USER MOD reduce.3.24.130724 H: found=0, std=0, add=625, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 623 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 79 SER OG : rot 180:sc= -0.828! USER MOD Single : A 81 HIS :FLIP no HD1:sc= -5.71! C(o=-6.3!,f=-5.7!) USER MOD Single : A 85 SER OG : rot -17:sc= 0.108 USER MOD Single : A 87 MET CE :methyl -151:sc= -0.1 (180deg=-1.04) USER MOD Single : A 90 THR OG1 : rot 180:sc= -1.35! USER MOD Single : A 92 TYR OH : rot 180:sc= -0.572 USER MOD Single : A 94 THR OG1 : rot 46:sc= 0.921 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= -0.767 K(o=-0.77,f=-1.3) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -4.58! C(o=-4.6!,f=-4.1!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.0535 USER MOD Single : A 116 CYS SG : rot 166:sc= -0.0679 USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl 166:sc= 0 (180deg=-0.247) USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 LYS NZ :NH3+ -175:sc= -0.724 (180deg=-0.79) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 155:sc= 0.192 (180deg=0.0598) USER MOD Single : A 142 SER OG : rot 129:sc= -1.39! USER MOD Single : A 144 GLN : amide:sc= -4.78! C(o=-4.8!,f=-11!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 75 -20.528 12.461 -6.151 1.00 0.00 N ATOM 2 CA ALA A 75 -20.421 13.072 -7.469 1.00 0.00 C ATOM 3 C ALA A 75 -19.095 13.808 -7.627 1.00 0.00 C ATOM 4 O ALA A 75 -18.703 14.592 -6.765 1.00 0.00 O ATOM 5 CB ALA A 75 -21.586 14.023 -7.705 1.00 0.00 C ATOM 0 HA ALA A 75 -20.457 12.278 -8.215 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -21.494 14.473 -8.694 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -22.524 13.471 -7.643 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -21.575 14.807 -6.947 1.00 0.00 H new ATOM 11 N ALA A 76 -18.409 13.548 -8.735 1.00 0.00 N ATOM 12 CA ALA A 76 -17.126 14.186 -9.005 1.00 0.00 C ATOM 13 C ALA A 76 -16.129 13.905 -7.886 1.00 0.00 C ATOM 14 O ALA A 76 -16.513 13.735 -6.729 1.00 0.00 O ATOM 15 CB ALA A 76 -17.311 15.684 -9.189 1.00 0.00 C ATOM 0 H ALA A 76 -18.720 12.901 -9.460 1.00 0.00 H new ATOM 0 HA ALA A 76 -16.724 13.766 -9.927 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -16.345 16.148 -9.390 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -17.983 15.867 -10.027 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -17.737 16.112 -8.282 1.00 0.00 H new ATOM 21 N GLU A 77 -14.849 13.861 -8.239 1.00 0.00 N ATOM 22 CA GLU A 77 -13.796 13.601 -7.262 1.00 0.00 C ATOM 23 C GLU A 77 -13.736 14.712 -6.220 1.00 0.00 C ATOM 24 O GLU A 77 -13.445 15.864 -6.541 1.00 0.00 O ATOM 25 CB GLU A 77 -12.444 13.468 -7.963 1.00 0.00 C ATOM 26 CG GLU A 77 -11.948 12.034 -8.059 1.00 0.00 C ATOM 27 CD GLU A 77 -10.703 11.903 -8.914 1.00 0.00 C ATOM 28 OE1 GLU A 77 -10.732 12.357 -10.077 1.00 0.00 O ATOM 29 OE2 GLU A 77 -9.701 11.344 -8.422 1.00 0.00 O ATOM 0 H GLU A 77 -14.515 14.002 -9.192 1.00 0.00 H new ATOM 0 HA GLU A 77 -14.027 12.664 -6.755 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -12.522 13.885 -8.967 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -11.706 14.064 -7.427 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -11.738 11.659 -7.058 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -12.737 11.408 -8.475 1.00 0.00 H new ATOM 36 N ILE A 78 -14.015 14.359 -4.969 1.00 0.00 N ATOM 37 CA ILE A 78 -13.994 15.323 -3.877 1.00 0.00 C ATOM 38 C ILE A 78 -12.737 15.169 -3.033 1.00 0.00 C ATOM 39 O ILE A 78 -12.423 16.020 -2.201 1.00 0.00 O ATOM 40 CB ILE A 78 -15.226 15.172 -2.964 1.00 0.00 C ATOM 41 CG1 ILE A 78 -16.239 14.198 -3.571 1.00 0.00 C ATOM 42 CG2 ILE A 78 -15.870 16.527 -2.712 1.00 0.00 C ATOM 43 CD1 ILE A 78 -15.917 12.744 -3.298 1.00 0.00 C ATOM 0 H ILE A 78 -14.259 13.410 -4.687 1.00 0.00 H new ATOM 0 HA ILE A 78 -14.008 16.313 -4.334 1.00 0.00 H new ATOM 0 HB ILE A 78 -14.895 14.763 -2.009 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -17.229 14.423 -3.176 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -16.283 14.356 -4.649 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -16.739 16.402 -2.065 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -15.150 17.188 -2.229 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -16.183 16.963 -3.661 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -16.676 12.111 -3.757 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -14.941 12.503 -3.718 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -15.902 12.570 -2.222 1.00 0.00 H new ATOM 55 N SER A 79 -12.028 14.076 -3.259 1.00 0.00 N ATOM 56 CA SER A 79 -10.799 13.783 -2.530 1.00 0.00 C ATOM 57 C SER A 79 -10.283 12.395 -2.891 1.00 0.00 C ATOM 58 O SER A 79 -10.529 11.898 -3.989 1.00 0.00 O ATOM 59 CB SER A 79 -11.041 13.873 -1.021 1.00 0.00 C ATOM 60 OG SER A 79 -11.372 12.605 -0.482 1.00 0.00 O ATOM 0 H SER A 79 -12.283 13.369 -3.948 1.00 0.00 H new ATOM 0 HA SER A 79 -10.048 14.521 -2.812 1.00 0.00 H new ATOM 0 HB2 SER A 79 -10.149 14.259 -0.529 1.00 0.00 H new ATOM 0 HB3 SER A 79 -11.847 14.579 -0.820 1.00 0.00 H new ATOM 0 HG SER A 79 -11.520 12.688 0.483 1.00 0.00 H new ATOM 66 N GLY A 80 -9.569 11.770 -1.960 1.00 0.00 N ATOM 67 CA GLY A 80 -9.038 10.443 -2.206 1.00 0.00 C ATOM 68 C GLY A 80 -8.582 9.754 -0.935 1.00 0.00 C ATOM 69 O GLY A 80 -9.226 9.870 0.108 1.00 0.00 O ATOM 0 H GLY A 80 -9.349 12.158 -1.043 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -9.801 9.834 -2.691 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -8.199 10.514 -2.898 1.00 0.00 H new ATOM 73 N HIS A 81 -7.467 9.035 -1.022 1.00 0.00 N ATOM 74 CA HIS A 81 -6.924 8.322 0.129 1.00 0.00 C ATOM 75 C HIS A 81 -5.726 7.471 -0.275 1.00 0.00 C ATOM 76 O HIS A 81 -5.856 6.269 -0.504 1.00 0.00 O ATOM 77 CB HIS A 81 -7.998 7.437 0.761 1.00 0.00 C ATOM 78 CG HIS A 81 -7.504 6.635 1.925 1.00 0.00 C ATOM 79 ND1 HIS A 81 -6.713 5.535 1.975 1.00 0.00 N flip ATOM 80 CD2 HIS A 81 -7.820 6.936 3.234 1.00 0.00 C flip ATOM 81 CE1 HIS A 81 -6.568 5.198 3.297 1.00 0.00 C flip ATOM 82 NE2 HIS A 81 -7.244 6.059 4.036 1.00 0.00 N flip ATOM 0 H HIS A 81 -6.922 8.931 -1.878 1.00 0.00 H new ATOM 0 HA HIS A 81 -6.595 9.061 0.859 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -8.828 8.064 1.088 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -8.390 6.759 0.003 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -8.441 7.760 3.553 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -5.994 4.364 3.673 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -7.310 6.048 5.054 1.00 0.00 H new ATOM 91 N ILE A 82 -4.559 8.101 -0.359 1.00 0.00 N ATOM 92 CA ILE A 82 -3.342 7.396 -0.734 1.00 0.00 C ATOM 93 C ILE A 82 -2.336 7.392 0.409 1.00 0.00 C ATOM 94 O ILE A 82 -2.317 8.300 1.239 1.00 0.00 O ATOM 95 CB ILE A 82 -2.686 8.023 -1.977 1.00 0.00 C ATOM 96 CG1 ILE A 82 -3.759 8.464 -2.968 1.00 0.00 C ATOM 97 CG2 ILE A 82 -1.731 7.035 -2.630 1.00 0.00 C ATOM 98 CD1 ILE A 82 -3.202 9.075 -4.235 1.00 0.00 C ATOM 0 H ILE A 82 -4.432 9.096 -0.173 1.00 0.00 H new ATOM 0 HA ILE A 82 -3.631 6.371 -0.965 1.00 0.00 H new ATOM 0 HB ILE A 82 -2.114 8.898 -1.668 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -4.375 7.604 -3.230 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.413 9.188 -2.483 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -1.276 7.495 -3.507 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -0.952 6.759 -1.920 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -2.280 6.143 -2.931 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -4.023 9.364 -4.891 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -2.610 9.955 -3.985 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -2.571 8.346 -4.743 1.00 0.00 H new ATOM 110 N VAL A 83 -1.502 6.363 0.441 1.00 0.00 N ATOM 111 CA VAL A 83 -0.487 6.234 1.481 1.00 0.00 C ATOM 112 C VAL A 83 0.911 6.450 0.911 1.00 0.00 C ATOM 113 O VAL A 83 1.840 5.705 1.220 1.00 0.00 O ATOM 114 CB VAL A 83 -0.550 4.854 2.168 1.00 0.00 C ATOM 115 CG1 VAL A 83 0.126 3.793 1.312 1.00 0.00 C ATOM 116 CG2 VAL A 83 0.086 4.917 3.548 1.00 0.00 C ATOM 0 H VAL A 83 -1.507 5.604 -0.241 1.00 0.00 H new ATOM 0 HA VAL A 83 -0.696 7.004 2.224 1.00 0.00 H new ATOM 0 HB VAL A 83 -1.598 4.577 2.284 1.00 0.00 H new ATOM 0 HG11 VAL A 83 0.069 2.828 1.816 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -0.378 3.728 0.348 1.00 0.00 H new ATOM 0 HG13 VAL A 83 1.171 4.061 1.158 1.00 0.00 H new ATOM 0 HG21 VAL A 83 0.033 3.935 4.018 1.00 0.00 H new ATOM 0 HG22 VAL A 83 1.129 5.219 3.454 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -0.448 5.643 4.162 1.00 0.00 H new ATOM 126 N ARG A 84 1.048 7.477 0.076 1.00 0.00 N ATOM 127 CA ARG A 84 2.329 7.799 -0.544 1.00 0.00 C ATOM 128 C ARG A 84 3.488 7.474 0.391 1.00 0.00 C ATOM 129 O ARG A 84 3.475 7.847 1.564 1.00 0.00 O ATOM 130 CB ARG A 84 2.373 9.278 -0.934 1.00 0.00 C ATOM 131 CG ARG A 84 1.642 10.187 0.041 1.00 0.00 C ATOM 132 CD ARG A 84 2.318 10.203 1.403 1.00 0.00 C ATOM 133 NE ARG A 84 2.246 11.517 2.034 1.00 0.00 N ATOM 134 CZ ARG A 84 1.116 12.068 2.464 1.00 0.00 C ATOM 135 NH1 ARG A 84 -0.034 11.419 2.331 1.00 0.00 N ATOM 136 NH2 ARG A 84 1.133 13.268 3.027 1.00 0.00 N ATOM 0 H ARG A 84 0.285 8.101 -0.187 1.00 0.00 H new ATOM 0 HA ARG A 84 2.431 7.189 -1.441 1.00 0.00 H new ATOM 0 HB2 ARG A 84 3.413 9.596 -1.004 1.00 0.00 H new ATOM 0 HB3 ARG A 84 1.936 9.397 -1.926 1.00 0.00 H new ATOM 0 HG2 ARG A 84 1.607 11.200 -0.361 1.00 0.00 H new ATOM 0 HG3 ARG A 84 0.611 9.851 0.150 1.00 0.00 H new ATOM 0 HD2 ARG A 84 1.846 9.464 2.050 1.00 0.00 H new ATOM 0 HD3 ARG A 84 3.362 9.910 1.293 1.00 0.00 H new ATOM 0 HE ARG A 84 3.112 12.042 2.152 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -0.051 10.496 1.898 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -0.900 11.844 2.662 1.00 0.00 H new ATOM 0 HH21 ARG A 84 2.015 13.770 3.131 1.00 0.00 H new ATOM 0 HH22 ARG A 84 0.264 13.689 3.356 1.00 0.00 H new ATOM 150 N SER A 85 4.487 6.776 -0.137 1.00 0.00 N ATOM 151 CA SER A 85 5.654 6.400 0.649 1.00 0.00 C ATOM 152 C SER A 85 6.017 7.499 1.643 1.00 0.00 C ATOM 153 O SER A 85 6.690 8.469 1.292 1.00 0.00 O ATOM 154 CB SER A 85 6.843 6.117 -0.270 1.00 0.00 C ATOM 155 OG SER A 85 7.585 7.298 -0.525 1.00 0.00 O ATOM 0 H SER A 85 4.511 6.459 -1.106 1.00 0.00 H new ATOM 0 HA SER A 85 5.410 5.496 1.206 1.00 0.00 H new ATOM 0 HB2 SER A 85 7.490 5.369 0.188 1.00 0.00 H new ATOM 0 HB3 SER A 85 6.487 5.697 -1.211 1.00 0.00 H new ATOM 0 HG SER A 85 7.043 8.081 -0.293 1.00 0.00 H new ATOM 161 N PRO A 86 5.578 7.359 2.905 1.00 0.00 N ATOM 162 CA PRO A 86 5.862 8.343 3.954 1.00 0.00 C ATOM 163 C PRO A 86 7.358 8.557 4.141 1.00 0.00 C ATOM 164 O PRO A 86 7.787 9.528 4.765 1.00 0.00 O ATOM 165 CB PRO A 86 5.243 7.729 5.218 1.00 0.00 C ATOM 166 CG PRO A 86 5.015 6.291 4.889 1.00 0.00 C ATOM 167 CD PRO A 86 4.777 6.234 3.409 1.00 0.00 C ATOM 0 HA PRO A 86 5.455 9.325 3.711 1.00 0.00 H new ATOM 0 HB2 PRO A 86 5.910 7.835 6.074 1.00 0.00 H new ATOM 0 HB3 PRO A 86 4.308 8.225 5.479 1.00 0.00 H new ATOM 0 HG2 PRO A 86 5.878 5.686 5.168 1.00 0.00 H new ATOM 0 HG3 PRO A 86 4.159 5.897 5.437 1.00 0.00 H new ATOM 0 HD2 PRO A 86 5.102 5.284 2.984 1.00 0.00 H new ATOM 0 HD3 PRO A 86 3.721 6.348 3.165 1.00 0.00 H new ATOM 175 N MET A 87 8.148 7.643 3.589 1.00 0.00 N ATOM 176 CA MET A 87 9.600 7.724 3.683 1.00 0.00 C ATOM 177 C MET A 87 10.251 7.060 2.473 1.00 0.00 C ATOM 178 O MET A 87 9.601 6.321 1.735 1.00 0.00 O ATOM 179 CB MET A 87 10.089 7.061 4.972 1.00 0.00 C ATOM 180 CG MET A 87 10.305 5.563 4.844 1.00 0.00 C ATOM 181 SD MET A 87 9.599 4.638 6.221 1.00 0.00 S ATOM 182 CE MET A 87 10.242 5.562 7.614 1.00 0.00 C ATOM 0 H MET A 87 7.805 6.835 3.070 1.00 0.00 H new ATOM 0 HA MET A 87 9.885 8.776 3.700 1.00 0.00 H new ATOM 0 HB2 MET A 87 11.024 7.529 5.279 1.00 0.00 H new ATOM 0 HB3 MET A 87 9.364 7.248 5.764 1.00 0.00 H new ATOM 0 HG2 MET A 87 9.861 5.214 3.912 1.00 0.00 H new ATOM 0 HG3 MET A 87 11.374 5.358 4.784 1.00 0.00 H new ATOM 0 HE1 MET A 87 10.355 4.897 8.471 1.00 0.00 H new ATOM 0 HE2 MET A 87 11.212 5.985 7.353 1.00 0.00 H new ATOM 0 HE3 MET A 87 9.551 6.366 7.867 1.00 0.00 H new ATOM 192 N VAL A 88 11.536 7.329 2.276 1.00 0.00 N ATOM 193 CA VAL A 88 12.269 6.756 1.156 1.00 0.00 C ATOM 194 C VAL A 88 12.499 5.262 1.361 1.00 0.00 C ATOM 195 O VAL A 88 13.593 4.836 1.731 1.00 0.00 O ATOM 196 CB VAL A 88 13.628 7.456 0.959 1.00 0.00 C ATOM 197 CG1 VAL A 88 14.325 7.651 2.295 1.00 0.00 C ATOM 198 CG2 VAL A 88 14.505 6.665 0.000 1.00 0.00 C ATOM 0 H VAL A 88 12.090 7.939 2.877 1.00 0.00 H new ATOM 0 HA VAL A 88 11.661 6.907 0.264 1.00 0.00 H new ATOM 0 HB VAL A 88 13.450 8.438 0.521 1.00 0.00 H new ATOM 0 HG11 VAL A 88 15.283 8.147 2.137 1.00 0.00 H new ATOM 0 HG12 VAL A 88 13.701 8.265 2.944 1.00 0.00 H new ATOM 0 HG13 VAL A 88 14.491 6.681 2.764 1.00 0.00 H new ATOM 0 HG21 VAL A 88 15.460 7.176 -0.126 1.00 0.00 H new ATOM 0 HG22 VAL A 88 14.678 5.667 0.404 1.00 0.00 H new ATOM 0 HG23 VAL A 88 14.007 6.584 -0.966 1.00 0.00 H new ATOM 208 N GLY A 89 11.460 4.469 1.117 1.00 0.00 N ATOM 209 CA GLY A 89 11.568 3.032 1.281 1.00 0.00 C ATOM 210 C GLY A 89 11.117 2.271 0.050 1.00 0.00 C ATOM 211 O GLY A 89 11.569 2.549 -1.060 1.00 0.00 O ATOM 0 H GLY A 89 10.545 4.797 0.808 1.00 0.00 H new ATOM 0 HA2 GLY A 89 12.602 2.772 1.506 1.00 0.00 H new ATOM 0 HA3 GLY A 89 10.968 2.721 2.136 1.00 0.00 H new ATOM 215 N THR A 90 10.224 1.305 0.247 1.00 0.00 N ATOM 216 CA THR A 90 9.715 0.499 -0.857 1.00 0.00 C ATOM 217 C THR A 90 8.268 0.086 -0.608 1.00 0.00 C ATOM 218 O THR A 90 7.918 -0.352 0.487 1.00 0.00 O ATOM 219 CB THR A 90 10.584 -0.743 -1.052 1.00 0.00 C ATOM 220 OG1 THR A 90 11.824 -0.401 -1.646 1.00 0.00 O ATOM 221 CG2 THR A 90 9.934 -1.799 -1.920 1.00 0.00 C ATOM 0 H THR A 90 9.839 1.062 1.160 1.00 0.00 H new ATOM 0 HA THR A 90 9.751 1.105 -1.762 1.00 0.00 H new ATOM 0 HB THR A 90 10.726 -1.155 -0.053 1.00 0.00 H new ATOM 0 HG1 THR A 90 12.366 -1.209 -1.761 1.00 0.00 H new ATOM 0 HG21 THR A 90 10.604 -2.653 -2.017 1.00 0.00 H new ATOM 0 HG22 THR A 90 8.999 -2.122 -1.462 1.00 0.00 H new ATOM 0 HG23 THR A 90 9.730 -1.384 -2.907 1.00 0.00 H new ATOM 229 N PHE A 91 7.433 0.225 -1.633 1.00 0.00 N ATOM 230 CA PHE A 91 6.024 -0.137 -1.526 1.00 0.00 C ATOM 231 C PHE A 91 5.787 -1.551 -2.049 1.00 0.00 C ATOM 232 O PHE A 91 6.431 -1.988 -3.005 1.00 0.00 O ATOM 233 CB PHE A 91 5.157 0.861 -2.300 1.00 0.00 C ATOM 234 CG PHE A 91 3.810 0.317 -2.691 1.00 0.00 C ATOM 235 CD1 PHE A 91 3.674 -0.489 -3.816 1.00 0.00 C ATOM 236 CD2 PHE A 91 2.678 0.608 -1.934 1.00 0.00 C ATOM 237 CE1 PHE A 91 2.437 -0.994 -4.180 1.00 0.00 C ATOM 238 CE2 PHE A 91 1.439 0.104 -2.293 1.00 0.00 C ATOM 239 CZ PHE A 91 1.318 -0.697 -3.417 1.00 0.00 C ATOM 0 H PHE A 91 7.708 0.586 -2.547 1.00 0.00 H new ATOM 0 HA PHE A 91 5.744 -0.106 -0.473 1.00 0.00 H new ATOM 0 HB2 PHE A 91 5.015 1.754 -1.691 1.00 0.00 H new ATOM 0 HB3 PHE A 91 5.689 1.170 -3.200 1.00 0.00 H new ATOM 0 HD1 PHE A 91 4.543 -0.724 -4.413 1.00 0.00 H new ATOM 0 HD2 PHE A 91 2.767 1.233 -1.058 1.00 0.00 H new ATOM 0 HE1 PHE A 91 2.344 -1.618 -5.057 1.00 0.00 H new ATOM 0 HE2 PHE A 91 0.568 0.335 -1.698 1.00 0.00 H new ATOM 0 HZ PHE A 91 0.352 -1.090 -3.699 1.00 0.00 H new ATOM 249 N TYR A 92 4.859 -2.259 -1.414 1.00 0.00 N ATOM 250 CA TYR A 92 4.533 -3.623 -1.811 1.00 0.00 C ATOM 251 C TYR A 92 3.032 -3.878 -1.715 1.00 0.00 C ATOM 252 O TYR A 92 2.313 -3.161 -1.019 1.00 0.00 O ATOM 253 CB TYR A 92 5.283 -4.626 -0.935 1.00 0.00 C ATOM 254 CG TYR A 92 6.764 -4.697 -1.227 1.00 0.00 C ATOM 255 CD1 TYR A 92 7.245 -4.520 -2.523 1.00 0.00 C ATOM 256 CD2 TYR A 92 7.683 -4.940 -0.209 1.00 0.00 C ATOM 257 CE1 TYR A 92 8.603 -4.585 -2.795 1.00 0.00 C ATOM 258 CE2 TYR A 92 9.041 -5.006 -0.472 1.00 0.00 C ATOM 259 CZ TYR A 92 9.496 -4.828 -1.766 1.00 0.00 C ATOM 260 OH TYR A 92 10.844 -4.891 -2.032 1.00 0.00 O ATOM 0 H TYR A 92 4.319 -1.910 -0.622 1.00 0.00 H new ATOM 0 HA TYR A 92 4.841 -3.751 -2.849 1.00 0.00 H new ATOM 0 HB2 TYR A 92 5.140 -4.359 0.112 1.00 0.00 H new ATOM 0 HB3 TYR A 92 4.846 -5.615 -1.074 1.00 0.00 H new ATOM 0 HD1 TYR A 92 6.550 -4.329 -3.327 1.00 0.00 H new ATOM 0 HD2 TYR A 92 7.331 -5.079 0.802 1.00 0.00 H new ATOM 0 HE1 TYR A 92 8.962 -4.447 -3.804 1.00 0.00 H new ATOM 0 HE2 TYR A 92 9.741 -5.195 0.329 1.00 0.00 H new ATOM 0 HH TYR A 92 11.333 -5.067 -1.202 1.00 0.00 H new ATOM 270 N ARG A 93 2.570 -4.905 -2.418 1.00 0.00 N ATOM 271 CA ARG A 93 1.157 -5.261 -2.414 1.00 0.00 C ATOM 272 C ARG A 93 0.983 -6.776 -2.433 1.00 0.00 C ATOM 273 O ARG A 93 -0.044 -7.288 -2.877 1.00 0.00 O ATOM 274 CB ARG A 93 0.449 -4.636 -3.616 1.00 0.00 C ATOM 275 CG ARG A 93 0.614 -5.429 -4.901 1.00 0.00 C ATOM 276 CD ARG A 93 0.068 -4.668 -6.097 1.00 0.00 C ATOM 277 NE ARG A 93 -1.250 -5.152 -6.498 1.00 0.00 N ATOM 278 CZ ARG A 93 -1.491 -6.403 -6.877 1.00 0.00 C ATOM 279 NH1 ARG A 93 -0.505 -7.290 -6.912 1.00 0.00 N ATOM 280 NH2 ARG A 93 -2.718 -6.768 -7.224 1.00 0.00 N ATOM 0 H ARG A 93 3.154 -5.506 -2.999 1.00 0.00 H new ATOM 0 HA ARG A 93 0.709 -4.873 -1.499 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -0.613 -4.541 -3.392 1.00 0.00 H new ATOM 0 HB3 ARG A 93 0.834 -3.628 -3.769 1.00 0.00 H new ATOM 0 HG2 ARG A 93 1.669 -5.651 -5.060 1.00 0.00 H new ATOM 0 HG3 ARG A 93 0.098 -6.384 -4.809 1.00 0.00 H new ATOM 0 HD2 ARG A 93 0.006 -3.607 -5.854 1.00 0.00 H new ATOM 0 HD3 ARG A 93 0.760 -4.764 -6.934 1.00 0.00 H new ATOM 0 HE ARG A 93 -2.029 -4.494 -6.487 1.00 0.00 H new ATOM 0 HH11 ARG A 93 0.440 -7.012 -6.648 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -0.692 -8.249 -7.203 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -3.478 -6.088 -7.200 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -2.901 -7.728 -7.515 1.00 0.00 H new ATOM 294 N THR A 94 1.996 -7.486 -1.948 1.00 0.00 N ATOM 295 CA THR A 94 1.960 -8.943 -1.906 1.00 0.00 C ATOM 296 C THR A 94 2.388 -9.456 -0.535 1.00 0.00 C ATOM 297 O THR A 94 3.577 -9.495 -0.217 1.00 0.00 O ATOM 298 CB THR A 94 2.870 -9.527 -2.988 1.00 0.00 C ATOM 299 OG1 THR A 94 4.211 -9.119 -2.789 1.00 0.00 O ATOM 300 CG2 THR A 94 2.469 -9.119 -4.390 1.00 0.00 C ATOM 0 H THR A 94 2.853 -7.075 -1.578 1.00 0.00 H new ATOM 0 HA THR A 94 0.935 -9.263 -2.091 1.00 0.00 H new ATOM 0 HB THR A 94 2.769 -10.609 -2.898 1.00 0.00 H new ATOM 0 HG1 THR A 94 4.449 -9.226 -1.844 1.00 0.00 H new ATOM 0 HG21 THR A 94 3.155 -9.567 -5.109 1.00 0.00 H new ATOM 0 HG22 THR A 94 1.455 -9.463 -4.593 1.00 0.00 H new ATOM 0 HG23 THR A 94 2.509 -8.033 -4.478 1.00 0.00 H new ATOM 308 N PRO A 95 1.416 -9.857 0.298 1.00 0.00 N ATOM 309 CA PRO A 95 1.685 -10.370 1.645 1.00 0.00 C ATOM 310 C PRO A 95 2.413 -11.711 1.622 1.00 0.00 C ATOM 311 O PRO A 95 3.353 -11.931 2.385 1.00 0.00 O ATOM 312 CB PRO A 95 0.290 -10.530 2.254 1.00 0.00 C ATOM 313 CG PRO A 95 -0.622 -10.677 1.084 1.00 0.00 C ATOM 314 CD PRO A 95 -0.024 -9.840 -0.011 1.00 0.00 C ATOM 0 HA PRO A 95 2.336 -9.703 2.210 1.00 0.00 H new ATOM 0 HB2 PRO A 95 0.241 -11.402 2.906 1.00 0.00 H new ATOM 0 HB3 PRO A 95 0.021 -9.664 2.859 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -0.701 -11.720 0.779 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -1.629 -10.339 1.329 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -0.229 -10.260 -0.996 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -0.424 -8.826 -0.007 1.00 0.00 H new ATOM 322 N SER A 96 1.971 -12.603 0.743 1.00 0.00 N ATOM 323 CA SER A 96 2.579 -13.922 0.621 1.00 0.00 C ATOM 324 C SER A 96 2.911 -14.240 -0.833 1.00 0.00 C ATOM 325 O SER A 96 2.366 -13.630 -1.753 1.00 0.00 O ATOM 326 CB SER A 96 1.644 -14.992 1.188 1.00 0.00 C ATOM 327 OG SER A 96 2.073 -15.420 2.469 1.00 0.00 O ATOM 0 H SER A 96 1.193 -12.436 0.104 1.00 0.00 H new ATOM 0 HA SER A 96 3.507 -13.919 1.193 1.00 0.00 H new ATOM 0 HB2 SER A 96 0.631 -14.595 1.254 1.00 0.00 H new ATOM 0 HB3 SER A 96 1.609 -15.844 0.510 1.00 0.00 H new ATOM 0 HG SER A 96 1.457 -16.102 2.809 1.00 0.00 H new ATOM 333 N PRO A 97 3.814 -15.205 -1.055 1.00 0.00 N ATOM 334 CA PRO A 97 4.224 -15.611 -2.401 1.00 0.00 C ATOM 335 C PRO A 97 3.122 -16.363 -3.140 1.00 0.00 C ATOM 336 O PRO A 97 2.829 -17.517 -2.829 1.00 0.00 O ATOM 337 CB PRO A 97 5.420 -16.532 -2.146 1.00 0.00 C ATOM 338 CG PRO A 97 5.199 -17.069 -0.774 1.00 0.00 C ATOM 339 CD PRO A 97 4.505 -15.976 -0.006 1.00 0.00 C ATOM 0 HA PRO A 97 4.456 -14.753 -3.032 1.00 0.00 H new ATOM 0 HB2 PRO A 97 5.466 -17.334 -2.882 1.00 0.00 H new ATOM 0 HB3 PRO A 97 6.361 -15.986 -2.211 1.00 0.00 H new ATOM 0 HG2 PRO A 97 4.590 -17.973 -0.802 1.00 0.00 H new ATOM 0 HG3 PRO A 97 6.145 -17.337 -0.303 1.00 0.00 H new ATOM 0 HD2 PRO A 97 3.803 -16.381 0.723 1.00 0.00 H new ATOM 0 HD3 PRO A 97 5.215 -15.359 0.544 1.00 0.00 H new ATOM 347 N ASP A 98 2.514 -15.700 -4.118 1.00 0.00 N ATOM 348 CA ASP A 98 1.443 -16.305 -4.901 1.00 0.00 C ATOM 349 C ASP A 98 0.118 -16.248 -4.147 1.00 0.00 C ATOM 350 O ASP A 98 -0.634 -17.222 -4.119 1.00 0.00 O ATOM 351 CB ASP A 98 1.787 -17.756 -5.239 1.00 0.00 C ATOM 352 CG ASP A 98 0.976 -18.288 -6.404 1.00 0.00 C ATOM 353 OD1 ASP A 98 0.938 -17.615 -7.457 1.00 0.00 O ATOM 354 OD2 ASP A 98 0.378 -19.376 -6.264 1.00 0.00 O ATOM 0 H ASP A 98 2.745 -14.744 -4.387 1.00 0.00 H new ATOM 0 HA ASP A 98 1.339 -15.738 -5.826 1.00 0.00 H new ATOM 0 HB2 ASP A 98 2.848 -17.829 -5.476 1.00 0.00 H new ATOM 0 HB3 ASP A 98 1.612 -18.381 -4.363 1.00 0.00 H new ATOM 359 N ALA A 99 -0.161 -15.100 -3.539 1.00 0.00 N ATOM 360 CA ALA A 99 -1.396 -14.915 -2.786 1.00 0.00 C ATOM 361 C ALA A 99 -2.345 -13.970 -3.515 1.00 0.00 C ATOM 362 O ALA A 99 -2.216 -13.754 -4.721 1.00 0.00 O ATOM 363 CB ALA A 99 -1.089 -14.388 -1.392 1.00 0.00 C ATOM 0 H ALA A 99 0.451 -14.284 -3.553 1.00 0.00 H new ATOM 0 HA ALA A 99 -1.888 -15.883 -2.696 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -2.020 -14.254 -0.840 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -0.454 -15.101 -0.865 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -0.573 -13.431 -1.470 1.00 0.00 H new ATOM 369 N LYS A 100 -3.298 -13.409 -2.778 1.00 0.00 N ATOM 370 CA LYS A 100 -4.268 -12.487 -3.357 1.00 0.00 C ATOM 371 C LYS A 100 -3.803 -11.043 -3.203 1.00 0.00 C ATOM 372 O LYS A 100 -4.610 -10.114 -3.227 1.00 0.00 O ATOM 373 CB LYS A 100 -5.635 -12.666 -2.695 1.00 0.00 C ATOM 374 CG LYS A 100 -6.052 -14.120 -2.544 1.00 0.00 C ATOM 375 CD LYS A 100 -6.844 -14.342 -1.266 1.00 0.00 C ATOM 376 CE LYS A 100 -8.275 -13.847 -1.405 1.00 0.00 C ATOM 377 NZ LYS A 100 -9.251 -14.971 -1.426 1.00 0.00 N ATOM 0 H LYS A 100 -3.419 -13.577 -1.779 1.00 0.00 H new ATOM 0 HA LYS A 100 -4.355 -12.713 -4.420 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -5.617 -12.198 -1.711 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -6.386 -12.140 -3.284 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -6.654 -14.418 -3.403 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -5.166 -14.755 -2.539 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -6.847 -15.404 -1.018 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -6.357 -13.824 -0.440 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -8.510 -13.178 -0.577 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -8.371 -13.266 -2.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -10.215 -14.592 -1.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -9.043 -15.596 -2.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -9.178 -15.511 -0.540 1.00 0.00 H new ATOM 391 N ALA A 101 -2.496 -10.863 -3.046 1.00 0.00 N ATOM 392 CA ALA A 101 -1.921 -9.533 -2.887 1.00 0.00 C ATOM 393 C ALA A 101 -2.408 -8.877 -1.599 1.00 0.00 C ATOM 394 O ALA A 101 -3.229 -9.440 -0.875 1.00 0.00 O ATOM 395 CB ALA A 101 -2.266 -8.664 -4.087 1.00 0.00 C ATOM 0 H ALA A 101 -1.815 -11.622 -3.025 1.00 0.00 H new ATOM 0 HA ALA A 101 -0.838 -9.635 -2.825 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.831 -7.673 -3.956 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -1.866 -9.119 -4.993 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.349 -8.576 -4.173 1.00 0.00 H new ATOM 401 N PHE A 102 -1.894 -7.683 -1.319 1.00 0.00 N ATOM 402 CA PHE A 102 -2.277 -6.949 -0.119 1.00 0.00 C ATOM 403 C PHE A 102 -3.541 -6.134 -0.366 1.00 0.00 C ATOM 404 O PHE A 102 -4.436 -6.084 0.479 1.00 0.00 O ATOM 405 CB PHE A 102 -1.139 -6.027 0.326 1.00 0.00 C ATOM 406 CG PHE A 102 -0.412 -6.519 1.544 1.00 0.00 C ATOM 407 CD1 PHE A 102 -1.114 -7.072 2.610 1.00 0.00 C ATOM 408 CD2 PHE A 102 0.975 -6.431 1.627 1.00 0.00 C ATOM 409 CE1 PHE A 102 -0.448 -7.529 3.735 1.00 0.00 C ATOM 410 CE2 PHE A 102 1.645 -6.887 2.750 1.00 0.00 C ATOM 411 CZ PHE A 102 0.932 -7.437 3.805 1.00 0.00 C ATOM 0 H PHE A 102 -1.212 -7.204 -1.907 1.00 0.00 H new ATOM 0 HA PHE A 102 -2.478 -7.671 0.672 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -0.428 -5.919 -0.493 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -1.544 -5.036 0.530 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -2.190 -7.146 2.560 1.00 0.00 H new ATOM 0 HD2 PHE A 102 1.534 -6.003 0.808 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -1.004 -7.956 4.556 1.00 0.00 H new ATOM 0 HE2 PHE A 102 2.721 -6.814 2.804 1.00 0.00 H new ATOM 0 HZ PHE A 102 1.453 -7.794 4.681 1.00 0.00 H new ATOM 421 N ILE A 103 -3.608 -5.498 -1.531 1.00 0.00 N ATOM 422 CA ILE A 103 -4.760 -4.684 -1.897 1.00 0.00 C ATOM 423 C ILE A 103 -4.661 -4.219 -3.345 1.00 0.00 C ATOM 424 O ILE A 103 -3.568 -3.959 -3.851 1.00 0.00 O ATOM 425 CB ILE A 103 -4.898 -3.450 -0.985 1.00 0.00 C ATOM 426 CG1 ILE A 103 -3.522 -2.860 -0.667 1.00 0.00 C ATOM 427 CG2 ILE A 103 -5.633 -3.815 0.295 1.00 0.00 C ATOM 428 CD1 ILE A 103 -3.208 -1.607 -1.452 1.00 0.00 C ATOM 0 H ILE A 103 -2.875 -5.531 -2.240 1.00 0.00 H new ATOM 0 HA ILE A 103 -5.641 -5.314 -1.774 1.00 0.00 H new ATOM 0 HB ILE A 103 -5.480 -2.694 -1.512 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -3.469 -2.635 0.398 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -2.758 -3.609 -0.873 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -5.722 -2.932 0.928 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -6.628 -4.187 0.050 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -5.077 -4.588 0.826 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -2.218 -1.244 -1.176 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -3.228 -1.831 -2.519 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -3.951 -0.842 -1.228 1.00 0.00 H new ATOM 440 N GLU A 104 -5.806 -4.116 -4.009 1.00 0.00 N ATOM 441 CA GLU A 104 -5.846 -3.681 -5.400 1.00 0.00 C ATOM 442 C GLU A 104 -7.152 -2.956 -5.706 1.00 0.00 C ATOM 443 O GLU A 104 -8.094 -2.994 -4.915 1.00 0.00 O ATOM 444 CB GLU A 104 -5.683 -4.881 -6.335 1.00 0.00 C ATOM 445 CG GLU A 104 -6.986 -5.604 -6.631 1.00 0.00 C ATOM 446 CD GLU A 104 -6.775 -7.061 -6.994 1.00 0.00 C ATOM 447 OE1 GLU A 104 -5.607 -7.500 -7.034 1.00 0.00 O ATOM 448 OE2 GLU A 104 -7.780 -7.762 -7.238 1.00 0.00 O ATOM 0 H GLU A 104 -6.719 -4.328 -3.607 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.021 -2.988 -5.562 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -5.244 -4.543 -7.273 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -4.980 -5.585 -5.890 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -7.638 -5.541 -5.760 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -7.499 -5.100 -7.450 1.00 0.00 H new ATOM 455 N VAL A 105 -7.202 -2.295 -6.858 1.00 0.00 N ATOM 456 CA VAL A 105 -8.393 -1.561 -7.266 1.00 0.00 C ATOM 457 C VAL A 105 -9.652 -2.389 -7.040 1.00 0.00 C ATOM 458 O VAL A 105 -9.742 -3.536 -7.479 1.00 0.00 O ATOM 459 CB VAL A 105 -8.321 -1.153 -8.750 1.00 0.00 C ATOM 460 CG1 VAL A 105 -9.594 -0.435 -9.169 1.00 0.00 C ATOM 461 CG2 VAL A 105 -7.100 -0.282 -9.005 1.00 0.00 C ATOM 0 H VAL A 105 -6.431 -2.253 -7.525 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.436 -0.662 -6.651 1.00 0.00 H new ATOM 0 HB VAL A 105 -8.227 -2.057 -9.352 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -9.524 -0.155 -10.220 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -10.449 -1.096 -9.026 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -9.723 0.461 -8.562 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -7.065 -0.003 -10.058 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -7.161 0.618 -8.393 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -6.198 -0.836 -8.746 1.00 0.00 H new ATOM 471 N GLY A 106 -10.624 -1.802 -6.349 1.00 0.00 N ATOM 472 CA GLY A 106 -11.866 -2.500 -6.074 1.00 0.00 C ATOM 473 C GLY A 106 -11.914 -3.068 -4.668 1.00 0.00 C ATOM 474 O GLY A 106 -12.976 -3.464 -4.188 1.00 0.00 O ATOM 0 H GLY A 106 -10.573 -0.855 -5.974 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -12.703 -1.816 -6.215 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -11.992 -3.309 -6.794 1.00 0.00 H new ATOM 478 N GLN A 107 -10.761 -3.107 -4.008 1.00 0.00 N ATOM 479 CA GLN A 107 -10.676 -3.630 -2.650 1.00 0.00 C ATOM 480 C GLN A 107 -11.296 -2.658 -1.652 1.00 0.00 C ATOM 481 O GLN A 107 -10.802 -1.547 -1.463 1.00 0.00 O ATOM 482 CB GLN A 107 -9.217 -3.900 -2.275 1.00 0.00 C ATOM 483 CG GLN A 107 -9.042 -5.065 -1.314 1.00 0.00 C ATOM 484 CD GLN A 107 -9.954 -4.967 -0.106 1.00 0.00 C ATOM 485 OE1 GLN A 107 -9.666 -4.242 0.846 1.00 0.00 O ATOM 486 NE2 GLN A 107 -11.061 -5.700 -0.139 1.00 0.00 N ATOM 0 H GLN A 107 -9.873 -2.783 -4.392 1.00 0.00 H new ATOM 0 HA GLN A 107 -11.234 -4.566 -2.613 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -8.648 -4.100 -3.183 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -8.794 -3.002 -1.825 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -9.241 -5.998 -1.840 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -8.005 -5.103 -0.980 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -11.260 -6.287 -0.949 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -11.712 -5.676 0.646 1.00 0.00 H new ATOM 495 N LYS A 108 -12.384 -3.084 -1.018 1.00 0.00 N ATOM 496 CA LYS A 108 -13.073 -2.250 -0.040 1.00 0.00 C ATOM 497 C LYS A 108 -12.389 -2.329 1.322 1.00 0.00 C ATOM 498 O LYS A 108 -12.801 -3.097 2.190 1.00 0.00 O ATOM 499 CB LYS A 108 -14.536 -2.681 0.088 1.00 0.00 C ATOM 500 CG LYS A 108 -15.279 -2.711 -1.237 1.00 0.00 C ATOM 501 CD LYS A 108 -16.549 -1.878 -1.182 1.00 0.00 C ATOM 502 CE LYS A 108 -17.254 -1.850 -2.529 1.00 0.00 C ATOM 503 NZ LYS A 108 -18.595 -1.209 -2.441 1.00 0.00 N ATOM 0 H LYS A 108 -12.807 -4.001 -1.164 1.00 0.00 H new ATOM 0 HA LYS A 108 -13.033 -1.218 -0.388 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -14.576 -3.672 0.540 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -15.049 -2.000 0.767 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -14.630 -2.335 -2.028 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -15.529 -3.741 -1.492 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -17.221 -2.286 -0.427 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -16.305 -0.861 -0.876 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -16.640 -1.309 -3.249 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -17.362 -2.868 -2.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -19.042 -1.210 -3.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -19.190 -1.740 -1.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -18.490 -0.229 -2.108 1.00 0.00 H new ATOM 517 N VAL A 109 -11.344 -1.528 1.502 1.00 0.00 N ATOM 518 CA VAL A 109 -10.606 -1.509 2.759 1.00 0.00 C ATOM 519 C VAL A 109 -11.457 -0.930 3.885 1.00 0.00 C ATOM 520 O VAL A 109 -12.489 -0.305 3.638 1.00 0.00 O ATOM 521 CB VAL A 109 -9.307 -0.689 2.639 1.00 0.00 C ATOM 522 CG1 VAL A 109 -8.231 -1.496 1.930 1.00 0.00 C ATOM 523 CG2 VAL A 109 -9.568 0.621 1.913 1.00 0.00 C ATOM 0 H VAL A 109 -10.990 -0.885 0.794 1.00 0.00 H new ATOM 0 HA VAL A 109 -10.352 -2.543 2.992 1.00 0.00 H new ATOM 0 HB VAL A 109 -8.951 -0.456 3.643 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -7.321 -0.901 1.854 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -8.025 -2.404 2.496 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -8.575 -1.762 0.930 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -8.639 1.187 1.838 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -9.948 0.413 0.913 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -10.304 1.204 2.467 1.00 0.00 H new ATOM 533 N ASN A 110 -11.017 -1.140 5.121 1.00 0.00 N ATOM 534 CA ASN A 110 -11.735 -0.641 6.283 1.00 0.00 C ATOM 535 C ASN A 110 -10.806 -0.521 7.481 1.00 0.00 C ATOM 536 O ASN A 110 -10.077 -1.454 7.816 1.00 0.00 O ATOM 537 CB ASN A 110 -12.906 -1.561 6.624 1.00 0.00 C ATOM 538 CG ASN A 110 -13.711 -1.953 5.401 1.00 0.00 C ATOM 539 OD1 ASN A 110 -14.776 -1.394 5.139 1.00 0.00 O ATOM 540 ND2 ASN A 110 -13.204 -2.921 4.645 1.00 0.00 N ATOM 0 H ASN A 110 -10.164 -1.654 5.342 1.00 0.00 H new ATOM 0 HA ASN A 110 -12.121 0.349 6.041 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -12.528 -2.461 7.110 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -13.559 -1.062 7.340 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -13.701 -3.229 3.809 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -12.318 -3.356 4.900 1.00 0.00 H new ATOM 547 N VAL A 111 -10.844 0.639 8.119 1.00 0.00 N ATOM 548 CA VAL A 111 -10.012 0.907 9.286 1.00 0.00 C ATOM 549 C VAL A 111 -9.809 -0.354 10.119 1.00 0.00 C ATOM 550 O VAL A 111 -10.749 -0.870 10.723 1.00 0.00 O ATOM 551 CB VAL A 111 -10.631 2.001 10.177 1.00 0.00 C ATOM 552 CG1 VAL A 111 -10.004 3.354 9.876 1.00 0.00 C ATOM 553 CG2 VAL A 111 -12.140 2.051 9.990 1.00 0.00 C ATOM 0 H VAL A 111 -11.446 1.416 7.847 1.00 0.00 H new ATOM 0 HA VAL A 111 -9.048 1.253 8.913 1.00 0.00 H new ATOM 0 HB VAL A 111 -10.425 1.755 11.219 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -10.454 4.114 10.515 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -8.932 3.308 10.066 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.176 3.610 8.831 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -12.560 2.829 10.627 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -12.370 2.272 8.948 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -12.572 1.088 10.261 1.00 0.00 H new ATOM 563 N GLY A 112 -8.575 -0.847 10.146 1.00 0.00 N ATOM 564 CA GLY A 112 -8.269 -2.046 10.905 1.00 0.00 C ATOM 565 C GLY A 112 -7.952 -3.228 10.013 1.00 0.00 C ATOM 566 O GLY A 112 -7.906 -4.369 10.474 1.00 0.00 O ATOM 0 H GLY A 112 -7.780 -0.437 9.655 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -7.420 -1.851 11.561 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -9.116 -2.294 11.545 1.00 0.00 H new ATOM 570 N ASP A 113 -7.734 -2.956 8.730 1.00 0.00 N ATOM 571 CA ASP A 113 -7.419 -4.003 7.768 1.00 0.00 C ATOM 572 C ASP A 113 -6.086 -3.723 7.083 1.00 0.00 C ATOM 573 O ASP A 113 -6.001 -2.876 6.193 1.00 0.00 O ATOM 574 CB ASP A 113 -8.530 -4.115 6.722 1.00 0.00 C ATOM 575 CG ASP A 113 -8.159 -5.041 5.581 1.00 0.00 C ATOM 576 OD1 ASP A 113 -7.301 -5.925 5.788 1.00 0.00 O ATOM 577 OD2 ASP A 113 -8.728 -4.883 4.481 1.00 0.00 O ATOM 0 H ASP A 113 -7.770 -2.017 8.333 1.00 0.00 H new ATOM 0 HA ASP A 113 -7.341 -4.948 8.306 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -9.440 -4.478 7.200 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -8.752 -3.125 6.325 1.00 0.00 H new ATOM 582 N THR A 114 -5.049 -4.438 7.506 1.00 0.00 N ATOM 583 CA THR A 114 -3.715 -4.269 6.938 1.00 0.00 C ATOM 584 C THR A 114 -3.789 -3.934 5.453 1.00 0.00 C ATOM 585 O THR A 114 -3.845 -4.826 4.607 1.00 0.00 O ATOM 586 CB THR A 114 -2.887 -5.538 7.142 1.00 0.00 C ATOM 587 OG1 THR A 114 -3.169 -6.124 8.401 1.00 0.00 O ATOM 588 CG2 THR A 114 -1.394 -5.297 7.073 1.00 0.00 C ATOM 0 H THR A 114 -5.106 -5.142 8.242 1.00 0.00 H new ATOM 0 HA THR A 114 -3.234 -3.439 7.455 1.00 0.00 H new ATOM 0 HB THR A 114 -3.170 -6.201 6.325 1.00 0.00 H new ATOM 0 HG1 THR A 114 -2.631 -6.935 8.512 1.00 0.00 H new ATOM 0 HG21 THR A 114 -0.866 -6.238 7.226 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.136 -4.891 6.095 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.104 -4.588 7.848 1.00 0.00 H new ATOM 596 N LEU A 115 -3.784 -2.642 5.142 1.00 0.00 N ATOM 597 CA LEU A 115 -3.848 -2.189 3.758 1.00 0.00 C ATOM 598 C LEU A 115 -2.808 -2.910 2.906 1.00 0.00 C ATOM 599 O LEU A 115 -3.135 -3.820 2.145 1.00 0.00 O ATOM 600 CB LEU A 115 -3.624 -0.678 3.684 1.00 0.00 C ATOM 601 CG LEU A 115 -4.893 0.172 3.773 1.00 0.00 C ATOM 602 CD1 LEU A 115 -4.552 1.601 4.162 1.00 0.00 C ATOM 603 CD2 LEU A 115 -5.645 0.141 2.451 1.00 0.00 C ATOM 0 H LEU A 115 -3.736 -1.890 5.830 1.00 0.00 H new ATOM 0 HA LEU A 115 -4.839 -2.422 3.369 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -2.953 -0.386 4.491 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -3.116 -0.447 2.748 1.00 0.00 H new ATOM 0 HG LEU A 115 -5.537 -0.247 4.546 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -5.467 2.190 4.220 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -4.055 1.605 5.132 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -3.889 2.034 3.413 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -6.545 0.750 2.530 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -5.007 0.537 1.660 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -5.922 -0.886 2.214 1.00 0.00 H new ATOM 615 N CYS A 116 -1.553 -2.498 3.048 1.00 0.00 N ATOM 616 CA CYS A 116 -0.459 -3.104 2.298 1.00 0.00 C ATOM 617 C CYS A 116 0.822 -3.104 3.122 1.00 0.00 C ATOM 618 O CYS A 116 0.779 -3.064 4.353 1.00 0.00 O ATOM 619 CB CYS A 116 -0.234 -2.354 0.983 1.00 0.00 C ATOM 620 SG CYS A 116 0.611 -0.768 1.174 1.00 0.00 S ATOM 0 H CYS A 116 -1.268 -1.746 3.676 1.00 0.00 H new ATOM 0 HA CYS A 116 -0.730 -4.136 2.075 1.00 0.00 H new ATOM 0 HB2 CYS A 116 0.348 -2.985 0.312 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -1.198 -2.184 0.504 1.00 0.00 H new ATOM 0 HG CYS A 116 1.029 -0.357 0.014 1.00 0.00 H new ATOM 626 N ILE A 117 1.960 -3.146 2.441 1.00 0.00 N ATOM 627 CA ILE A 117 3.252 -3.148 3.112 1.00 0.00 C ATOM 628 C ILE A 117 4.228 -2.207 2.407 1.00 0.00 C ATOM 629 O ILE A 117 4.111 -1.958 1.208 1.00 0.00 O ATOM 630 CB ILE A 117 3.836 -4.583 3.190 1.00 0.00 C ATOM 631 CG1 ILE A 117 3.376 -5.263 4.482 1.00 0.00 C ATOM 632 CG2 ILE A 117 5.360 -4.583 3.108 1.00 0.00 C ATOM 633 CD1 ILE A 117 4.023 -6.609 4.727 1.00 0.00 C ATOM 0 H ILE A 117 2.014 -3.179 1.423 1.00 0.00 H new ATOM 0 HA ILE A 117 3.103 -2.788 4.130 1.00 0.00 H new ATOM 0 HB ILE A 117 3.463 -5.141 2.331 1.00 0.00 H new ATOM 0 HG12 ILE A 117 3.594 -4.607 5.325 1.00 0.00 H new ATOM 0 HG13 ILE A 117 2.294 -5.391 4.449 1.00 0.00 H new ATOM 0 HG21 ILE A 117 5.728 -5.608 3.166 1.00 0.00 H new ATOM 0 HG22 ILE A 117 5.674 -4.138 2.164 1.00 0.00 H new ATOM 0 HG23 ILE A 117 5.769 -4.003 3.935 1.00 0.00 H new ATOM 0 HD11 ILE A 117 3.648 -7.029 5.660 1.00 0.00 H new ATOM 0 HD12 ILE A 117 3.784 -7.283 3.904 1.00 0.00 H new ATOM 0 HD13 ILE A 117 5.104 -6.486 4.793 1.00 0.00 H new ATOM 645 N VAL A 118 5.186 -1.688 3.166 1.00 0.00 N ATOM 646 CA VAL A 118 6.181 -0.774 2.622 1.00 0.00 C ATOM 647 C VAL A 118 7.566 -1.064 3.191 1.00 0.00 C ATOM 648 O VAL A 118 7.963 -0.489 4.204 1.00 0.00 O ATOM 649 CB VAL A 118 5.817 0.693 2.917 1.00 0.00 C ATOM 650 CG1 VAL A 118 6.890 1.630 2.385 1.00 0.00 C ATOM 651 CG2 VAL A 118 4.459 1.035 2.325 1.00 0.00 C ATOM 0 H VAL A 118 5.294 -1.885 4.161 1.00 0.00 H new ATOM 0 HA VAL A 118 6.194 -0.929 1.543 1.00 0.00 H new ATOM 0 HB VAL A 118 5.760 0.822 3.998 1.00 0.00 H new ATOM 0 HG11 VAL A 118 6.613 2.661 2.604 1.00 0.00 H new ATOM 0 HG12 VAL A 118 7.843 1.401 2.862 1.00 0.00 H new ATOM 0 HG13 VAL A 118 6.984 1.501 1.307 1.00 0.00 H new ATOM 0 HG21 VAL A 118 4.218 2.075 2.543 1.00 0.00 H new ATOM 0 HG22 VAL A 118 4.485 0.888 1.245 1.00 0.00 H new ATOM 0 HG23 VAL A 118 3.698 0.388 2.761 1.00 0.00 H new ATOM 661 N GLU A 119 8.296 -1.958 2.533 1.00 0.00 N ATOM 662 CA GLU A 119 9.637 -2.322 2.976 1.00 0.00 C ATOM 663 C GLU A 119 10.492 -1.080 3.200 1.00 0.00 C ATOM 664 O GLU A 119 11.230 -0.652 2.311 1.00 0.00 O ATOM 665 CB GLU A 119 10.306 -3.236 1.949 1.00 0.00 C ATOM 666 CG GLU A 119 10.725 -4.583 2.515 1.00 0.00 C ATOM 667 CD GLU A 119 12.120 -4.988 2.083 1.00 0.00 C ATOM 668 OE1 GLU A 119 13.056 -4.180 2.264 1.00 0.00 O ATOM 669 OE2 GLU A 119 12.278 -6.114 1.566 1.00 0.00 O ATOM 0 H GLU A 119 7.982 -2.443 1.692 1.00 0.00 H new ATOM 0 HA GLU A 119 9.547 -2.855 3.923 1.00 0.00 H new ATOM 0 HB2 GLU A 119 9.620 -3.398 1.118 1.00 0.00 H new ATOM 0 HB3 GLU A 119 11.184 -2.732 1.544 1.00 0.00 H new ATOM 0 HG2 GLU A 119 10.682 -4.545 3.603 1.00 0.00 H new ATOM 0 HG3 GLU A 119 10.014 -5.345 2.195 1.00 0.00 H new ATOM 676 N ALA A 120 10.392 -0.507 4.394 1.00 0.00 N ATOM 677 CA ALA A 120 11.157 0.685 4.737 1.00 0.00 C ATOM 678 C ALA A 120 12.323 0.337 5.654 1.00 0.00 C ATOM 679 O ALA A 120 12.190 -0.494 6.551 1.00 0.00 O ATOM 680 CB ALA A 120 10.256 1.720 5.392 1.00 0.00 C ATOM 0 H ALA A 120 9.788 -0.849 5.141 1.00 0.00 H new ATOM 0 HA ALA A 120 11.563 1.107 3.818 1.00 0.00 H new ATOM 0 HB1 ALA A 120 10.841 2.605 5.643 1.00 0.00 H new ATOM 0 HB2 ALA A 120 9.458 1.996 4.703 1.00 0.00 H new ATOM 0 HB3 ALA A 120 9.822 1.302 6.301 1.00 0.00 H new ATOM 686 N MET A 121 13.467 0.973 5.420 1.00 0.00 N ATOM 687 CA MET A 121 14.659 0.725 6.223 1.00 0.00 C ATOM 688 C MET A 121 14.941 -0.771 6.316 1.00 0.00 C ATOM 689 O MET A 121 15.617 -1.231 7.238 1.00 0.00 O ATOM 690 CB MET A 121 14.497 1.330 7.623 1.00 0.00 C ATOM 691 CG MET A 121 13.936 0.366 8.659 1.00 0.00 C ATOM 692 SD MET A 121 12.634 1.106 9.663 1.00 0.00 S ATOM 693 CE MET A 121 13.457 1.228 11.248 1.00 0.00 C ATOM 0 H MET A 121 13.593 1.664 4.681 1.00 0.00 H new ATOM 0 HA MET A 121 15.508 1.204 5.736 1.00 0.00 H new ATOM 0 HB2 MET A 121 15.467 1.689 7.966 1.00 0.00 H new ATOM 0 HB3 MET A 121 13.841 2.198 7.558 1.00 0.00 H new ATOM 0 HG2 MET A 121 13.543 -0.516 8.154 1.00 0.00 H new ATOM 0 HG3 MET A 121 14.743 0.028 9.309 1.00 0.00 H new ATOM 0 HE1 MET A 121 12.778 1.669 11.978 1.00 0.00 H new ATOM 0 HE2 MET A 121 13.753 0.233 11.582 1.00 0.00 H new ATOM 0 HE3 MET A 121 14.342 1.856 11.151 1.00 0.00 H new ATOM 703 N LYS A 122 14.414 -1.522 5.356 1.00 0.00 N ATOM 704 CA LYS A 122 14.599 -2.967 5.322 1.00 0.00 C ATOM 705 C LYS A 122 13.542 -3.670 6.168 1.00 0.00 C ATOM 706 O LYS A 122 13.820 -4.679 6.816 1.00 0.00 O ATOM 707 CB LYS A 122 15.998 -3.341 5.816 1.00 0.00 C ATOM 708 CG LYS A 122 16.544 -4.612 5.184 1.00 0.00 C ATOM 709 CD LYS A 122 15.515 -5.730 5.205 1.00 0.00 C ATOM 710 CE LYS A 122 15.971 -6.925 4.381 1.00 0.00 C ATOM 711 NZ LYS A 122 16.334 -8.062 5.221 1.00 0.00 N ATOM 0 H LYS A 122 13.853 -1.152 4.588 1.00 0.00 H new ATOM 0 HA LYS A 122 14.491 -3.296 4.288 1.00 0.00 H new ATOM 0 HB2 LYS A 122 16.681 -2.518 5.606 1.00 0.00 H new ATOM 0 HB3 LYS A 122 15.971 -3.465 6.899 1.00 0.00 H new ATOM 0 HG2 LYS A 122 16.842 -4.409 4.155 1.00 0.00 H new ATOM 0 HG3 LYS A 122 17.439 -4.930 5.718 1.00 0.00 H new ATOM 0 HD2 LYS A 122 15.338 -6.043 6.234 1.00 0.00 H new ATOM 0 HD3 LYS A 122 14.566 -5.360 4.816 1.00 0.00 H new ATOM 0 HE2 LYS A 122 15.175 -7.219 3.697 1.00 0.00 H new ATOM 0 HE3 LYS A 122 16.826 -6.638 3.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 16.639 -8.854 4.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 17.111 -7.790 5.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 15.511 -8.353 5.786 1.00 0.00 H new ATOM 722 N MET A 123 12.329 -3.132 6.155 1.00 0.00 N ATOM 723 CA MET A 123 11.231 -3.712 6.917 1.00 0.00 C ATOM 724 C MET A 123 9.890 -3.421 6.254 1.00 0.00 C ATOM 725 O MET A 123 9.581 -2.276 5.925 1.00 0.00 O ATOM 726 CB MET A 123 11.227 -3.177 8.349 1.00 0.00 C ATOM 727 CG MET A 123 12.578 -3.271 9.039 1.00 0.00 C ATOM 728 SD MET A 123 13.005 -4.960 9.503 1.00 0.00 S ATOM 729 CE MET A 123 12.498 -4.980 11.220 1.00 0.00 C ATOM 0 H MET A 123 12.081 -2.296 5.626 1.00 0.00 H new ATOM 0 HA MET A 123 11.379 -4.792 6.941 1.00 0.00 H new ATOM 0 HB2 MET A 123 10.906 -2.135 8.338 1.00 0.00 H new ATOM 0 HB3 MET A 123 10.491 -3.731 8.932 1.00 0.00 H new ATOM 0 HG2 MET A 123 13.348 -2.875 8.377 1.00 0.00 H new ATOM 0 HG3 MET A 123 12.571 -2.644 9.931 1.00 0.00 H new ATOM 0 HE1 MET A 123 12.699 -5.962 11.647 1.00 0.00 H new ATOM 0 HE2 MET A 123 13.054 -4.223 11.773 1.00 0.00 H new ATOM 0 HE3 MET A 123 11.431 -4.767 11.287 1.00 0.00 H new ATOM 739 N MET A 124 9.099 -4.470 6.063 1.00 0.00 N ATOM 740 CA MET A 124 7.788 -4.341 5.439 1.00 0.00 C ATOM 741 C MET A 124 6.834 -3.553 6.332 1.00 0.00 C ATOM 742 O MET A 124 6.177 -4.119 7.206 1.00 0.00 O ATOM 743 CB MET A 124 7.206 -5.725 5.146 1.00 0.00 C ATOM 744 CG MET A 124 7.755 -6.360 3.879 1.00 0.00 C ATOM 745 SD MET A 124 6.934 -7.911 3.469 1.00 0.00 S ATOM 746 CE MET A 124 7.381 -8.085 1.743 1.00 0.00 C ATOM 0 H MET A 124 9.344 -5.423 6.332 1.00 0.00 H new ATOM 0 HA MET A 124 7.909 -3.797 4.502 1.00 0.00 H new ATOM 0 HB2 MET A 124 7.412 -6.383 5.991 1.00 0.00 H new ATOM 0 HB3 MET A 124 6.122 -5.644 5.062 1.00 0.00 H new ATOM 0 HG2 MET A 124 7.641 -5.663 3.049 1.00 0.00 H new ATOM 0 HG3 MET A 124 8.823 -6.540 4.001 1.00 0.00 H new ATOM 0 HE1 MET A 124 7.166 -9.101 1.412 1.00 0.00 H new ATOM 0 HE2 MET A 124 6.805 -7.379 1.145 1.00 0.00 H new ATOM 0 HE3 MET A 124 8.445 -7.881 1.620 1.00 0.00 H new ATOM 756 N ASN A 125 6.764 -2.246 6.106 1.00 0.00 N ATOM 757 CA ASN A 125 5.889 -1.380 6.889 1.00 0.00 C ATOM 758 C ASN A 125 4.425 -1.635 6.548 1.00 0.00 C ATOM 759 O ASN A 125 3.800 -0.858 5.826 1.00 0.00 O ATOM 760 CB ASN A 125 6.235 0.088 6.640 1.00 0.00 C ATOM 761 CG ASN A 125 6.162 0.923 7.904 1.00 0.00 C ATOM 762 OD1 ASN A 125 7.136 1.027 8.649 1.00 0.00 O ATOM 763 ND2 ASN A 125 5.004 1.525 8.150 1.00 0.00 N ATOM 0 H ASN A 125 7.302 -1.762 5.387 1.00 0.00 H new ATOM 0 HA ASN A 125 6.042 -1.608 7.944 1.00 0.00 H new ATOM 0 HB2 ASN A 125 7.239 0.156 6.221 1.00 0.00 H new ATOM 0 HB3 ASN A 125 5.551 0.498 5.897 1.00 0.00 H new ATOM 0 HD21 ASN A 125 4.896 2.102 8.985 1.00 0.00 H new ATOM 0 HD22 ASN A 125 4.223 1.411 7.504 1.00 0.00 H new ATOM 770 N GLN A 126 3.883 -2.730 7.071 1.00 0.00 N ATOM 771 CA GLN A 126 2.491 -3.089 6.823 1.00 0.00 C ATOM 772 C GLN A 126 1.557 -1.948 7.217 1.00 0.00 C ATOM 773 O GLN A 126 1.369 -1.667 8.400 1.00 0.00 O ATOM 774 CB GLN A 126 2.126 -4.355 7.599 1.00 0.00 C ATOM 775 CG GLN A 126 2.427 -4.265 9.086 1.00 0.00 C ATOM 776 CD GLN A 126 2.232 -5.587 9.803 1.00 0.00 C ATOM 777 OE1 GLN A 126 3.018 -6.520 9.634 1.00 0.00 O ATOM 778 NE2 GLN A 126 1.180 -5.674 10.609 1.00 0.00 N ATOM 0 H GLN A 126 4.387 -3.385 7.670 1.00 0.00 H new ATOM 0 HA GLN A 126 2.373 -3.278 5.756 1.00 0.00 H new ATOM 0 HB2 GLN A 126 1.064 -4.561 7.464 1.00 0.00 H new ATOM 0 HB3 GLN A 126 2.671 -5.200 7.177 1.00 0.00 H new ATOM 0 HG2 GLN A 126 3.455 -3.929 9.225 1.00 0.00 H new ATOM 0 HG3 GLN A 126 1.782 -3.512 9.538 1.00 0.00 H new ATOM 0 HE21 GLN A 126 0.555 -4.876 10.719 1.00 0.00 H new ATOM 0 HE22 GLN A 126 0.997 -6.539 11.118 1.00 0.00 H new ATOM 787 N ILE A 127 0.974 -1.295 6.216 1.00 0.00 N ATOM 788 CA ILE A 127 0.060 -0.185 6.461 1.00 0.00 C ATOM 789 C ILE A 127 -1.288 -0.687 6.969 1.00 0.00 C ATOM 790 O ILE A 127 -1.706 -1.800 6.653 1.00 0.00 O ATOM 791 CB ILE A 127 -0.165 0.651 5.186 1.00 0.00 C ATOM 792 CG1 ILE A 127 1.163 0.895 4.467 1.00 0.00 C ATOM 793 CG2 ILE A 127 -0.839 1.971 5.531 1.00 0.00 C ATOM 794 CD1 ILE A 127 2.126 1.759 5.252 1.00 0.00 C ATOM 0 H ILE A 127 1.118 -1.515 5.230 1.00 0.00 H new ATOM 0 HA ILE A 127 0.523 0.444 7.222 1.00 0.00 H new ATOM 0 HB ILE A 127 -0.821 0.095 4.516 1.00 0.00 H new ATOM 0 HG12 ILE A 127 1.636 -0.065 4.259 1.00 0.00 H new ATOM 0 HG13 ILE A 127 0.965 1.368 3.505 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.991 2.551 4.621 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -1.802 1.775 6.002 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -0.207 2.534 6.218 1.00 0.00 H new ATOM 0 HD11 ILE A 127 3.046 1.890 4.682 1.00 0.00 H new ATOM 0 HD12 ILE A 127 1.673 2.733 5.438 1.00 0.00 H new ATOM 0 HD13 ILE A 127 2.354 1.278 6.203 1.00 0.00 H new ATOM 806 N GLU A 128 -1.964 0.144 7.756 1.00 0.00 N ATOM 807 CA GLU A 128 -3.266 -0.215 8.307 1.00 0.00 C ATOM 808 C GLU A 128 -4.322 0.816 7.924 1.00 0.00 C ATOM 809 O GLU A 128 -4.175 2.004 8.209 1.00 0.00 O ATOM 810 CB GLU A 128 -3.184 -0.335 9.830 1.00 0.00 C ATOM 811 CG GLU A 128 -1.998 -1.153 10.314 1.00 0.00 C ATOM 812 CD GLU A 128 -1.383 -0.594 11.581 1.00 0.00 C ATOM 813 OE1 GLU A 128 -2.069 -0.598 12.626 1.00 0.00 O ATOM 814 OE2 GLU A 128 -0.218 -0.150 11.530 1.00 0.00 O ATOM 0 H GLU A 128 -1.632 1.070 8.026 1.00 0.00 H new ATOM 0 HA GLU A 128 -3.556 -1.179 7.888 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -3.126 0.664 10.262 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -4.103 -0.789 10.200 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -2.318 -2.180 10.492 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -1.241 -1.186 9.531 1.00 0.00 H new ATOM 821 N ALA A 129 -5.387 0.354 7.277 1.00 0.00 N ATOM 822 CA ALA A 129 -6.467 1.238 6.856 1.00 0.00 C ATOM 823 C ALA A 129 -6.782 2.265 7.938 1.00 0.00 C ATOM 824 O ALA A 129 -7.058 1.911 9.084 1.00 0.00 O ATOM 825 CB ALA A 129 -7.709 0.429 6.514 1.00 0.00 C ATOM 0 H ALA A 129 -5.525 -0.627 7.033 1.00 0.00 H new ATOM 0 HA ALA A 129 -6.142 1.774 5.964 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -8.507 1.102 6.201 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -7.480 -0.264 5.704 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -8.031 -0.132 7.391 1.00 0.00 H new ATOM 831 N ASP A 130 -6.737 3.541 7.566 1.00 0.00 N ATOM 832 CA ASP A 130 -7.018 4.621 8.504 1.00 0.00 C ATOM 833 C ASP A 130 -8.301 5.352 8.124 1.00 0.00 C ATOM 834 O ASP A 130 -8.568 6.451 8.611 1.00 0.00 O ATOM 835 CB ASP A 130 -5.848 5.605 8.543 1.00 0.00 C ATOM 836 CG ASP A 130 -5.803 6.401 9.833 1.00 0.00 C ATOM 837 OD1 ASP A 130 -6.756 7.166 10.091 1.00 0.00 O ATOM 838 OD2 ASP A 130 -4.816 6.257 10.584 1.00 0.00 O ATOM 0 H ASP A 130 -6.509 3.851 6.622 1.00 0.00 H new ATOM 0 HA ASP A 130 -7.151 4.185 9.494 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -4.913 5.058 8.424 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -5.925 6.290 7.699 1.00 0.00 H new ATOM 843 N LYS A 131 -9.089 4.736 7.251 1.00 0.00 N ATOM 844 CA LYS A 131 -10.344 5.329 6.804 1.00 0.00 C ATOM 845 C LYS A 131 -11.006 4.461 5.740 1.00 0.00 C ATOM 846 O LYS A 131 -10.569 4.431 4.590 1.00 0.00 O ATOM 847 CB LYS A 131 -10.099 6.736 6.252 1.00 0.00 C ATOM 848 CG LYS A 131 -11.215 7.245 5.353 1.00 0.00 C ATOM 849 CD LYS A 131 -10.724 7.482 3.935 1.00 0.00 C ATOM 850 CE LYS A 131 -11.872 7.449 2.937 1.00 0.00 C ATOM 851 NZ LYS A 131 -11.461 7.951 1.598 1.00 0.00 N ATOM 0 H LYS A 131 -8.882 3.826 6.839 1.00 0.00 H new ATOM 0 HA LYS A 131 -11.013 5.394 7.662 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -9.973 7.427 7.086 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -9.164 6.739 5.692 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -12.031 6.523 5.340 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -11.617 8.173 5.760 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -10.219 8.447 3.880 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -9.989 6.722 3.671 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -12.242 6.428 2.844 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -12.697 8.054 3.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -12.291 7.992 0.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -11.053 8.903 1.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -10.751 7.310 1.190 1.00 0.00 H new ATOM 865 N SER A 132 -12.064 3.756 6.131 1.00 0.00 N ATOM 866 CA SER A 132 -12.784 2.890 5.204 1.00 0.00 C ATOM 867 C SER A 132 -12.846 3.521 3.818 1.00 0.00 C ATOM 868 O SER A 132 -13.466 4.568 3.629 1.00 0.00 O ATOM 869 CB SER A 132 -14.199 2.619 5.719 1.00 0.00 C ATOM 870 OG SER A 132 -15.072 2.278 4.656 1.00 0.00 O ATOM 0 H SER A 132 -12.440 3.767 7.079 1.00 0.00 H new ATOM 0 HA SER A 132 -12.247 1.944 5.133 1.00 0.00 H new ATOM 0 HB2 SER A 132 -14.175 1.809 6.448 1.00 0.00 H new ATOM 0 HB3 SER A 132 -14.577 3.502 6.235 1.00 0.00 H new ATOM 0 HG SER A 132 -15.969 2.108 5.011 1.00 0.00 H new ATOM 876 N GLY A 133 -12.194 2.882 2.853 1.00 0.00 N ATOM 877 CA GLY A 133 -12.186 3.402 1.499 1.00 0.00 C ATOM 878 C GLY A 133 -12.138 2.308 0.452 1.00 0.00 C ATOM 879 O GLY A 133 -12.236 1.124 0.774 1.00 0.00 O ATOM 0 H GLY A 133 -11.672 2.015 2.984 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -13.077 4.010 1.343 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -11.326 4.059 1.372 1.00 0.00 H new ATOM 883 N THR A 134 -11.993 2.708 -0.806 1.00 0.00 N ATOM 884 CA THR A 134 -11.939 1.756 -1.910 1.00 0.00 C ATOM 885 C THR A 134 -10.724 2.005 -2.795 1.00 0.00 C ATOM 886 O THR A 134 -10.681 2.982 -3.541 1.00 0.00 O ATOM 887 CB THR A 134 -13.205 1.866 -2.753 1.00 0.00 C ATOM 888 OG1 THR A 134 -14.360 1.827 -1.935 1.00 0.00 O ATOM 889 CG2 THR A 134 -13.332 0.764 -3.783 1.00 0.00 C ATOM 0 H THR A 134 -11.911 3.685 -1.087 1.00 0.00 H new ATOM 0 HA THR A 134 -11.860 0.755 -1.485 1.00 0.00 H new ATOM 0 HB THR A 134 -13.125 2.821 -3.272 1.00 0.00 H new ATOM 0 HG1 THR A 134 -15.160 1.901 -2.496 1.00 0.00 H new ATOM 0 HG21 THR A 134 -14.253 0.900 -4.349 1.00 0.00 H new ATOM 0 HG22 THR A 134 -12.480 0.801 -4.462 1.00 0.00 H new ATOM 0 HG23 THR A 134 -13.354 -0.203 -3.280 1.00 0.00 H new ATOM 897 N VAL A 135 -9.743 1.111 -2.727 1.00 0.00 N ATOM 898 CA VAL A 135 -8.546 1.246 -3.543 1.00 0.00 C ATOM 899 C VAL A 135 -8.912 1.744 -4.937 1.00 0.00 C ATOM 900 O VAL A 135 -9.967 1.394 -5.468 1.00 0.00 O ATOM 901 CB VAL A 135 -7.788 -0.087 -3.667 1.00 0.00 C ATOM 902 CG1 VAL A 135 -6.664 0.034 -4.682 1.00 0.00 C ATOM 903 CG2 VAL A 135 -7.250 -0.522 -2.312 1.00 0.00 C ATOM 0 H VAL A 135 -9.754 0.292 -2.119 1.00 0.00 H new ATOM 0 HA VAL A 135 -7.896 1.968 -3.048 1.00 0.00 H new ATOM 0 HB VAL A 135 -8.483 -0.850 -4.018 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -6.138 -0.918 -4.758 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -7.079 0.297 -5.655 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -5.967 0.809 -4.363 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -6.717 -1.467 -2.418 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -6.569 0.238 -1.930 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -8.079 -0.650 -1.615 1.00 0.00 H new ATOM 913 N LYS A 136 -8.051 2.564 -5.527 1.00 0.00 N ATOM 914 CA LYS A 136 -8.312 3.101 -6.852 1.00 0.00 C ATOM 915 C LYS A 136 -7.204 2.723 -7.825 1.00 0.00 C ATOM 916 O LYS A 136 -7.401 2.744 -9.039 1.00 0.00 O ATOM 917 CB LYS A 136 -8.458 4.621 -6.782 1.00 0.00 C ATOM 918 CG LYS A 136 -9.680 5.073 -6.003 1.00 0.00 C ATOM 919 CD LYS A 136 -9.645 6.568 -5.727 1.00 0.00 C ATOM 920 CE LYS A 136 -9.599 7.372 -7.016 1.00 0.00 C ATOM 921 NZ LYS A 136 -10.230 8.711 -6.859 1.00 0.00 N ATOM 0 H LYS A 136 -7.172 2.869 -5.110 1.00 0.00 H new ATOM 0 HA LYS A 136 -9.244 2.669 -7.217 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -7.565 5.044 -6.321 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -8.513 5.020 -7.795 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -10.582 4.827 -6.564 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -9.733 4.529 -5.060 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -10.525 6.853 -5.150 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -8.773 6.806 -5.117 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -8.563 7.494 -7.331 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -10.109 6.821 -7.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -9.831 9.367 -7.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -11.256 8.630 -7.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -10.044 9.072 -5.902 1.00 0.00 H new ATOM 935 N ALA A 137 -6.038 2.377 -7.286 1.00 0.00 N ATOM 936 CA ALA A 137 -4.905 1.998 -8.120 1.00 0.00 C ATOM 937 C ALA A 137 -3.592 2.102 -7.354 1.00 0.00 C ATOM 938 O ALA A 137 -3.530 2.717 -6.289 1.00 0.00 O ATOM 939 CB ALA A 137 -4.859 2.877 -9.355 1.00 0.00 C ATOM 0 H ALA A 137 -5.855 2.352 -6.283 1.00 0.00 H new ATOM 0 HA ALA A 137 -5.036 0.958 -8.419 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -4.010 2.589 -9.975 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -5.781 2.755 -9.923 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -4.753 3.920 -9.056 1.00 0.00 H new ATOM 945 N ILE A 138 -2.543 1.501 -7.906 1.00 0.00 N ATOM 946 CA ILE A 138 -1.231 1.534 -7.279 1.00 0.00 C ATOM 947 C ILE A 138 -0.287 2.446 -8.056 1.00 0.00 C ATOM 948 O ILE A 138 0.513 1.981 -8.869 1.00 0.00 O ATOM 949 CB ILE A 138 -0.606 0.124 -7.184 1.00 0.00 C ATOM 950 CG1 ILE A 138 -1.649 -0.952 -7.499 1.00 0.00 C ATOM 951 CG2 ILE A 138 -0.017 -0.097 -5.801 1.00 0.00 C ATOM 952 CD1 ILE A 138 -2.754 -1.042 -6.468 1.00 0.00 C ATOM 0 H ILE A 138 -2.578 0.986 -8.786 1.00 0.00 H new ATOM 0 HA ILE A 138 -1.370 1.921 -6.270 1.00 0.00 H new ATOM 0 HB ILE A 138 0.194 0.050 -7.921 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -2.089 -0.746 -8.475 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -1.151 -1.919 -7.572 1.00 0.00 H new ATOM 0 HG21 ILE A 138 0.420 -1.094 -5.747 1.00 0.00 H new ATOM 0 HG22 ILE A 138 0.755 0.649 -5.611 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -0.803 -0.004 -5.052 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -3.457 -1.824 -6.755 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -2.325 -1.279 -5.494 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -3.277 -0.087 -6.411 1.00 0.00 H new ATOM 964 N LEU A 139 -0.388 3.749 -7.803 1.00 0.00 N ATOM 965 CA LEU A 139 0.457 4.725 -8.484 1.00 0.00 C ATOM 966 C LEU A 139 1.883 4.211 -8.590 1.00 0.00 C ATOM 967 O LEU A 139 2.613 4.550 -9.522 1.00 0.00 O ATOM 968 CB LEU A 139 0.439 6.063 -7.740 1.00 0.00 C ATOM 969 CG LEU A 139 -0.855 6.871 -7.876 1.00 0.00 C ATOM 970 CD1 LEU A 139 -0.559 8.362 -7.832 1.00 0.00 C ATOM 971 CD2 LEU A 139 -1.585 6.509 -9.162 1.00 0.00 C ATOM 0 H LEU A 139 -1.044 4.152 -7.134 1.00 0.00 H new ATOM 0 HA LEU A 139 0.061 4.876 -9.488 1.00 0.00 H new ATOM 0 HB2 LEU A 139 0.620 5.874 -6.682 1.00 0.00 H new ATOM 0 HB3 LEU A 139 1.268 6.672 -8.101 1.00 0.00 H new ATOM 0 HG LEU A 139 -1.503 6.622 -7.035 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -1.490 8.921 -7.930 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -0.085 8.611 -6.883 1.00 0.00 H new ATOM 0 HD13 LEU A 139 0.110 8.625 -8.652 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -2.501 7.095 -9.238 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -0.944 6.725 -10.017 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -1.833 5.448 -9.153 1.00 0.00 H new ATOM 983 N VAL A 140 2.269 3.386 -7.627 1.00 0.00 N ATOM 984 CA VAL A 140 3.605 2.813 -7.600 1.00 0.00 C ATOM 985 C VAL A 140 3.581 1.366 -8.069 1.00 0.00 C ATOM 986 O VAL A 140 2.699 0.594 -7.691 1.00 0.00 O ATOM 987 CB VAL A 140 4.207 2.870 -6.187 1.00 0.00 C ATOM 988 CG1 VAL A 140 5.480 2.041 -6.112 1.00 0.00 C ATOM 989 CG2 VAL A 140 4.474 4.311 -5.779 1.00 0.00 C ATOM 0 H VAL A 140 1.672 3.098 -6.851 1.00 0.00 H new ATOM 0 HA VAL A 140 4.223 3.405 -8.275 1.00 0.00 H new ATOM 0 HB VAL A 140 3.486 2.446 -5.488 1.00 0.00 H new ATOM 0 HG11 VAL A 140 5.890 2.095 -5.104 1.00 0.00 H new ATOM 0 HG12 VAL A 140 5.253 1.003 -6.357 1.00 0.00 H new ATOM 0 HG13 VAL A 140 6.210 2.430 -6.822 1.00 0.00 H new ATOM 0 HG21 VAL A 140 4.900 4.332 -4.776 1.00 0.00 H new ATOM 0 HG22 VAL A 140 5.175 4.764 -6.480 1.00 0.00 H new ATOM 0 HG23 VAL A 140 3.539 4.871 -5.788 1.00 0.00 H new ATOM 999 N GLU A 141 4.556 1.002 -8.887 1.00 0.00 N ATOM 1000 CA GLU A 141 4.648 -0.356 -9.402 1.00 0.00 C ATOM 1001 C GLU A 141 4.953 -1.330 -8.274 1.00 0.00 C ATOM 1002 O GLU A 141 6.113 -1.536 -7.917 1.00 0.00 O ATOM 1003 CB GLU A 141 5.729 -0.446 -10.480 1.00 0.00 C ATOM 1004 CG GLU A 141 5.182 -0.341 -11.894 1.00 0.00 C ATOM 1005 CD GLU A 141 6.157 -0.850 -12.936 1.00 0.00 C ATOM 1006 OE1 GLU A 141 7.246 -0.253 -13.074 1.00 0.00 O ATOM 1007 OE2 GLU A 141 5.831 -1.846 -13.616 1.00 0.00 O ATOM 0 H GLU A 141 5.295 1.627 -9.209 1.00 0.00 H new ATOM 0 HA GLU A 141 3.689 -0.622 -9.846 1.00 0.00 H new ATOM 0 HB2 GLU A 141 6.458 0.349 -10.320 1.00 0.00 H new ATOM 0 HB3 GLU A 141 6.260 -1.392 -10.373 1.00 0.00 H new ATOM 0 HG2 GLU A 141 4.253 -0.908 -11.963 1.00 0.00 H new ATOM 0 HG3 GLU A 141 4.937 0.699 -12.108 1.00 0.00 H new ATOM 1014 N SER A 142 3.903 -1.919 -7.710 1.00 0.00 N ATOM 1015 CA SER A 142 4.060 -2.865 -6.614 1.00 0.00 C ATOM 1016 C SER A 142 5.332 -3.687 -6.786 1.00 0.00 C ATOM 1017 O SER A 142 5.648 -4.134 -7.890 1.00 0.00 O ATOM 1018 CB SER A 142 2.852 -3.796 -6.526 1.00 0.00 C ATOM 1019 OG SER A 142 2.671 -4.513 -7.735 1.00 0.00 O ATOM 0 H SER A 142 2.937 -1.757 -7.994 1.00 0.00 H new ATOM 0 HA SER A 142 4.133 -2.293 -5.689 1.00 0.00 H new ATOM 0 HB2 SER A 142 2.988 -4.496 -5.701 1.00 0.00 H new ATOM 0 HB3 SER A 142 1.956 -3.215 -6.307 1.00 0.00 H new ATOM 0 HG SER A 142 2.589 -5.470 -7.539 1.00 0.00 H new ATOM 1025 N GLY A 143 6.060 -3.884 -5.695 1.00 0.00 N ATOM 1026 CA GLY A 143 7.289 -4.652 -5.756 1.00 0.00 C ATOM 1027 C GLY A 143 8.476 -3.815 -6.190 1.00 0.00 C ATOM 1028 O GLY A 143 9.358 -4.301 -6.898 1.00 0.00 O ATOM 0 H GLY A 143 5.822 -3.526 -4.770 1.00 0.00 H new ATOM 0 HA2 GLY A 143 7.492 -5.084 -4.776 1.00 0.00 H new ATOM 0 HA3 GLY A 143 7.161 -5.482 -6.451 1.00 0.00 H new ATOM 1032 N GLN A 144 8.502 -2.555 -5.766 1.00 0.00 N ATOM 1033 CA GLN A 144 9.595 -1.656 -6.124 1.00 0.00 C ATOM 1034 C GLN A 144 9.745 -0.537 -5.098 1.00 0.00 C ATOM 1035 O GLN A 144 8.815 -0.234 -4.350 1.00 0.00 O ATOM 1036 CB GLN A 144 9.363 -1.065 -7.516 1.00 0.00 C ATOM 1037 CG GLN A 144 8.517 0.198 -7.511 1.00 0.00 C ATOM 1038 CD GLN A 144 9.335 1.446 -7.783 1.00 0.00 C ATOM 1039 OE1 GLN A 144 10.565 1.404 -7.804 1.00 0.00 O ATOM 1040 NE2 GLN A 144 8.653 2.566 -7.994 1.00 0.00 N ATOM 0 H GLN A 144 7.783 -2.135 -5.177 1.00 0.00 H new ATOM 0 HA GLN A 144 10.518 -2.236 -6.133 1.00 0.00 H new ATOM 0 HB2 GLN A 144 10.328 -0.843 -7.972 1.00 0.00 H new ATOM 0 HB3 GLN A 144 8.878 -1.814 -8.143 1.00 0.00 H new ATOM 0 HG2 GLN A 144 7.734 0.110 -8.264 1.00 0.00 H new ATOM 0 HG3 GLN A 144 8.021 0.296 -6.545 1.00 0.00 H new ATOM 0 HE21 GLN A 144 7.633 2.555 -7.967 1.00 0.00 H new ATOM 0 HE22 GLN A 144 9.149 3.437 -8.183 1.00 0.00 H new ATOM 1049 N PRO A 145 10.930 0.092 -5.054 1.00 0.00 N ATOM 1050 CA PRO A 145 11.215 1.185 -4.118 1.00 0.00 C ATOM 1051 C PRO A 145 10.425 2.449 -4.440 1.00 0.00 C ATOM 1052 O PRO A 145 9.671 2.492 -5.413 1.00 0.00 O ATOM 1053 CB PRO A 145 12.716 1.430 -4.301 1.00 0.00 C ATOM 1054 CG PRO A 145 13.017 0.938 -5.673 1.00 0.00 C ATOM 1055 CD PRO A 145 12.084 -0.216 -5.915 1.00 0.00 C ATOM 0 HA PRO A 145 10.933 0.928 -3.097 1.00 0.00 H new ATOM 0 HB2 PRO A 145 12.960 2.487 -4.198 1.00 0.00 H new ATOM 0 HB3 PRO A 145 13.299 0.894 -3.552 1.00 0.00 H new ATOM 0 HG2 PRO A 145 12.864 1.725 -6.412 1.00 0.00 H new ATOM 0 HG3 PRO A 145 14.057 0.622 -5.755 1.00 0.00 H new ATOM 0 HD2 PRO A 145 11.795 -0.286 -6.964 1.00 0.00 H new ATOM 0 HD3 PRO A 145 12.543 -1.167 -5.646 1.00 0.00 H new ATOM 1063 N VAL A 146 10.602 3.478 -3.616 1.00 0.00 N ATOM 1064 CA VAL A 146 9.905 4.745 -3.811 1.00 0.00 C ATOM 1065 C VAL A 146 10.643 5.889 -3.121 1.00 0.00 C ATOM 1066 O VAL A 146 11.742 5.705 -2.597 1.00 0.00 O ATOM 1067 CB VAL A 146 8.463 4.682 -3.274 1.00 0.00 C ATOM 1068 CG1 VAL A 146 7.493 4.328 -4.391 1.00 0.00 C ATOM 1069 CG2 VAL A 146 8.361 3.681 -2.134 1.00 0.00 C ATOM 0 H VAL A 146 11.222 3.459 -2.807 1.00 0.00 H new ATOM 0 HA VAL A 146 9.876 4.929 -4.885 1.00 0.00 H new ATOM 0 HB VAL A 146 8.195 5.666 -2.888 1.00 0.00 H new ATOM 0 HG11 VAL A 146 6.479 4.288 -3.993 1.00 0.00 H new ATOM 0 HG12 VAL A 146 7.546 5.086 -5.173 1.00 0.00 H new ATOM 0 HG13 VAL A 146 7.758 3.356 -4.808 1.00 0.00 H new ATOM 0 HG21 VAL A 146 7.335 3.650 -1.767 1.00 0.00 H new ATOM 0 HG22 VAL A 146 8.648 2.692 -2.491 1.00 0.00 H new ATOM 0 HG23 VAL A 146 9.026 3.982 -1.325 1.00 0.00 H new ATOM 1079 N GLU A 147 10.031 7.069 -3.125 1.00 0.00 N ATOM 1080 CA GLU A 147 10.631 8.243 -2.499 1.00 0.00 C ATOM 1081 C GLU A 147 9.576 9.077 -1.778 1.00 0.00 C ATOM 1082 O GLU A 147 8.418 9.125 -2.192 1.00 0.00 O ATOM 1083 CB GLU A 147 11.343 9.097 -3.549 1.00 0.00 C ATOM 1084 CG GLU A 147 12.421 9.998 -2.970 1.00 0.00 C ATOM 1085 CD GLU A 147 13.707 9.961 -3.774 1.00 0.00 C ATOM 1086 OE1 GLU A 147 14.509 9.027 -3.567 1.00 0.00 O ATOM 1087 OE2 GLU A 147 13.909 10.866 -4.612 1.00 0.00 O ATOM 0 H GLU A 147 9.121 7.238 -3.554 1.00 0.00 H new ATOM 0 HA GLU A 147 11.359 7.899 -1.764 1.00 0.00 H new ATOM 0 HB2 GLU A 147 11.791 8.441 -4.296 1.00 0.00 H new ATOM 0 HB3 GLU A 147 10.606 9.712 -4.066 1.00 0.00 H new ATOM 0 HG2 GLU A 147 12.051 11.022 -2.931 1.00 0.00 H new ATOM 0 HG3 GLU A 147 12.630 9.695 -1.944 1.00 0.00 H new ATOM 1094 N PHE A 148 9.984 9.732 -0.696 1.00 0.00 N ATOM 1095 CA PHE A 148 9.071 10.563 0.081 1.00 0.00 C ATOM 1096 C PHE A 148 8.097 11.302 -0.833 1.00 0.00 C ATOM 1097 O PHE A 148 8.509 12.043 -1.724 1.00 0.00 O ATOM 1098 CB PHE A 148 9.857 11.567 0.928 1.00 0.00 C ATOM 1099 CG PHE A 148 8.995 12.368 1.862 1.00 0.00 C ATOM 1100 CD1 PHE A 148 8.645 11.864 3.109 1.00 0.00 C ATOM 1101 CD2 PHE A 148 8.533 13.627 1.494 1.00 0.00 C ATOM 1102 CE1 PHE A 148 7.850 12.601 3.974 1.00 0.00 C ATOM 1103 CE2 PHE A 148 7.738 14.369 2.355 1.00 0.00 C ATOM 1104 CZ PHE A 148 7.397 13.854 3.596 1.00 0.00 C ATOM 0 H PHE A 148 10.939 9.704 -0.338 1.00 0.00 H new ATOM 0 HA PHE A 148 8.498 9.912 0.741 1.00 0.00 H new ATOM 0 HB2 PHE A 148 10.608 11.031 1.509 1.00 0.00 H new ATOM 0 HB3 PHE A 148 10.392 12.248 0.266 1.00 0.00 H new ATOM 0 HD1 PHE A 148 8.996 10.887 3.408 1.00 0.00 H new ATOM 0 HD2 PHE A 148 8.796 14.031 0.528 1.00 0.00 H new ATOM 0 HE1 PHE A 148 7.585 12.199 4.940 1.00 0.00 H new ATOM 0 HE2 PHE A 148 7.385 15.346 2.059 1.00 0.00 H new ATOM 0 HZ PHE A 148 6.778 14.430 4.268 1.00 0.00 H new ATOM 1114 N ASP A 149 6.803 11.092 -0.607 1.00 0.00 N ATOM 1115 CA ASP A 149 5.772 11.738 -1.413 1.00 0.00 C ATOM 1116 C ASP A 149 5.586 11.013 -2.740 1.00 0.00 C ATOM 1117 O ASP A 149 5.321 11.636 -3.769 1.00 0.00 O ATOM 1118 CB ASP A 149 6.132 13.204 -1.664 1.00 0.00 C ATOM 1119 CG ASP A 149 4.925 14.038 -2.046 1.00 0.00 C ATOM 1120 OD1 ASP A 149 4.432 13.884 -3.183 1.00 0.00 O ATOM 1121 OD2 ASP A 149 4.473 14.846 -1.208 1.00 0.00 O ATOM 0 H ASP A 149 6.444 10.481 0.126 1.00 0.00 H new ATOM 0 HA ASP A 149 4.834 11.693 -0.860 1.00 0.00 H new ATOM 0 HB2 ASP A 149 6.590 13.622 -0.767 1.00 0.00 H new ATOM 0 HB3 ASP A 149 6.876 13.262 -2.458 1.00 0.00 H new ATOM 1126 N GLU A 150 5.722 9.693 -2.709 1.00 0.00 N ATOM 1127 CA GLU A 150 5.564 8.881 -3.908 1.00 0.00 C ATOM 1128 C GLU A 150 4.324 8.000 -3.807 1.00 0.00 C ATOM 1129 O GLU A 150 4.423 6.791 -3.601 1.00 0.00 O ATOM 1130 CB GLU A 150 6.804 8.014 -4.135 1.00 0.00 C ATOM 1131 CG GLU A 150 7.899 8.712 -4.924 1.00 0.00 C ATOM 1132 CD GLU A 150 8.392 7.883 -6.095 1.00 0.00 C ATOM 1133 OE1 GLU A 150 9.075 6.866 -5.856 1.00 0.00 O ATOM 1134 OE2 GLU A 150 8.094 8.253 -7.250 1.00 0.00 O ATOM 0 H GLU A 150 5.941 9.162 -1.866 1.00 0.00 H new ATOM 0 HA GLU A 150 5.443 9.554 -4.757 1.00 0.00 H new ATOM 0 HB2 GLU A 150 7.204 7.707 -3.169 1.00 0.00 H new ATOM 0 HB3 GLU A 150 6.511 7.106 -4.662 1.00 0.00 H new ATOM 0 HG2 GLU A 150 7.524 9.667 -5.292 1.00 0.00 H new ATOM 0 HG3 GLU A 150 8.736 8.932 -4.261 1.00 0.00 H new ATOM 1141 N PRO A 151 3.134 8.600 -3.958 1.00 0.00 N ATOM 1142 CA PRO A 151 1.870 7.879 -3.894 1.00 0.00 C ATOM 1143 C PRO A 151 1.999 6.459 -4.435 1.00 0.00 C ATOM 1144 O PRO A 151 2.373 6.256 -5.590 1.00 0.00 O ATOM 1145 CB PRO A 151 0.972 8.731 -4.782 1.00 0.00 C ATOM 1146 CG PRO A 151 1.460 10.130 -4.574 1.00 0.00 C ATOM 1147 CD PRO A 151 2.927 10.036 -4.215 1.00 0.00 C ATOM 0 HA PRO A 151 1.495 7.752 -2.879 1.00 0.00 H new ATOM 0 HB2 PRO A 151 1.051 8.434 -5.828 1.00 0.00 H new ATOM 0 HB3 PRO A 151 -0.076 8.630 -4.500 1.00 0.00 H new ATOM 0 HG2 PRO A 151 1.321 10.725 -5.476 1.00 0.00 H new ATOM 0 HG3 PRO A 151 0.899 10.620 -3.779 1.00 0.00 H new ATOM 0 HD2 PRO A 151 3.561 10.393 -5.027 1.00 0.00 H new ATOM 0 HD3 PRO A 151 3.164 10.638 -3.337 1.00 0.00 H new ATOM 1155 N LEU A 152 1.703 5.477 -3.588 1.00 0.00 N ATOM 1156 CA LEU A 152 1.806 4.076 -3.980 1.00 0.00 C ATOM 1157 C LEU A 152 0.436 3.419 -4.116 1.00 0.00 C ATOM 1158 O LEU A 152 0.077 2.940 -5.188 1.00 0.00 O ATOM 1159 CB LEU A 152 2.650 3.303 -2.964 1.00 0.00 C ATOM 1160 CG LEU A 152 3.693 4.135 -2.213 1.00 0.00 C ATOM 1161 CD1 LEU A 152 3.614 3.863 -0.719 1.00 0.00 C ATOM 1162 CD2 LEU A 152 5.089 3.837 -2.738 1.00 0.00 C ATOM 0 H LEU A 152 1.391 5.626 -2.628 1.00 0.00 H new ATOM 0 HA LEU A 152 2.289 4.047 -4.957 1.00 0.00 H new ATOM 0 HB2 LEU A 152 1.982 2.844 -2.235 1.00 0.00 H new ATOM 0 HB3 LEU A 152 3.161 2.492 -3.483 1.00 0.00 H new ATOM 0 HG LEU A 152 3.481 5.191 -2.382 1.00 0.00 H new ATOM 0 HD11 LEU A 152 4.362 4.462 -0.200 1.00 0.00 H new ATOM 0 HD12 LEU A 152 2.621 4.125 -0.353 1.00 0.00 H new ATOM 0 HD13 LEU A 152 3.802 2.806 -0.531 1.00 0.00 H new ATOM 0 HD21 LEU A 152 5.818 4.437 -2.193 1.00 0.00 H new ATOM 0 HD22 LEU A 152 5.312 2.779 -2.598 1.00 0.00 H new ATOM 0 HD23 LEU A 152 5.138 4.081 -3.799 1.00 0.00 H new ATOM 1174 N VAL A 153 -0.320 3.388 -3.021 1.00 0.00 N ATOM 1175 CA VAL A 153 -1.641 2.773 -3.024 1.00 0.00 C ATOM 1176 C VAL A 153 -2.742 3.812 -2.850 1.00 0.00 C ATOM 1177 O VAL A 153 -2.900 4.397 -1.778 1.00 0.00 O ATOM 1178 CB VAL A 153 -1.767 1.718 -1.909 1.00 0.00 C ATOM 1179 CG1 VAL A 153 -1.243 2.267 -0.593 1.00 0.00 C ATOM 1180 CG2 VAL A 153 -3.211 1.258 -1.766 1.00 0.00 C ATOM 0 H VAL A 153 -0.039 3.781 -2.123 1.00 0.00 H new ATOM 0 HA VAL A 153 -1.759 2.289 -3.994 1.00 0.00 H new ATOM 0 HB VAL A 153 -1.161 0.854 -2.183 1.00 0.00 H new ATOM 0 HG11 VAL A 153 -1.340 1.507 0.183 1.00 0.00 H new ATOM 0 HG12 VAL A 153 -0.193 2.539 -0.705 1.00 0.00 H new ATOM 0 HG13 VAL A 153 -1.819 3.149 -0.312 1.00 0.00 H new ATOM 0 HG21 VAL A 153 -3.279 0.513 -0.973 1.00 0.00 H new ATOM 0 HG22 VAL A 153 -3.842 2.111 -1.517 1.00 0.00 H new ATOM 0 HG23 VAL A 153 -3.548 0.820 -2.705 1.00 0.00 H new ATOM 1190 N VAL A 154 -3.501 4.031 -3.915 1.00 0.00 N ATOM 1191 CA VAL A 154 -4.596 4.994 -3.896 1.00 0.00 C ATOM 1192 C VAL A 154 -5.915 4.328 -3.516 1.00 0.00 C ATOM 1193 O VAL A 154 -6.164 3.174 -3.869 1.00 0.00 O ATOM 1194 CB VAL A 154 -4.765 5.679 -5.262 1.00 0.00 C ATOM 1195 CG1 VAL A 154 -5.642 6.915 -5.137 1.00 0.00 C ATOM 1196 CG2 VAL A 154 -3.411 6.034 -5.854 1.00 0.00 C ATOM 0 H VAL A 154 -3.378 3.553 -4.808 1.00 0.00 H new ATOM 0 HA VAL A 154 -4.339 5.742 -3.146 1.00 0.00 H new ATOM 0 HB VAL A 154 -5.258 4.980 -5.938 1.00 0.00 H new ATOM 0 HG11 VAL A 154 -5.749 7.385 -6.114 1.00 0.00 H new ATOM 0 HG12 VAL A 154 -6.625 6.628 -4.763 1.00 0.00 H new ATOM 0 HG13 VAL A 154 -5.182 7.619 -4.444 1.00 0.00 H new ATOM 0 HG21 VAL A 154 -3.552 6.518 -6.821 1.00 0.00 H new ATOM 0 HG22 VAL A 154 -2.887 6.713 -5.182 1.00 0.00 H new ATOM 0 HG23 VAL A 154 -2.822 5.126 -5.985 1.00 0.00 H new ATOM 1206 N ILE A 155 -6.758 5.067 -2.799 1.00 0.00 N ATOM 1207 CA ILE A 155 -8.056 4.555 -2.369 1.00 0.00 C ATOM 1208 C ILE A 155 -9.121 5.646 -2.423 1.00 0.00 C ATOM 1209 O ILE A 155 -8.873 6.790 -2.041 1.00 0.00 O ATOM 1210 CB ILE A 155 -7.981 3.983 -0.936 1.00 0.00 C ATOM 1211 CG1 ILE A 155 -7.215 2.660 -0.934 1.00 0.00 C ATOM 1212 CG2 ILE A 155 -9.376 3.794 -0.356 1.00 0.00 C ATOM 1213 CD1 ILE A 155 -6.600 2.319 0.406 1.00 0.00 C ATOM 0 H ILE A 155 -6.565 6.024 -2.503 1.00 0.00 H new ATOM 0 HA ILE A 155 -8.331 3.755 -3.056 1.00 0.00 H new ATOM 0 HB ILE A 155 -7.447 4.696 -0.308 1.00 0.00 H new ATOM 0 HG12 ILE A 155 -7.891 1.858 -1.229 1.00 0.00 H new ATOM 0 HG13 ILE A 155 -6.427 2.705 -1.685 1.00 0.00 H new ATOM 0 HG21 ILE A 155 -9.299 3.390 0.654 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -9.890 4.755 -0.324 1.00 0.00 H new ATOM 0 HG23 ILE A 155 -9.939 3.102 -0.981 1.00 0.00 H new ATOM 0 HD11 ILE A 155 -6.073 1.368 0.333 1.00 0.00 H new ATOM 0 HD12 ILE A 155 -5.898 3.102 0.694 1.00 0.00 H new ATOM 0 HD13 ILE A 155 -7.386 2.241 1.158 1.00 0.00 H new ATOM 1225 N GLU A 156 -10.312 5.285 -2.898 1.00 0.00 N ATOM 1226 CA GLU A 156 -11.414 6.235 -2.998 1.00 0.00 C ATOM 1227 C GLU A 156 -12.037 6.492 -1.630 1.00 0.00 C ATOM 1228 O GLU A 156 -12.885 5.679 -1.205 1.00 0.00 O ATOM 1229 CB GLU A 156 -12.479 5.714 -3.966 1.00 0.00 C ATOM 1230 CG GLU A 156 -13.494 6.767 -4.379 1.00 0.00 C ATOM 1231 CD GLU A 156 -14.906 6.412 -3.955 1.00 0.00 C ATOM 1232 OE1 GLU A 156 -15.123 5.262 -3.519 1.00 0.00 O ATOM 1233 OE2 GLU A 156 -15.794 7.284 -4.060 1.00 0.00 O ATOM 1234 OXT GLU A 156 -11.671 7.503 -0.994 1.00 0.00 O ATOM 0 H GLU A 156 -10.536 4.343 -3.219 1.00 0.00 H new ATOM 0 HA GLU A 156 -11.016 7.175 -3.379 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -11.988 5.325 -4.858 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -13.003 4.879 -3.501 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -13.217 7.726 -3.940 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -13.464 6.891 -5.461 1.00 0.00 H new TER 1241 GLU A 156