724 -15.916 -14.124 1.00 0.00 C ATOM 1449 O ASP A 95 2.019 -16.447 -14.981 1.00 0.00 O ATOM 1450 CB ASP A 95 4.395 -17.573 -13.159 1.00 0.00 C ATOM 1451 CG ASP A 95 4.205 -17.340 -11.667 1.00 0.00 C ATOM 1452 OD1 ASP A 95 3.074 -17.357 -11.111 1.00 0.00 O ATOM 1453 OD2 ASP A 95 5.193 -17.083 -10.929 1.00 0.00 O ATOM 0 H ASP A 95 4.938 -15.438 -12.245 1.00 0.00 H new ATOM 0 HA ASP A 95 4.455 -16.343 -14.989 1.00 0.00 H new ATOM 0 HB2 ASP A 95 3.703 -18.341 -13.504 1.00 0.00 H new ATOM 0 HB3 ASP A 95 5.403 -17.942 -13.350 1.00 0.00 H new ATOM 1458 N GLY A 96 2.256 -15.072 -13.188 1.00 0.00 N ATOM 1459 CA GLY A 96 0.975 -14.462 -13.367 1.00 0.00 C ATOM 1460 C GLY A 96 -0.039 -15.247 -12.609 1.00 0.00 C ATOM 1461 O GLY A 96 -1.177 -15.343 -13.066 1.00 0.00 O ATOM 0 H GLY A 96 2.747 -14.817 -12.331 1.00 0.00 H new ATOM 0 HA2 GLY A 96 0.995 -13.431 -13.014 1.00 0.00 H new ATOM 0 HA3 GLY A 96 0.716 -14.432 -14.425 1.00 0.00 H new ATOM 1465 N ASN A 97 0.223 -15.827 -11.424 1.00 0.00 N ATOM 1466 CA ASN A 97 -0.779 -16.578 -10.733 1.00 0.00 C ATOM 1467 C ASN A 97 -1.590 -15.676 -9.868 1.00 0.00 C ATOM 1468 O ASN A 97 -2.726 -16.025 -9.549 1.00 0.00 O ATOM 1469 CB ASN A 97 -0.179 -17.762 -9.957 1.00 0.00 C ATOM 1470 CG ASN A 97 0.820 -17.467 -8.847 1.00 0.00 C ATOM 1471 OD1 ASN A 97 1.517 -16.464 -8.701 1.00 0.00 O ATOM 1472 ND2 ASN A 97 0.935 -18.489 -7.957 1.00 0.00 N ATOM 0 H ASN A 97 1.123 -15.777 -10.947 1.00 0.00 H new ATOM 0 HA ASN A 97 -1.449 -17.020 -11.471 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -1.004 -18.325 -9.521 1.00 0.00 H new ATOM 0 HB3 ASN A 97 0.309 -18.418 -10.678 1.00 0.00 H new ATOM 0 HD21 ASN A 97 1.593 -18.418 -7.181 1.00 0.00 H new ATOM 0 HD22 ASN A 97 0.363 -19.327 -8.066 1.00 0.00 H new ATOM 1479 N GLY A 98 -1.098 -14.565 -9.290 1.00 0.00 N ATOM 1480 CA GLY A 98 -1.700 -13.813 -8.233 1.00 0.00 C ATOM 1481 C GLY A 98 -0.837 -13.617 -7.035 1.00 0.00 C ATOM 1482 O GLY A 98 -1.227 -12.880 -6.131 1.00 0.00 O ATOM 0 H GLY A 98 -0.209 -14.162 -9.587 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.988 -12.835 -8.620 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -2.617 -14.316 -7.925 1.00 0.00 H new ATOM 1486 N TYR A 99 0.278 -14.370 -7.011 1.00 0.00 N ATOM 1487 CA TYR A 99 1.110 -14.508 -5.856 1.00 0.00 C ATOM 1488 C TYR A 99 2.547 -14.353 -6.218 1.00 0.00 C ATOM 1489 O TYR A 99 3.020 -14.783 -7.268 1.00 0.00 O ATOM 1490 CB TYR A 99 1.065 -15.891 -5.184 1.00 0.00 C ATOM 1491 CG TYR A 99 -0.344 -16.257 -4.865 1.00 0.00 C ATOM 1492 CD1 TYR A 99 -1.197 -16.807 -5.792 1.00 0.00 C ATOM 1493 CD2 TYR A 99 -0.795 -15.991 -3.593 1.00 0.00 C ATOM 1494 CE1 TYR A 99 -2.448 -17.175 -5.357 1.00 0.00 C ATOM 1495 CE2 TYR A 99 -2.054 -16.361 -3.181 1.00 0.00 C ATOM 1496 CZ TYR A 99 -2.921 -16.913 -4.093 1.00 0.00 C ATOM 1497 OH TYR A 99 -4.270 -17.105 -3.725 1.00 0.00 O ATOM 0 H TYR A 99 0.610 -14.898 -7.818 1.00 0.00 H new ATOM 0 HA TYR A 99 0.723 -13.743 -5.184 1.00 0.00 H new ATOM 0 HB2 TYR A 99 1.503 -16.640 -5.844 1.00 0.00 H new ATOM 0 HB3 TYR A 99 1.662 -15.881 -4.272 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.897 -16.944 -6.820 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -0.144 -15.479 -2.900 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -3.095 -17.698 -6.046 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.357 -16.220 -2.154 1.00 0.00 H new ATOM 0 HH TYR A 99 -4.390 -16.860 -2.784 1.00 0.00 H new ATOM 1507 N ILE A 100 3.351 -13.638 -5.411 1.00 0.00 N ATOM 1508 CA ILE A 100 4.764 -13.660 -5.635 1.00 0.00 C ATOM 1509 C ILE A 100 5.299 -14.692 -4.703 1.00 0.00 C ATOM 1510 O ILE A 100 5.184 -14.512 -3.492 1.00 0.00 O ATOM 1511 CB ILE A 100 5.448 -12.345 -5.405 1.00 0.00 C ATOM 1512 CG1 ILE A 100 4.781 -11.265 -6.273 1.00 0.00 C ATOM 1513 CG2 ILE A 100 6.914 -12.500 -5.843 1.00 0.00 C ATOM 1514 CD1 ILE A 100 5.191 -9.931 -5.650 1.00 0.00 C ATOM 0 H ILE A 100 3.038 -13.063 -4.629 1.00 0.00 H new ATOM 0 HA ILE A 100 4.957 -13.884 -6.684 1.00 0.00 H new ATOM 0 HB ILE A 100 5.382 -12.057 -4.356 1.00 0.00 H new ATOM 0 HG12 ILE A 100 5.113 -11.333 -7.309 1.00 0.00 H new ATOM 0 HG13 ILE A 100 3.697 -11.379 -6.278 1.00 0.00 H new ATOM 0 HG21 ILE A 100 7.441 -11.559 -5.688 1.00 0.00 H new ATOM 0 HG22 ILE A 100 7.389 -13.283 -5.253 1.00 0.00 H new ATOM 0 HG23 ILE A 100 6.952 -12.768 -6.899 1.00 0.00 H new ATOM 0 HD11 ILE A 100 4.750 -9.113 -6.219 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.839 -9.887 -4.619 1.00 0.00 H new ATOM 0 HD13 ILE A 100 6.277 -9.840 -5.666 1.00 0.00 H new ATOM 1526 N SER A 101 5.916 -15.828 -5.075 1.00 0.00 N ATOM 1527 CA SER A 101 6.413 -16.829 -4.184 1.00 0.00 C ATOM 1528 C SER A 101 7.643 -16.352 -3.493 1.00 0.00 C ATOM 1529 O SER A 101 8.338 -15.456 -3.969 1.00 0.00 O ATOM 1530 CB SER A 101 6.766 -18.119 -4.943 1.00 0.00 C ATOM 1531 OG SER A 101 7.713 -18.018 -5.997 1.00 0.00 O ATOM 0 H SER A 101 6.077 -16.060 -6.055 1.00 0.00 H new ATOM 0 HA SER A 101 5.626 -17.031 -3.458 1.00 0.00 H new ATOM 0 HB2 SER A 101 7.142 -18.843 -4.220 1.00 0.00 H new ATOM 0 HB3 SER A 101 5.845 -18.530 -5.356 1.00 0.00 H new ATOM 0 HG SER A 101 7.384 -17.390 -6.674 1.00 0.00 H new ATOM 1537 N ALA A 102 7.971 -16.924 -2.321 1.00 0.00 N ATOM 1538 CA ALA A 102 9.227 -16.688 -1.678 1.00 0.00 C ATOM 1539 C ALA A 102 10.445 -16.669 -2.535 1.00 0.00 C ATOM 1540 O ALA A 102 11.306 -15.820 -2.307 1.00 0.00 O ATOM 1541 CB ALA A 102 9.382 -17.600 -0.449 1.00 0.00 C ATOM 0 H ALA A 102 7.356 -17.559 -1.812 1.00 0.00 H new ATOM 0 HA ALA A 102 9.170 -15.646 -1.362 1.00 0.00 H new ATOM 0 HB1 ALA A 102 10.343 -17.407 0.028 1.00 0.00 H new ATOM 0 HB2 ALA A 102 8.578 -17.397 0.259 1.00 0.00 H new ATOM 0 HB3 ALA A 102 9.335 -18.643 -0.762 1.00 0.00 H new ATOM 1547 N ALA A 103 10.559 -17.522 -3.568 1.00 0.00 N ATOM 1548 CA ALA A 103 11.574 -17.596 -4.574 1.00 0.00 C ATOM 1549 C ALA A 103 11.716 -16.350 -5.379 1.00 0.00 C ATOM 1550 O ALA A 103 12.790 -15.766 -5.515 1.00 0.00 O ATOM 1551 CB ALA A 103 11.323 -18.772 -5.532 1.00 0.00 C ATOM 0 H ALA A 103 9.854 -18.245 -3.712 1.00 0.00 H new ATOM 0 HA ALA A 103 12.503 -17.743 -4.024 1.00 0.00 H new ATOM 0 HB1 ALA A 103 12.110 -18.802 -6.285 1.00 0.00 H new ATOM 0 HB2 ALA A 103 11.323 -19.706 -4.970 1.00 0.00 H new ATOM 0 HB3 ALA A 103 10.358 -18.643 -6.021 1.00 0.00 H new ATOM 1557 N GLU A 104 10.550 -15.989 -5.943 1.00 0.00 N ATOM 1558 CA GLU A 104 10.380 -14.847 -6.787 1.00 0.00 C ATOM 1559 C GLU A 104 10.710 -13.616 -6.016 1.00 0.00 C ATOM 1560 O GLU A 104 11.380 -12.680 -6.449 1.00 0.00 O ATOM 1561 CB GLU A 104 8.961 -14.662 -7.350 1.00 0.00 C ATOM 1562 CG GLU A 104 8.484 -15.691 -8.377 1.00 0.00 C ATOM 1563 CD GLU A 104 6.965 -15.737 -8.460 1.00 0.00 C ATOM 1564 OE1 GLU A 104 6.347 -14.963 -9.239 1.00 0.00 O ATOM 1565 OE2 GLU A 104 6.331 -16.625 -7.829 1.00 0.00 O ATOM 0 H GLU A 104 9.688 -16.516 -5.805 1.00 0.00 H new ATOM 0 HA GLU A 104 11.045 -15.016 -7.634 1.00 0.00 H new ATOM 0 HB2 GLU A 104 8.261 -14.667 -6.514 1.00 0.00 H new ATOM 0 HB3 GLU A 104 8.904 -13.674 -7.808 1.00 0.00 H new ATOM 0 HG2 GLU A 104 8.895 -15.446 -9.356 1.00 0.00 H new ATOM 0 HG3 GLU A 104 8.864 -16.677 -8.109 1.00 0.00 H new ATOM 1572 N LEU A 105 10.301 -13.611 -4.735 1.00 0.00 N ATOM 1573 CA LEU A 105 10.495 -12.408 -3.986 1.00 0.00 C ATOM 1574 C LEU A 105 11.911 -12.230 -3.557 1.00 0.00 C ATOM 1575 O LEU A 105 12.403 -11.109 -3.436 1.00 0.00 O ATOM 1576 CB LEU A 105 9.561 -12.374 -2.765 1.00 0.00 C ATOM 1577 CG LEU A 105 9.304 -10.961 -2.215 1.00 0.00 C ATOM 1578 CD1 LEU A 105 7.783 -10.757 -2.117 1.00 0.00 C ATOM 1579 CD2 LEU A 105 10.127 -10.671 -0.948 1.00 0.00 C ATOM 0 H LEU A 105 9.862 -14.388 -4.241 1.00 0.00 H new ATOM 0 HA LEU A 105 10.249 -11.578 -4.648 1.00 0.00 H new ATOM 0 HB2 LEU A 105 8.607 -12.826 -3.037 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.991 -12.988 -1.974 1.00 0.00 H new ATOM 0 HG LEU A 105 9.673 -10.193 -2.895 1.00 0.00 H new ATOM 0 HD11 LEU A 105 7.574 -9.760 -1.729 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.337 -10.862 -3.106 1.00 0.00 H new ATOM 0 HD13 LEU A 105 7.358 -11.504 -1.447 1.00 0.00 H new ATOM 0 HD21 LEU A 105 9.912 -9.662 -0.597 1.00 0.00 H new ATOM 0 HD22 LEU A 105 9.864 -11.389 -0.171 1.00 0.00 H new ATOM 0 HD23 LEU A 105 11.189 -10.757 -1.177 1.00 0.00 H new ATOM 1591 N ARG A 106 12.705 -13.287 -3.312 1.00 0.00 N ATOM 1592 CA ARG A 106 14.093 -13.303 -2.968 1.00 0.00 C ATOM 1593 C ARG A 106 14.813 -12.866 -4.197 1.00 0.00 C ATOM 1594 O ARG A 106 15.729 -12.055 -4.073 1.00 0.00 O ATOM 1595 CB ARG A 106 14.649 -14.696 -2.626 1.00 0.00 C ATOM 1596 CG ARG A 106 16.043 -15.148 -3.066 1.00 0.00 C ATOM 1597 CD ARG A 106 16.423 -16.420 -2.305 1.00 0.00 C ATOM 1598 NE ARG A 106 17.093 -15.981 -1.049 1.00 0.00 N ATOM 1599 CZ ARG A 106 16.513 -16.069 0.184 1.00 0.00 C ATOM 1600 NH1 ARG A 106 15.269 -16.581 0.418 1.00 0.00 N ATOM 1601 NH2 ARG A 106 17.187 -15.727 1.321 1.00 0.00 N ATOM 0 H ARG A 106 12.330 -14.234 -3.361 1.00 0.00 H new ATOM 0 HA ARG A 106 14.225 -12.675 -2.087 1.00 0.00 H new ATOM 0 HB2 ARG A 106 14.618 -14.788 -1.540 1.00 0.00 H new ATOM 0 HB3 ARG A 106 13.943 -15.423 -3.028 1.00 0.00 H new ATOM 0 HG2 ARG A 106 16.056 -15.335 -4.140 1.00 0.00 H new ATOM 0 HG3 ARG A 106 16.772 -14.362 -2.871 1.00 0.00 H new ATOM 0 HD2 ARG A 106 15.539 -17.018 -2.084 1.00 0.00 H new ATOM 0 HD3 ARG A 106 17.089 -17.044 -2.901 1.00 0.00 H new ATOM 0 HE ARG A 106 18.035 -15.594 -1.113 1.00 0.00 H new ATOM 0 HH11 ARG A 106 14.707 -16.931 -0.358 1.00 0.00 H new ATOM 0 HH12 ARG A 106 14.902 -16.614 1.369 1.00 0.00 H new ATOM 0 HH21 ARG A 106 18.150 -15.395 1.263 1.00 0.00 H new ATOM 0 HH22 ARG A 106 16.728 -15.803 2.229 1.00 0.00 H new ATOM 1615 N HIS A 107 14.422 -13.165 -5.449 1.00 0.00 N ATOM 1616 CA HIS A 107 14.888 -12.590 -6.672 1.00 0.00 C ATOM 1617 C HIS A 107 14.647 -11.123 -6.770 1.00 0.00 C ATOM 1618 O HIS A 107 15.601 -10.347 -6.789 1.00 0.00 O ATOM 1619 CB HIS A 107 14.161 -13.241 -7.861 1.00 0.00 C ATOM 1620 CG HIS A 107 14.530 -12.814 -9.250 1.00 0.00 C ATOM 1621 ND1 HIS A 107 15.786 -12.739 -9.818 1.00 0.00 N ATOM 1622 CD2 HIS A 107 13.677 -12.418 -10.233 1.00 0.00 C ATOM 1623 CE1 HIS A 107 15.630 -12.238 -11.073 1.00 0.00 C ATOM 1624 NE2 HIS A 107 14.356 -12.097 -11.391 1.00 0.00 N ATOM 0 H HIS A 107 13.712 -13.877 -5.618 1.00 0.00 H new ATOM 0 HA HIS A 107 15.963 -12.768 -6.691 1.00 0.00 H new ATOM 0 HB2 HIS A 107 14.316 -14.318 -7.794 1.00 0.00 H new ATOM 0 HB3 HIS A 107 13.093 -13.064 -7.733 1.00 0.00 H new ATOM 0 HD2 HIS A 107 12.604 -12.362 -10.121 1.00 0.00 H new ATOM 0 HE1 HIS A 107 16.449 -11.986 -11.730 1.00 0.00 H new ATOM 0 HE2 HIS A 107 13.963 -11.815 -12.289 1.00 0.00 H new ATOM 1632 N VAL A 108 13.375 -10.692 -6.710 1.00 0.00 N ATOM 1633 CA VAL A 108 12.983 -9.318 -6.652 1.00 0.00 C ATOM 1634 C VAL A 108 13.717 -8.460 -5.679 1.00 0.00 C ATOM 1635 O VAL A 108 14.264 -7.435 -6.081 1.00 0.00 O ATOM 1636 CB VAL A 108 11.515 -9.235 -6.354 1.00 0.00 C ATOM 1637 CG1 VAL A 108 11.155 -7.740 -6.334 1.00 0.00 C ATOM 1638 CG2 VAL A 108 10.707 -9.876 -7.495 1.00 0.00 C ATOM 0 H VAL A 108 12.581 -11.333 -6.702 1.00 0.00 H new ATOM 0 HA VAL A 108 13.239 -8.919 -7.633 1.00 0.00 H new ATOM 0 HB VAL A 108 11.293 -9.741 -5.415 1.00 0.00 H new ATOM 0 HG11 VAL A 108 10.092 -7.624 -6.120 1.00 0.00 H new ATOM 0 HG12 VAL A 108 11.737 -7.236 -5.563 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.380 -7.299 -7.305 1.00 0.00 H new ATOM 0 HG21 VAL A 108 9.643 -9.810 -7.269 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.913 -9.350 -8.427 1.00 0.00 H new ATOM 0 HG23 VAL A 108 10.992 -10.923 -7.599 1.00 0.00 H new ATOM 1648 N MET A 109 13.885 -8.891 -4.416 1.00 0.00 N ATOM 1649 CA MET A 109 14.553 -8.120 -3.414 1.00 0.00 C ATOM 1650 C MET A 109 16.033 -8.290 -3.389 1.00 0.00 C ATOM 1651 O MET A 109 16.721 -7.521 -2.720 1.00 0.00 O ATOM 1652 CB MET A 109 13.910 -8.331 -2.033 1.00 0.00 C ATOM 1653 CG MET A 109 12.429 -7.945 -2.032 1.00 0.00 C ATOM 1654 SD MET A 109 12.000 -6.203 -2.321 1.00 0.00 S ATOM 1655 CE MET A 109 10.193 -6.362 -2.405 1.00 0.00 C ATOM 0 H MET A 109 13.549 -9.795 -4.084 1.00 0.00 H new ATOM 0 HA MET A 109 14.410 -7.077 -3.696 1.00 0.00 H new ATOM 0 HB2 MET A 109 14.014 -9.376 -1.739 1.00 0.00 H new ATOM 0 HB3 MET A 109 14.441 -7.737 -1.290 1.00 0.00 H new ATOM 0 HG2 MET A 109 11.928 -8.543 -2.793 1.00 0.00 H new ATOM 0 HG3 MET A 109 12.009 -8.237 -1.070 1.00 0.00 H new ATOM 0 HE1 MET A 109 9.749 -5.382 -2.580 1.00 0.00 H new ATOM 0 HE2 MET A 109 9.924 -7.033 -3.221 1.00 0.00 H new ATOM 0 HE3 MET A 109 9.819 -6.767 -1.465 1.00 0.00 H new ATOM 1665 N THR A 110 16.650 -9.225 -4.134 1.00 0.00 N ATOM 1666 CA THR A 110 18.030 -9.237 -4.507 1.00 0.00 C ATOM 1667 C THR A 110 18.278 -8.176 -5.524 1.00 0.00 C ATOM 1668 O THR A 110 19.338 -7.552 -5.491 1.00 0.00 O ATOM 1669 CB THR A 110 18.532 -10.532 -5.073 1.00 0.00 C ATOM 1670 OG1 THR A 110 18.294 -11.505 -4.066 1.00 0.00 O ATOM 1671 CG2 THR A 110 20.057 -10.630 -5.252 1.00 0.00 C ATOM 0 H THR A 110 16.145 -10.031 -4.502 1.00 0.00 H new ATOM 0 HA THR A 110 18.571 -9.070 -3.576 1.00 0.00 H new ATOM 0 HB THR A 110 18.044 -10.646 -6.041 1.00 0.00 H new ATOM 0 HG1 THR A 110 17.485 -12.013 -4.286 1.00 0.00 H new ATOM 0 HG21 THR A 110 20.313 -11.605 -5.667 1.00 0.00 H new ATOM 0 HG22 THR A 110 20.395 -9.847 -5.931 1.00 0.00 H new ATOM 0 HG23 THR A 110 20.545 -10.508 -4.285 1.00 0.00 H new ATOM 1679 N ASN A 111 17.368 -8.030 -6.503 1.00 0.00 N ATOM 1680 CA ASN A 111 17.634 -7.320 -7.715 1.00 0.00 C ATOM 1681 C ASN A 111 17.424 -5.859 -7.513 1.00 0.00 C ATOM 1682 O ASN A 111 18.117 -4.990 -8.040 1.00 0.00 O ATOM 1683 CB ASN A 111 16.798 -7.884 -8.876 1.00 0.00 C ATOM 1684 CG ASN A 111 17.278 -7.372 -10.226 1.00 0.00 C ATOM 1685 OD1 ASN A 111 18.461 -7.053 -10.334 1.00 0.00 O ATOM 1686 ND2 ASN A 111 16.496 -7.514 -11.330 1.00 0.00 N ATOM 0 H ASN A 111 16.425 -8.415 -6.451 1.00 0.00 H new ATOM 0 HA ASN A 111 18.679 -7.461 -7.989 1.00 0.00 H new ATOM 0 HB2 ASN A 111 16.848 -8.973 -8.863 1.00 0.00 H new ATOM 0 HB3 ASN A 111 15.752 -7.611 -8.736 1.00 0.00 H new ATOM 0 HD21 ASN A 111 16.890 -7.356 -12.258 1.00 0.00 H new ATOM 0 HD22 ASN A 111 15.516 -7.779 -11.230 1.00 0.00 H new ATOM 1693 N LEU A 112 16.323 -5.454 -6.855 1.00 0.00 N ATOM 1694 CA LEU A 112 15.638 -4.207 -6.998 1.00 0.00 C ATOM 1695 C LEU A 112 16.371 -2.942 -6.710 1.00 0.00 C ATOM 1696 O LEU A 112 16.464 -2.051 -7.553 1.00 0.00 O ATOM 1697 CB LEU A 112 14.274 -4.220 -6.288 1.00 0.00 C ATOM 1698 CG LEU A 112 13.278 -3.152 -6.772 1.00 0.00 C ATOM 1699 CD1 LEU A 112 12.895 -3.079 -8.260 1.00 0.00 C ATOM 1700 CD2 LEU A 112 11.999 -3.435 -5.965 1.00 0.00 C ATOM 0 H LEU A 112 15.874 -6.054 -6.162 1.00 0.00 H new ATOM 0 HA LEU A 112 15.518 -4.162 -8.080 1.00 0.00 H new ATOM 0 HB2 LEU A 112 13.822 -5.203 -6.420 1.00 0.00 H new ATOM 0 HB3 LEU A 112 14.437 -4.085 -5.219 1.00 0.00 H new ATOM 0 HG LEU A 112 13.777 -2.194 -6.624 1.00 0.00 H new ATOM 0 HD11 LEU A 112 12.184 -2.267 -8.413 1.00 0.00 H new ATOM 0 HD12 LEU A 112 13.788 -2.897 -8.857 1.00 0.00 H new ATOM 0 HD13 LEU A 112 12.441 -4.022 -8.565 1.00 0.00 H new ATOM 0 HD21 LEU A 112 11.227 -2.718 -6.244 1.00 0.00 H new ATOM 0 HD22 LEU A 112 11.650 -4.446 -6.178 1.00 0.00 H new ATOM 0 HD23 LEU A 112 12.213 -3.342 -4.900 1.00 0.00 H new ATOM 1712 N GLY A 113 17.064 -2.800 -5.566 1.00 0.00 N ATOM 1713 CA GLY A 113 17.737 -1.602 -5.171 1.00 0.00 C ATOM 1714 C GLY A 113 18.412 -1.564 -3.843 1.00 0.00 C ATOM 1715 O GLY A 113 19.619 -1.348 -3.749 1.00 0.00 O ATOM 0 H GLY A 113 17.159 -3.554 -4.886 1.00 0.00 H new ATOM 0 HA2 GLY A 113 18.487 -1.379 -5.929 1.00 0.00 H new ATOM 0 HA3 GLY A 113 17.009 -0.791 -5.195 1.00 0.00 H new ATOM 1719 N GLU A 114 17.647 -1.747 -2.752 1.00 0.00 N ATOM 1720 CA GLU A 114 18.123 -1.794 -1.404 1.00 0.00 C ATOM 1721 C GLU A 114 18.823 -3.085 -1.151 1.00 0.00 C ATOM 1722 O GLU A 114 18.537 -4.165 -1.664 1.00 0.00 O ATOM 1723 CB GLU A 114 16.966 -1.682 -0.397 1.00 0.00 C ATOM 1724 CG GLU A 114 16.260 -0.334 -0.560 1.00 0.00 C ATOM 1725 CD GLU A 114 15.314 -0.097 0.607 1.00 0.00 C ATOM 1726 OE1 GLU A 114 14.311 -0.818 0.857 1.00 0.00 O ATOM 1727 OE2 GLU A 114 15.610 0.863 1.368 1.00 0.00 O ATOM 0 H GLU A 114 16.636 -1.869 -2.815 1.00 0.00 H new ATOM 0 HA GLU A 114 18.804 -0.953 -1.274 1.00 0.00 H new ATOM 0 HB2 GLU A 114 16.257 -2.495 -0.553 1.00 0.00 H new ATOM 0 HB3 GLU A 114 17.346 -1.782 0.620 1.00 0.00 H new ATOM 0 HG2 GLU A 114 16.997 0.468 -0.610 1.00 0.00 H new ATOM 0 HG3 GLU A 114 15.705 -0.316 -1.498 1.00 0.00 H new ATOM 1734 N LYS A 115 19.923 -3.056 -0.377 1.00 0.00 N ATOM 1735 CA LYS A 115 20.694 -4.249 -0.209 1.00 0.00 C ATOM 1736 C LYS A 115 20.243 -4.949 1.027 1.00 0.00 C ATOM 1737 O LYS A 115 20.381 -4.391 2.114 1.00 0.00 O ATOM 1738 CB LYS A 115 22.196 -3.983 -0.012 1.00 0.00 C ATOM 1739 CG LYS A 115 22.859 -3.395 -1.259 1.00 0.00 C ATOM 1740 CD LYS A 115 24.365 -3.132 -1.183 1.00 0.00 C ATOM 1741 CE LYS A 115 24.852 -2.289 -2.364 1.00 0.00 C ATOM 1742 NZ LYS A 115 24.413 -0.877 -2.300 1.00 0.00 N ATOM 0 H LYS A 115 20.271 -2.235 0.118 1.00 0.00 H new ATOM 0 HA LYS A 115 20.548 -4.831 -1.119 1.00 0.00 H new ATOM 0 HB2 LYS A 115 22.333 -3.298 0.825 1.00 0.00 H new ATOM 0 HB3 LYS A 115 22.694 -4.915 0.254 1.00 0.00 H new ATOM 0 HG2 LYS A 115 22.674 -4.072 -2.093 1.00 0.00 H new ATOM 0 HG3 LYS A 115 22.362 -2.454 -1.496 1.00 0.00 H new ATOM 0 HD2 LYS A 115 24.598 -2.620 -0.249 1.00 0.00 H new ATOM 0 HD3 LYS A 115 24.900 -4.081 -1.168 1.00 0.00 H new ATOM 0 HE2 LYS A 115 25.941 -2.322 -2.399 1.00 0.00 H new ATOM 0 HE3 LYS A 115 24.489 -2.733 -3.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 24.935 -0.319 -3.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 23.394 -0.821 -2.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 24.602 -0.498 -1.350 1.00 0.00 H new ATOM 1756 N LEU A 116 19.706 -6.176 0.900 1.00 0.00 N ATOM 1757 CA LEU A 116 19.181 -6.856 2.043 1.00 0.00 C ATOM 1758 C LEU A 116 19.779 -8.220 2.090 1.00 0.00 C ATOM 1759 O LEU A 116 20.050 -8.896 1.099 1.00 0.00 O ATOM 1760 CB LEU A 116 17.658 -7.065 2.003 1.00 0.00 C ATOM 1761 CG LEU A 116 16.862 -5.750 1.966 1.00 0.00 C ATOM 1762 CD1 LEU A 116 15.413 -6.093 1.579 1.00 0.00 C ATOM 1763 CD2 LEU A 116 16.963 -4.955 3.279 1.00 0.00 C ATOM 0 H LEU A 116 19.636 -6.690 0.022 1.00 0.00 H new ATOM 0 HA LEU A 116 19.422 -6.232 2.904 1.00 0.00 H new ATOM 0 HB2 LEU A 116 17.403 -7.660 1.126 1.00 0.00 H new ATOM 0 HB3 LEU A 116 17.355 -7.640 2.878 1.00 0.00 H new ATOM 0 HG LEU A 116 17.289 -5.081 1.219 1.00 0.00 H new ATOM 0 HD11 LEU A 116 14.820 -5.179 1.544 1.00 0.00 H new ATOM 0 HD12 LEU A 116 15.401 -6.571 0.600 1.00 0.00 H new ATOM 0 HD13 LEU A 116 14.990 -6.772 2.319 1.00 0.00 H new ATOM 0 HD21 LEU A 116 16.382 -4.037 3.194 1.00 0.00 H new ATOM 0 HD22 LEU A 116 16.573 -5.557 4.100 1.00 0.00 H new ATOM 0 HD23 LEU A 116 18.006 -4.707 3.475 1.00 0.00 H new ATOM 1775 N THR A 117 20.110 -8.723 3.293 1.00 0.00 N ATOM 1776 CA THR A 117 20.645 -10.021 3.566 1.00 0.00 C ATOM 1777 C THR A 117 19.656 -11.135 3.545 1.00 0.00 C ATOM 1778 O THR A 117 18.483 -10.908 3.836 1.00 0.00 O ATOM 1779 CB THR A 117 21.429 -10.082 4.844 1.00 0.00 C ATOM 1780 OG1 THR A 117 20.620 -9.695 5.944 1.00 0.00 O ATOM 1781 CG2 THR A 117 22.550 -9.028 4.837 1.00 0.00 C ATOM 0 H THR A 117 19.993 -8.174 4.145 1.00 0.00 H new ATOM 0 HA THR A 117 21.317 -10.176 2.722 1.00 0.00 H new ATOM 0 HB THR A 117 21.801 -11.103 4.927 1.00 0.00 H new ATOM 0 HG1 THR A 117 20.917 -10.166 6.750 1.00 0.00 H new ATOM 0 HG21 THR A 117 23.109 -9.085 5.771 1.00 0.00 H new ATOM 0 HG22 THR A 117 23.222 -9.217 4.000 1.00 0.00 H new ATOM 0 HG23 THR A 117 22.114 -8.034 4.736 1.00 0.00 H new ATOM 1789 N ASP A 118 20.142 -12.350 3.233 1.00 0.00 N ATOM 1790 CA ASP A 118 19.341 -13.534 3.272 1.00 0.00 C ATOM 1791 C ASP A 118 18.445 -13.730 4.446 1.00 0.00 C ATOM 1792 O ASP A 118 17.259 -13.909 4.174 1.00 0.00 O ATOM 1793 CB ASP A 118 20.221 -14.787 3.130 1.00 0.00 C ATOM 1794 CG ASP A 118 20.676 -15.082 1.708 1.00 0.00 C ATOM 1795 OD1 ASP A 118 19.774 -15.153 0.831 1.00 0.00 O ATOM 1796 OD2 ASP A 118 21.913 -15.150 1.479 1.00 0.00 O ATOM 0 H ASP A 118 21.108 -12.513 2.949 1.00 0.00 H new ATOM 0 HA ASP A 118 18.669 -13.384 2.427 1.00 0.00 H new ATOM 0 HB2 ASP A 118 21.101 -14.671 3.763 1.00 0.00 H new ATOM 0 HB3 ASP A 118 19.669 -15.648 3.507 1.00 0.00 H new ATOM 1801 N GLU A 119 18.951 -13.709 5.692 1.00 0.00 N ATOM 1802 CA GLU A 119 18.124 -13.738 6.859 1.00 0.00 C ATOM 1803 C GLU A 119 17.106 -12.655 6.965 1.00 0.00 C ATOM 1804 O GLU A 119 15.971 -12.951 7.335 1.00 0.00 O ATOM 1805 CB GLU A 119 18.919 -13.900 8.165 1.00 0.00 C ATOM 1806 CG GLU A 119 19.651 -12.675 8.718 1.00 0.00 C ATOM 1807 CD GLU A 119 20.894 -12.404 7.883 1.00 0.00 C ATOM 1808 OE1 GLU A 119 21.335 -13.245 7.054 1.00 0.00 O ATOM 1809 OE2 GLU A 119 21.372 -11.244 7.994 1.00 0.00 O ATOM 0 H GLU A 119 19.950 -13.671 5.893 1.00 0.00 H new ATOM 0 HA GLU A 119 17.541 -14.647 6.711 1.00 0.00 H new ATOM 0 HB2 GLU A 119 18.231 -14.252 8.933 1.00 0.00 H new ATOM 0 HB3 GLU A 119 19.656 -14.688 8.011 1.00 0.00 H new ATOM 0 HG2 GLU A 119 18.992 -11.807 8.701 1.00 0.00 H new ATOM 0 HG3 GLU A 119 19.929 -12.844 9.758 1.00 0.00 H new ATOM 1816 N GLU A 120 17.483 -11.434 6.548 1.00 0.00 N ATOM 1817 CA GLU A 120 16.624 -10.291 6.526 1.00 0.00 C ATOM 1818 C GLU A 120 15.492 -10.486 5.577 1.00 0.00 C ATOM 1819 O GLU A 120 14.381 -10.206 6.022 1.00 0.00 O ATOM 1820 CB GLU A 120 17.338 -9.012 6.055 1.00 0.00 C ATOM 1821 CG GLU A 120 16.386 -7.815 6.039 1.00 0.00 C ATOM 1822 CD GLU A 120 16.414 -7.022 7.338 1.00 0.00 C ATOM 1823 OE1 GLU A 120 17.530 -6.927 7.915 1.00 0.00 O ATOM 1824 OE2 GLU A 120 15.414 -6.349 7.703 1.00 0.00 O ATOM 0 H GLU A 120 18.425 -11.234 6.212 1.00 0.00 H new ATOM 0 HA GLU A 120 16.285 -10.181 7.556 1.00 0.00 H new ATOM 0 HB2 GLU A 120 18.180 -8.800 6.714 1.00 0.00 H new ATOM 0 HB3 GLU A 120 17.746 -9.168 5.056 1.00 0.00 H new ATOM 0 HG2 GLU A 120 16.651 -7.157 5.211 1.00 0.00 H new ATOM 0 HG3 GLU A 120 15.371 -8.166 5.855 1.00 0.00 H new ATOM 1831 N VAL A 121 15.757 -10.970 4.351 1.00 0.00 N ATOM 1832 CA VAL A 121 14.836 -11.309 3.310 1.00 0.00 C ATOM 1833 C VAL A 121 13.809 -12.332 3.657 1.00 0.00 C ATOM 1834 O VAL A 121 12.602 -12.107 3.584 1.00 0.00 O ATOM 1835 CB VAL A 121 15.559 -11.599 2.029 1.00 0.00 C ATOM 1836 CG1 VAL A 121 14.565 -12.131 0.983 1.00 0.00 C ATOM 1837 CG2 VAL A 121 16.237 -10.333 1.478 1.00 0.00 C ATOM 0 H VAL A 121 16.720 -11.141 4.061 1.00 0.00 H new ATOM 0 HA VAL A 121 14.229 -10.416 3.163 1.00 0.00 H new ATOM 0 HB VAL A 121 16.326 -12.346 2.234 1.00 0.00 H new ATOM 0 HG11 VAL A 121 15.093 -12.341 0.053 1.00 0.00 H new ATOM 0 HG12 VAL A 121 14.103 -13.046 1.353 1.00 0.00 H new ATOM 0 HG13 VAL A 121 13.793 -11.383 0.801 1.00 0.00 H new ATOM 0 HG21 VAL A 121 16.754 -10.572 0.549 1.00 0.00 H new ATOM 0 HG22 VAL A 121 15.482 -9.570 1.287 1.00 0.00 H new ATOM 0 HG23 VAL A 121 16.956 -9.959 2.207 1.00 0.00 H new ATOM 1847 N ASP A 122 14.274 -13.488 4.164 1.00 0.00 N ATOM 1848 CA ASP A 122 13.488 -14.509 4.785 1.00 0.00 C ATOM 1849 C ASP A 122 12.669 -14.010 5.925 1.00 0.00 C ATOM 1850 O ASP A 122 11.517 -14.416 6.069 1.00 0.00 O ATOM 1851 CB ASP A 122 14.519 -15.493 5.363 1.00 0.00 C ATOM 1852 CG ASP A 122 15.053 -16.319 4.201 1.00 0.00 C ATOM 1853 OD1 ASP A 122 14.508 -16.342 3.065 1.00 0.00 O ATOM 1854 OD2 ASP A 122 16.121 -16.945 4.434 1.00 0.00 O ATOM 0 H ASP A 122 15.266 -13.724 4.138 1.00 0.00 H new ATOM 0 HA ASP A 122 12.797 -14.931 4.056 1.00 0.00 H new ATOM 0 HB2 ASP A 122 15.328 -14.956 5.857 1.00 0.00 H new ATOM 0 HB3 ASP A 122 14.059 -16.136 6.113 1.00 0.00 H new ATOM 1859 N GLU A 123 13.216 -13.078 6.726 1.00 0.00 N ATOM 1860 CA GLU A 123 12.559 -12.551 7.881 1.00 0.00 C ATOM 1861 C GLU A 123 11.484 -11.618 7.441 1.00 0.00 C ATOM 1862 O GLU A 123 10.402 -11.627 8.025 1.00 0.00 O ATOM 1863 CB GLU A 123 13.494 -11.897 8.913 1.00 0.00 C ATOM 1864 CG GLU A 123 12.824 -11.324 10.162 1.00 0.00 C ATOM 1865 CD GLU A 123 13.609 -11.375 11.465 1.00 0.00 C ATOM 1866 OE1 GLU A 123 13.782 -12.420 12.148 1.00 0.00 O ATOM 1867 OE2 GLU A 123 14.214 -10.344 11.864 1.00 0.00 O ATOM 0 H GLU A 123 14.141 -12.680 6.565 1.00 0.00 H new ATOM 0 HA GLU A 123 12.130 -13.397 8.417 1.00 0.00 H new ATOM 0 HB2 GLU A 123 14.229 -12.638 9.228 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.042 -11.094 8.419 1.00 0.00 H new ATOM 0 HG2 GLU A 123 12.572 -10.283 9.961 1.00 0.00 H new ATOM 0 HG3 GLU A 123 11.885 -11.855 10.314 1.00 0.00 H new ATOM 1874 N MET A 124 11.717 -10.882 6.340 1.00 0.00 N ATOM 1875 CA MET A 124 10.748 -10.020 5.735 1.00 0.00 C ATOM 1876 C MET A 124 9.591 -10.781 5.185 1.00 0.00 C ATOM 1877 O MET A 124 8.443 -10.447 5.472 1.00 0.00 O ATOM 1878 CB MET A 124 11.373 -9.164 4.621 1.00 0.00 C ATOM 1879 CG MET A 124 10.649 -7.836 4.395 1.00 0.00 C ATOM 1880 SD MET A 124 11.664 -6.766 3.333 1.00 0.00 S ATOM 1881 CE MET A 124 11.406 -7.516 1.699 1.00 0.00 C ATOM 0 H MET A 124 12.613 -10.887 5.853 1.00 0.00 H new ATOM 0 HA MET A 124 10.386 -9.364 6.526 1.00 0.00 H new ATOM 0 HB2 MET A 124 12.415 -8.963 4.869 1.00 0.00 H new ATOM 0 HB3 MET A 124 11.371 -9.733 3.691 1.00 0.00 H new ATOM 0 HG2 MET A 124 9.679 -8.013 3.930 1.00 0.00 H new ATOM 0 HG3 MET A 124 10.460 -7.345 5.350 1.00 0.00 H new ATOM 0 HE1 MET A 124 11.971 -6.960 0.950 1.00 0.00 H new ATOM 0 HE2 MET A 124 11.747 -8.551 1.716 1.00 0.00 H new ATOM 0 HE3 MET A 124 10.346 -7.487 1.449 1.00 0.00 H new ATOM 1891 N ILE A 125 9.885 -11.880 4.468 1.00 0.00 N ATOM 1892 CA ILE A 125 8.948 -12.853 3.998 1.00 0.00 C ATOM 1893 C ILE A 125 8.055 -13.377 5.070 1.00 0.00 C ATOM 1894 O ILE A 125 6.852 -13.122 5.063 1.00 0.00 O ATOM 1895 CB ILE A 125 9.597 -13.916 3.163 1.00 0.00 C ATOM 1896 CG1 ILE A 125 10.174 -13.285 1.885 1.00 0.00 C ATOM 1897 CG2 ILE A 125 8.673 -15.100 2.829 1.00 0.00 C ATOM 1898 CD1 ILE A 125 11.235 -14.205 1.283 1.00 0.00 C ATOM 0 H ILE A 125 10.843 -12.103 4.199 1.00 0.00 H new ATOM 0 HA ILE A 125 8.274 -12.329 3.321 1.00 0.00 H new ATOM 0 HB ILE A 125 10.401 -14.343 3.763 1.00 0.00 H new ATOM 0 HG12 ILE A 125 9.377 -13.113 1.162 1.00 0.00 H new ATOM 0 HG13 ILE A 125 10.611 -12.313 2.114 1.00 0.00 H new ATOM 0 HG21 ILE A 125 9.216 -15.825 2.223 1.00 0.00 H new ATOM 0 HG22 ILE A 125 8.341 -15.574 3.753 1.00 0.00 H new ATOM 0 HG23 ILE A 125 7.806 -14.740 2.274 1.00 0.00 H new ATOM 0 HD11 ILE A 125 11.639 -13.751 0.378 1.00 0.00 H new ATOM 0 HD12 ILE A 125 12.039 -14.354 2.004 1.00 0.00 H new ATOM 0 HD13 ILE A 125 10.785 -15.167 1.037 1.00 0.00 H new ATOM 1910 N ARG A 126 8.739 -13.932 6.087 1.00 0.00 N ATOM 1911 CA ARG A 126 8.084 -14.357 7.285 1.00 0.00 C ATOM 1912 C ARG A 126 7.113 -13.449 7.956 1.00 0.00 C ATOM 1913 O ARG A 126 6.063 -13.786 8.503 1.00 0.00 O ATOM 1914 CB ARG A 126 9.064 -14.926 8.325 1.00 0.00 C ATOM 1915 CG ARG A 126 8.406 -15.678 9.484 1.00 0.00 C ATOM 1916 CD ARG A 126 9.323 -16.524 10.369 1.00 0.00 C ATOM 1917 NE ARG A 126 8.391 -16.901 11.468 1.00 0.00 N ATOM 1918 CZ ARG A 126 8.805 -16.803 12.765 1.00 0.00 C ATOM 1919 NH1 ARG A 126 10.107 -16.974 13.139 1.00 0.00 N ATOM 1920 NH2 ARG A 126 7.911 -16.496 13.750 1.00 0.00 N ATOM 0 H ARG A 126 9.747 -14.086 6.079 1.00 0.00 H new ATOM 0 HA ARG A 126 7.443 -15.133 6.867 1.00 0.00 H new ATOM 0 HB2 ARG A 126 9.757 -15.600 7.820 1.00 0.00 H new ATOM 0 HB3 ARG A 126 9.656 -14.106 8.732 1.00 0.00 H new ATOM 0 HG2 ARG A 126 7.901 -14.949 10.118 1.00 0.00 H new ATOM 0 HG3 ARG A 126 7.636 -16.330 9.072 1.00 0.00 H new ATOM 0 HD2 ARG A 126 9.714 -17.395 9.843 1.00 0.00 H new ATOM 0 HD3 ARG A 126 10.181 -15.959 10.732 1.00 0.00 H new ATOM 0 HE ARG A 126 7.450 -17.230 11.253 1.00 0.00 H new ATOM 0 HH11 ARG A 126 10.816 -17.184 12.437 1.00 0.00 H new ATOM 0 HH12 ARG A 126 10.371 -16.891 14.121 1.00 0.00 H new ATOM 0 HH21 ARG A 126 6.930 -16.339 13.518 1.00 0.00 H new ATOM 0 HH22 ARG A 126 8.224 -16.424 14.718 1.00 0.00 H new ATOM 1934 N GLU A 127 7.530 -12.174 8.050 1.00 0.00 N ATOM 1935 CA GLU A 127 6.751 -11.177 8.715 1.00 0.00 C ATOM 1936 C GLU A 127 5.627 -10.683 7.871 1.00 0.00 C ATOM 1937 O GLU A 127 4.561 -10.463 8.444 1.00 0.00 O ATOM 1938 CB GLU A 127 7.568 -10.208 9.587 1.00 0.00 C ATOM 1939 CG GLU A 127 8.336 -10.964 10.673 1.00 0.00 C ATOM 1940 CD GLU A 127 9.350 -10.174 11.488 1.00 0.00 C ATOM 1941 OE1 GLU A 127 9.556 -8.945 11.303 1.00 0.00 O ATOM 1942 OE2 GLU A 127 9.991 -10.833 12.350 1.00 0.00 O ATOM 0 H GLU A 127 8.410 -11.833 7.664 1.00 0.00 H new ATOM 0 HA GLU A 127 6.189 -11.638 9.527 1.00 0.00 H new ATOM 0 HB2 GLU A 127 8.267 -9.652 8.962 1.00 0.00 H new ATOM 0 HB3 GLU A 127 6.902 -9.478 10.048 1.00 0.00 H new ATOM 0 HG2 GLU A 127 7.610 -11.394 11.363 1.00 0.00 H new ATOM 0 HG3 GLU A 127 8.858 -11.796 10.200 1.00 0.00 H new ATOM 1949 N ALA A 128 5.787 -10.689 6.535 1.00 0.00 N ATOM 1950 CA ALA A 128 4.737 -10.361 5.621 1.00 0.00 C ATOM 1951 C ALA A 128 3.766 -11.443 5.299 1.00 0.00 C ATOM 1952 O ALA A 128 2.608 -11.180 4.978 1.00 0.00 O ATOM 1953 CB ALA A 128 5.509 -9.854 4.391 1.00 0.00 C ATOM 0 H ALA A 128 6.668 -10.928 6.079 1.00 0.00 H new ATOM 0 HA ALA A 128 4.057 -9.631 6.060 1.00 0.00 H new ATOM 0 HB1 ALA A 128 4.803 -9.568 3.611 1.00 0.00 H new ATOM 0 HB2 ALA A 128 6.111 -8.989 4.670 1.00 0.00 H new ATOM 0 HB3 ALA A 128 6.161 -10.645 4.019 1.00 0.00 H new ATOM 1959 N ASP A 129 4.105 -12.745 5.302 1.00 0.00 N ATOM 1960 CA ASP A 129 3.154 -13.761 4.973 1.00 0.00 C ATOM 1961 C ASP A 129 2.219 -14.017 6.104 1.00 0.00 C ATOM 1962 O ASP A 129 2.659 -14.369 7.197 1.00 0.00 O ATOM 1963 CB ASP A 129 3.831 -15.021 4.406 1.00 0.00 C ATOM 1964 CG ASP A 129 2.900 -15.912 3.598 1.00 0.00 C ATOM 1965 OD1 ASP A 129 1.866 -16.390 4.138 1.00 0.00 O ATOM 1966 OD2 ASP A 129 3.065 -16.166 2.374 1.00 0.00 O ATOM 0 H ASP A 129 5.036 -13.093 5.532 1.00 0.00 H new ATOM 0 HA ASP A 129 2.528 -13.394 4.159 1.00 0.00 H new ATOM 0 HB2 ASP A 129 4.667 -14.719 3.775 1.00 0.00 H new ATOM 0 HB3 ASP A 129 4.247 -15.600 5.231 1.00 0.00 H new ATOM 1971 N ILE A 130 0.931 -13.727 5.844 1.00 0.00 N ATOM 1972 CA ILE A 130 -0.116 -13.875 6.805 1.00 0.00 C ATOM 1973 C ILE A 130 -0.390 -15.313 7.080 1.00 0.00 C ATOM 1974 O ILE A 130 -0.440 -15.729 8.237 1.00 0.00 O ATOM 1975 CB ILE A 130 -1.349 -13.172 6.319 1.00 0.00 C ATOM 1976 CG1 ILE A 130 -0.961 -11.684 6.278 1.00 0.00 C ATOM 1977 CG2 ILE A 130 -2.609 -13.466 7.150 1.00 0.00 C ATOM 1978 CD1 ILE A 130 -0.975 -10.906 7.593 1.00 0.00 C ATOM 0 H ILE A 130 0.610 -13.380 4.940 1.00 0.00 H new ATOM 0 HA ILE A 130 0.200 -13.420 7.744 1.00 0.00 H new ATOM 0 HB ILE A 130 -1.648 -13.533 5.335 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.042 -11.611 5.857 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -1.635 -11.181 5.585 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.455 -12.920 6.733 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -2.820 -14.535 7.126 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -2.447 -13.151 8.181 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -0.680 -9.873 7.408 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -1.979 -10.926 8.017 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -0.276 -11.363 8.293 1.00 0.00 H new ATOM 1990 N ASP A 131 -0.579 -16.169 6.060 1.00 0.00 N ATOM 1991 CA ASP A 131 -0.720 -17.588 6.175 1.00 0.00 C ATOM 1992 C ASP A 131 0.409 -18.336 6.796 1.00 0.00 C ATOM 1993 O ASP A 131 0.289 -19.405 7.392 1.00 0.00 O ATOM 1994 CB ASP A 131 -1.046 -18.235 4.818 1.00 0.00 C ATOM 1995 CG ASP A 131 -2.077 -17.394 4.080 1.00 0.00 C ATOM 1996 OD1 ASP A 131 -3.286 -17.578 4.386 1.00 0.00 O ATOM 1997 OD2 ASP A 131 -1.728 -16.680 3.103 1.00 0.00 O ATOM 0 H ASP A 131 -0.637 -15.849 5.093 1.00 0.00 H new ATOM 0 HA ASP A 131 -1.549 -17.677 6.877 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -0.139 -18.323 4.220 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -1.428 -19.245 4.969 1.00 0.00 H new ATOM 2002 N GLY A 132 1.647 -17.902 6.499 1.00 0.00 N ATOM 2003 CA GLY A 132 2.829 -18.681 6.694 1.00 0.00 C ATOM 2004 C GLY A 132 3.159 -19.713 5.671 1.00 0.00 C ATOM 2005 O GLY A 132 4.122 -20.450 5.873 1.00 0.00 O ATOM 0 H GLY A 132 1.831 -16.977 6.110 1.00 0.00 H new ATOM 0 HA2 GLY A 132 3.674 -17.996 6.763 1.00 0.00 H new ATOM 0 HA3 GLY A 132 2.745 -19.181 7.659 1.00 0.00 H new ATOM 2009 N ASP A 133 2.400 -19.753 4.561 1.00 0.00 N ATOM 2010 CA ASP A 133 2.689 -20.649 3.485 1.00 0.00 C ATOM 2011 C ASP A 133 3.906 -20.255 2.721 1.00 0.00 C ATOM 2012 O ASP A 133 4.694 -21.084 2.267 1.00 0.00 O ATOM 2013 CB ASP A 133 1.504 -20.958 2.554 1.00 0.00 C ATOM 2014 CG ASP A 133 0.740 -19.754 2.023 1.00 0.00 C ATOM 2015 OD1 ASP A 133 1.202 -18.585 1.937 1.00 0.00 O ATOM 2016 OD2 ASP A 133 -0.436 -19.975 1.627 1.00 0.00 O ATOM 0 H ASP A 133 1.583 -19.162 4.409 1.00 0.00 H new ATOM 0 HA ASP A 133 2.902 -21.594 3.985 1.00 0.00 H new ATOM 0 HB2 ASP A 133 1.875 -21.531 1.704 1.00 0.00 H new ATOM 0 HB3 ASP A 133 0.804 -21.599 3.090 1.00 0.00 H new ATOM 2021 N GLY A 134 4.204 -18.954 2.559 1.00 0.00 N ATOM 2022 CA GLY A 134 5.378 -18.453 1.915 1.00 0.00 C ATOM 2023 C GLY A 134 5.100 -17.773 0.619 1.00 0.00 C ATOM 2024 O GLY A 134 5.932 -16.999 0.148 1.00 0.00 O ATOM 0 H GLY A 134 3.592 -18.211 2.896 1.00 0.00 H new ATOM 0 HA2 GLY A 134 5.879 -17.753 2.584 1.00 0.00 H new ATOM 0 HA3 GLY A 134 6.069 -19.278 1.742 1.00 0.00 H new ATOM 2028 N GLN A 135 3.885 -17.902 0.057 1.00 0.00 N ATOM 2029 CA GLN A 135 3.503 -17.342 -1.202 1.00 0.00 C ATOM 2030 C GLN A 135 2.781 -16.074 -0.900 1.00 0.00 C ATOM 2031 O GLN A 135 1.717 -16.124 -0.284 1.00 0.00 O ATOM 2032 CB GLN A 135 2.875 -18.229 -2.290 1.00 0.00 C ATOM 2033 CG GLN A 135 1.457 -18.756 -2.058 1.00 0.00 C ATOM 2034 CD GLN A 135 0.879 -19.537 -3.229 1.00 0.00 C ATOM 2035 OE1 GLN A 135 1.595 -20.294 -3.882 1.00 0.00 O ATOM 2036 NE2 GLN A 135 -0.458 -19.424 -3.454 1.00 0.00 N ATOM 0 H GLN A 135 3.131 -18.424 0.504 1.00 0.00 H new ATOM 0 HA GLN A 135 4.426 -17.169 -1.756 1.00 0.00 H new ATOM 0 HB2 GLN A 135 2.873 -17.663 -3.222 1.00 0.00 H new ATOM 0 HB3 GLN A 135 3.530 -19.087 -2.440 1.00 0.00 H new ATOM 0 HG2 GLN A 135 1.460 -19.396 -1.176 1.00 0.00 H new ATOM 0 HG3 GLN A 135 0.801 -17.914 -1.839 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -1.018 -18.784 -2.890 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -0.901 -19.979 -4.186 1.00 0.00 H new ATOM 2045 N VAL A 136 3.289 -14.926 -1.382 1.00 0.00 N ATOM 2046 CA VAL A 136 2.810 -13.657 -0.929 1.00 0.00 C ATOM 2047 C VAL A 136 1.805 -13.091 -1.871 1.00 0.00 C ATOM 2048 O VAL A 136 2.182 -12.931 -3.031 1.00 0.00 O ATOM 2049 CB VAL A 136 3.897 -12.656 -0.674 1.00 0.00 C ATOM 2050 CG1 VAL A 136 3.528 -11.181 -0.902 1.00 0.00 C ATOM 2051 CG2 VAL A 136 4.220 -12.813 0.822 1.00 0.00 C ATOM 0 H VAL A 136 4.029 -14.876 -2.083 1.00 0.00 H new ATOM 0 HA VAL A 136 2.335 -13.855 0.032 1.00 0.00 H new ATOM 0 HB VAL A 136 4.706 -12.859 -1.375 1.00 0.00 H new ATOM 0 HG11 VAL A 136 4.392 -10.552 -0.686 1.00 0.00 H new ATOM 0 HG12 VAL A 136 3.225 -11.038 -1.939 1.00 0.00 H new ATOM 0 HG13 VAL A 136 2.705 -10.906 -0.242 1.00 0.00 H new ATOM 0 HG21 VAL A 136 5.010 -12.115 1.099 1.00 0.00 H new ATOM 0 HG22 VAL A 136 3.327 -12.603 1.411 1.00 0.00 H new ATOM 0 HG23 VAL A 136 4.552 -13.833 1.017 1.00 0.00 H new ATOM 2061 N ASN A 137 0.547 -12.811 -1.485 1.00 0.00 N ATOM 2062 CA ASN A 137 -0.377 -12.156 -2.357 1.00 0.00 C ATOM 2063 C ASN A 137 -0.161 -10.683 -2.284 1.00 0.00 C ATOM 2064 O ASN A 137 0.827 -10.271 -1.679 1.00 0.00 O ATOM 2065 CB ASN A 137 -1.838 -12.632 -2.290 1.00 0.00 C ATOM 2066 CG ASN A 137 -2.494 -12.416 -0.934 1.00 0.00 C ATOM 2067 OD1 ASN A 137 -2.046 -11.561 -0.172 1.00 0.00 O ATOM 2068 ND2 ASN A 137 -3.574 -13.170 -0.597 1.00 0.00 N ATOM 0 H ASN A 137 0.169 -13.039 -0.565 1.00 0.00 H new ATOM 0 HA ASN A 137 -0.148 -12.475 -3.374 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -2.416 -12.107 -3.050 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -1.876 -13.693 -2.536 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -4.031 -13.032 0.305 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -3.928 -13.873 -1.246 1.00 0.00 H new ATOM 2075 N TYR A 138 -1.118 -9.935 -2.861 1.00 0.00 N ATOM 2076 CA TYR A 138 -1.074 -8.506 -2.853 1.00 0.00 C ATOM 2077 C TYR A 138 -1.289 -7.960 -1.484 1.00 0.00 C ATOM 2078 O TYR A 138 -0.548 -7.125 -0.968 1.00 0.00 O ATOM 2079 CB TYR A 138 -2.108 -8.166 -3.939 1.00 0.00 C ATOM 2080 CG TYR A 138 -2.158 -6.688 -4.121 1.00 0.00 C ATOM 2081 CD1 TYR A 138 -1.006 -5.969 -4.337 1.00 0.00 C ATOM 2082 CD2 TYR A 138 -3.312 -5.956 -3.969 1.00 0.00 C ATOM 2083 CE1 TYR A 138 -0.984 -4.609 -4.134 1.00 0.00 C ATOM 2084 CE2 TYR A 138 -3.353 -4.582 -3.972 1.00 0.00 C ATOM 2085 CZ TYR A 138 -2.159 -3.903 -4.030 1.00 0.00 C ATOM 2086 OH TYR A 138 -2.128 -2.492 -4.006 1.00 0.00 O ATOM 0 H TYR A 138 -1.931 -10.325 -3.338 1.00 0.00 H new ATOM 0 HA TYR A 138 -0.116 -8.041 -3.087 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -1.840 -8.651 -4.878 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -3.090 -8.543 -3.654 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -0.112 -6.476 -4.669 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -4.241 -6.492 -3.840 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -0.039 -4.093 -4.056 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -4.293 -4.053 -3.930 1.00 0.00 H new ATOM 0 HH TYR A 138 -3.042 -2.146 -3.930 1.00 0.00 H new ATOM 2096 N GLU A 139 -2.241 -8.472 -0.684 1.00 0.00 N ATOM 2097 CA GLU A 139 -2.513 -7.856 0.577 1.00 0.00 C ATOM 2098 C GLU A 139 -1.349 -8.002 1.496 1.00 0.00 C ATOM 2099 O GLU A 139 -1.003 -7.105 2.263 1.00 0.00 O ATOM 2100 CB GLU A 139 -3.821 -8.301 1.254 1.00 0.00 C ATOM 2101 CG GLU A 139 -4.353 -7.340 2.319 1.00 0.00 C ATOM 2102 CD GLU A 139 -4.988 -6.118 1.671 1.00 0.00 C ATOM 2103 OE1 GLU A 139 -6.109 -6.214 1.105 1.00 0.00 O ATOM 2104 OE2 GLU A 139 -4.391 -5.012 1.768 1.00 0.00 O ATOM 0 H GLU A 139 -2.809 -9.291 -0.902 1.00 0.00 H new ATOM 0 HA GLU A 139 -2.669 -6.801 0.352 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -4.585 -8.430 0.487 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -3.662 -9.277 1.713 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -5.087 -7.850 2.942 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -3.540 -7.029 2.974 1.00 0.00 H new ATOM 2111 N GLU A 140 -0.601 -9.110 1.353 1.00 0.00 N ATOM 2112 CA GLU A 140 0.590 -9.455 2.066 1.00 0.00 C ATOM 2113 C GLU A 140 1.728 -8.616 1.596 1.00 0.00 C ATOM 2114 O GLU A 140 2.515 -8.042 2.346 1.00 0.00 O ATOM 2115 CB GLU A 140 0.847 -10.965 1.929 1.00 0.00 C ATOM 2116 CG GLU A 140 -0.184 -11.977 2.435 1.00 0.00 C ATOM 2117 CD GLU A 140 0.158 -13.430 2.138 1.00 0.00 C ATOM 2118 OE1 GLU A 140 0.268 -14.015 1.028 1.00 0.00 O ATOM 2119 OE2 GLU A 140 0.054 -14.078 3.214 1.00 0.00 O ATOM 0 H GLU A 140 -0.855 -9.829 0.676 1.00 0.00 H new ATOM 0 HA GLU A 140 0.474 -9.246 3.129 1.00 0.00 H new ATOM 0 HB2 GLU A 140 1.006 -11.170 0.870 1.00 0.00 H new ATOM 0 HB3 GLU A 140 1.786 -11.179 2.440 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -0.294 -11.856 3.513 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -1.151 -11.746 1.988 1.00 0.00 H new ATOM 2126 N PHE A 141 1.828 -8.251 0.305 1.00 0.00 N ATOM 2127 CA PHE A 141 2.740 -7.344 -0.319 1.00 0.00 C ATOM 2128 C PHE A 141 2.391 -5.944 0.055 1.00 0.00 C ATOM 2129 O PHE A 141 3.340 -5.175 0.199 1.00 0.00 O ATOM 2130 CB PHE A 141 2.636 -7.432 -1.851 1.00 0.00 C ATOM 2131 CG PHE A 141 3.697 -6.734 -2.631 1.00 0.00 C ATOM 2132 CD1 PHE A 141 4.995 -7.168 -2.502 1.00 0.00 C ATOM 2133 CD2 PHE A 141 3.411 -5.575 -3.313 1.00 0.00 C ATOM 2134 CE1 PHE A 141 6.019 -6.397 -2.999 1.00 0.00 C ATOM 2135 CE2 PHE A 141 4.398 -4.943 -4.033 1.00 0.00 C ATOM 2136 CZ PHE A 141 5.696 -5.352 -3.832 1.00 0.00 C ATOM 0 H PHE A 141 1.186 -8.644 -0.384 1.00 0.00 H new ATOM 0 HA PHE A 141 3.745 -7.609 0.011 1.00 0.00 H new ATOM 0 HB2 PHE A 141 2.642 -8.485 -2.133 1.00 0.00 H new ATOM 0 HB3 PHE A 141 1.670 -7.027 -2.151 1.00 0.00 H new ATOM 0 HD1 PHE A 141 5.209 -8.107 -2.014 1.00 0.00 H new ATOM 0 HD2 PHE A 141 2.414 -5.162 -3.283 1.00 0.00 H new ATOM 0 HE1 PHE A 141 7.047 -6.606 -2.743 1.00 0.00 H new ATOM 0 HE2 PHE A 141 4.162 -4.154 -4.731 1.00 0.00 H new ATOM 0 HZ PHE A 141 6.491 -4.833 -4.348 1.00 0.00 H new ATOM 2146 N VAL A 142 1.139 -5.491 0.244 1.00 0.00 N ATOM 2147 CA VAL A 142 0.761 -4.196 0.719 1.00 0.00 C ATOM 2148 C VAL A 142 1.226 -4.033 2.125 1.00 0.00 C ATOM 2149 O VAL A 142 1.840 -2.996 2.370 1.00 0.00 O ATOM 2150 CB VAL A 142 -0.723 -3.980 0.687 1.00 0.00 C ATOM 2151 CG1 VAL A 142 -1.032 -2.543 1.139 1.00 0.00 C ATOM 2152 CG2 VAL A 142 -1.251 -4.096 -0.753 1.00 0.00 C ATOM 0 H VAL A 142 0.328 -6.078 0.049 1.00 0.00 H new ATOM 0 HA VAL A 142 1.224 -3.465 0.057 1.00 0.00 H new ATOM 0 HB VAL A 142 -1.187 -4.725 1.334 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -2.109 -2.379 1.118 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -0.662 -2.393 2.153 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -0.544 -1.837 0.467 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -2.329 -3.937 -0.759 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -0.770 -3.344 -1.379 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -1.029 -5.089 -1.143 1.00 0.00 H new ATOM 2162 N GLN A 143 1.071 -5.065 2.974 1.00 0.00 N ATOM 2163 CA GLN A 143 1.553 -5.007 4.319 1.00 0.00 C ATOM 2164 C GLN A 143 3.038 -4.891 4.323 1.00 0.00 C ATOM 2165 O GLN A 143 3.607 -4.039 5.004 1.00 0.00 O ATOM 2166 CB GLN A 143 1.096 -6.247 5.107 1.00 0.00 C ATOM 2167 CG GLN A 143 1.078 -5.939 6.605 1.00 0.00 C ATOM 2168 CD GLN A 143 0.620 -7.223 7.283 1.00 0.00 C ATOM 2169 OE1 GLN A 143 -0.340 -7.186 8.051 1.00 0.00 O ATOM 2170 NE2 GLN A 143 1.325 -8.364 7.058 1.00 0.00 N ATOM 0 H GLN A 143 0.611 -5.941 2.728 1.00 0.00 H new ATOM 0 HA GLN A 143 1.137 -4.126 4.807 1.00 0.00 H new ATOM 0 HB2 GLN A 143 0.102 -6.551 4.778 1.00 0.00 H new ATOM 0 HB3 GLN A 143 1.767 -7.082 4.907 1.00 0.00 H new ATOM 0 HG2 GLN A 143 2.066 -5.642 6.956 1.00 0.00 H new ATOM 0 HG3 GLN A 143 0.400 -5.115 6.827 1.00 0.00 H new ATOM 0 HE21 GLN A 143 2.116 -8.356 6.414 1.00 0.00 H new ATOM 0 HE22 GLN A 143 1.063 -9.228 7.533 1.00 0.00 H new ATOM 2179 N MET A 144 3.714 -5.735 3.524 1.00 0.00 N ATOM 2180 CA MET A 144 5.115 -5.655 3.251 1.00 0.00 C ATOM 2181 C MET A 144 5.593 -4.307 2.835 1.00 0.00 C ATOM 2182 O MET A 144 6.565 -3.825 3.415 1.00 0.00 O ATOM 2183 CB MET A 144 5.507 -6.773 2.269 1.00 0.00 C ATOM 2184 CG MET A 144 6.942 -6.859 1.748 1.00 0.00 C ATOM 2185 SD MET A 144 7.338 -8.078 0.459 1.00 0.00 S ATOM 2186 CE MET A 144 7.423 -9.527 1.552 1.00 0.00 C ATOM 0 H MET A 144 3.260 -6.512 3.044 1.00 0.00 H new ATOM 0 HA MET A 144 5.639 -5.814 4.193 1.00 0.00 H new ATOM 0 HB2 MET A 144 5.279 -7.724 2.751 1.00 0.00 H new ATOM 0 HB3 MET A 144 4.851 -6.689 1.402 1.00 0.00 H new ATOM 0 HG2 MET A 144 7.213 -5.875 1.365 1.00 0.00 H new ATOM 0 HG3 MET A 144 7.591 -7.059 2.601 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.063 -10.286 1.101 1.00 0.00 H new ATOM 0 HE2 MET A 144 7.835 -9.231 2.517 1.00 0.00 H new ATOM 0 HE3 MET A 144 6.422 -9.935 1.694 1.00 0.00 H new ATOM 2196 N MET A 145 4.985 -3.638 1.839 1.00 0.00 N ATOM 2197 CA MET A 145 5.547 -2.425 1.331 1.00 0.00 C ATOM 2198 C MET A 145 5.181 -1.235 2.150 1.00 0.00 C ATOM 2199 O MET A 145 5.706 -0.124 2.115 1.00 0.00 O ATOM 2200 CB MET A 145 5.254 -2.289 -0.172 1.00 0.00 C ATOM 2201 CG MET A 145 5.986 -3.320 -1.034 1.00 0.00 C ATOM 2202 SD MET A 145 7.800 -3.353 -0.916 1.00 0.00 S ATOM 2203 CE MET A 145 8.264 -1.705 -1.523 1.00 0.00 C ATOM 0 H MET A 145 4.117 -3.931 1.391 1.00 0.00 H new ATOM 0 HA MET A 145 6.632 -2.476 1.426 1.00 0.00 H new ATOM 0 HB2 MET A 145 4.181 -2.388 -0.335 1.00 0.00 H new ATOM 0 HB3 MET A 145 5.535 -1.288 -0.500 1.00 0.00 H new ATOM 0 HG2 MET A 145 5.611 -4.309 -0.771 1.00 0.00 H new ATOM 0 HG3 MET A 145 5.717 -3.143 -2.075 1.00 0.00 H new ATOM 0 HE1 MET A 145 9.349 -1.601 -1.500 1.00 0.00 H new ATOM 0 HE2 MET A 145 7.909 -1.581 -2.546 1.00 0.00 H new ATOM 0 HE3 MET A 145 7.813 -0.943 -0.888 1.00 0.00 H new