USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 935 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 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= -0.814 USER MOD Single : A 21 THR OG1 : rot 100:sc= -4.39! USER MOD Single : A 27 THR OG1 : rot 128:sc= -1.88! USER MOD Single : A 28 SER OG : rot 31:sc= -0.438! USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -137:sc= -1.66! USER MOD Single : A 42 GLN : amide:sc= -6.98! C(o=-7!,f=-7.7!) USER MOD Single : A 43 TYR OH : rot -140:sc= -4.34! USER MOD Single : A 50 ASN : amide:sc= -2.5! C(o=-2.5!,f=-3.2!) USER MOD Single : A 58 THR OG1 : rot 102:sc= 0.149 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0136 USER MOD Single : A 60 TYR OH : rot 165:sc= -2.07! USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.0765 USER MOD Single : A 64 TYR OH : rot 0:sc= -1.9 USER MOD Single : A 65 THR OG1 : rot 177:sc= -1.73! USER MOD Single : A 67 THR OG1 : rot 150:sc= -2.32! USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -16.8! C(o=-17!,f=-23!) USER MOD Single : A 81 ASN : amide:sc= 0 K(o=0,f=-2.2!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.114 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.54 USER MOD Single : A 97 SER OG : rot 63:sc= 0.0146 USER MOD Single : A 101 GLN : amide:sc= -0.928 K(o=-0.93,f=-6.9!) USER MOD Single : A 103 THR OG1 : rot 180:sc=-0.00369 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= -0.333 USER MOD Single : A 111 THR OG1 : rot 180:sc= -0.445 USER MOD Single : A 112 TYR OH : rot 9:sc= -2.92! USER MOD Single : A 124 GLN : amide:sc= -0.708 K(o=-0.71,f=-1.7!) USER MOD Single : A 128 GLN : amide:sc= -0.165 K(o=-0.17,f=-0.75) USER MOD Single : A 133 SER OG : rot -138:sc= 0.249 USER MOD Single : A 138 THR OG1 : rot -105:sc= -1.68! USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 24 N PRO A 3 -8.153 7.314 5.261 1.00 0.00 N ATOM 25 CA PRO A 3 -8.151 6.434 6.452 1.00 0.00 C ATOM 26 C PRO A 3 -6.733 5.938 6.771 1.00 0.00 C ATOM 27 O PRO A 3 -6.555 4.957 7.465 1.00 0.00 O ATOM 28 CB PRO A 3 -9.040 5.270 6.030 1.00 0.00 C ATOM 29 CG PRO A 3 -8.966 5.230 4.533 1.00 0.00 C ATOM 30 CD PRO A 3 -8.567 6.604 4.049 1.00 0.00 C ATOM 0 HA PRO A 3 -8.500 6.941 7.352 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -8.692 4.333 6.465 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -10.066 5.417 6.368 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -8.240 4.485 4.207 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -9.929 4.942 4.111 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -7.755 6.549 3.324 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -9.399 7.109 3.558 1.00 0.00 H new ATOM 38 N ILE A 4 -5.724 6.604 6.276 1.00 0.00 N ATOM 39 CA ILE A 4 -4.329 6.159 6.562 1.00 0.00 C ATOM 40 C ILE A 4 -3.437 7.371 6.844 1.00 0.00 C ATOM 41 O ILE A 4 -2.559 7.326 7.683 1.00 0.00 O ATOM 42 CB ILE A 4 -3.874 5.441 5.292 1.00 0.00 C ATOM 43 CG1 ILE A 4 -3.640 6.470 4.182 1.00 0.00 C ATOM 44 CG2 ILE A 4 -4.953 4.452 4.850 1.00 0.00 C ATOM 45 CD1 ILE A 4 -3.445 5.747 2.848 1.00 0.00 C ATOM 0 H ILE A 4 -5.805 7.434 5.688 1.00 0.00 H new ATOM 0 HA ILE A 4 -4.272 5.512 7.437 1.00 0.00 H new ATOM 0 HB ILE A 4 -2.948 4.902 5.491 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -4.489 7.151 4.118 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -2.763 7.075 4.411 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.628 3.940 3.944 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.121 3.720 5.640 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -5.880 4.990 4.650 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -3.279 6.479 2.058 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -2.582 5.084 2.916 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -4.335 5.161 2.618 1.00 0.00 H new ATOM 57 N GLY A 5 -3.656 8.455 6.150 1.00 0.00 N ATOM 58 CA GLY A 5 -2.821 9.668 6.379 1.00 0.00 C ATOM 59 C GLY A 5 -2.944 10.606 5.177 1.00 0.00 C ATOM 60 O GLY A 5 -2.730 10.213 4.047 1.00 0.00 O ATOM 0 H GLY A 5 -4.377 8.553 5.435 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -3.143 10.178 7.287 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -1.779 9.383 6.526 1.00 0.00 H new ATOM 64 N GLU A 6 -3.286 11.843 5.410 1.00 0.00 N ATOM 65 CA GLU A 6 -3.422 12.805 4.279 1.00 0.00 C ATOM 66 C GLU A 6 -2.040 13.194 3.747 1.00 0.00 C ATOM 67 O GLU A 6 -1.500 14.226 4.094 1.00 0.00 O ATOM 68 CB GLU A 6 -4.130 14.021 4.876 1.00 0.00 C ATOM 69 CG GLU A 6 -5.603 13.687 5.119 1.00 0.00 C ATOM 70 CD GLU A 6 -6.173 14.631 6.180 1.00 0.00 C ATOM 71 OE1 GLU A 6 -5.431 15.476 6.653 1.00 0.00 O ATOM 72 OE2 GLU A 6 -7.342 14.494 6.500 1.00 0.00 O ATOM 0 H GLU A 6 -3.477 12.230 6.334 1.00 0.00 H new ATOM 0 HA GLU A 6 -3.977 12.382 3.441 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -3.652 14.309 5.812 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -4.046 14.872 4.200 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -6.166 13.783 4.191 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -5.703 12.652 5.446 1.00 0.00 H new ATOM 79 N GLY A 7 -1.465 12.377 2.908 1.00 0.00 N ATOM 80 CA GLY A 7 -0.120 12.703 2.356 1.00 0.00 C ATOM 81 C GLY A 7 0.899 11.675 2.850 1.00 0.00 C ATOM 82 O GLY A 7 0.744 10.487 2.649 1.00 0.00 O ATOM 0 H GLY A 7 -1.868 11.499 2.581 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.153 12.703 1.266 1.00 0.00 H new ATOM 0 HA3 GLY A 7 0.179 13.704 2.666 1.00 0.00 H new ATOM 86 N THR A 8 1.942 12.123 3.493 1.00 0.00 N ATOM 87 CA THR A 8 2.973 11.171 3.998 1.00 0.00 C ATOM 88 C THR A 8 2.508 10.539 5.311 1.00 0.00 C ATOM 89 O THR A 8 1.446 10.843 5.817 1.00 0.00 O ATOM 90 CB THR A 8 4.222 12.024 4.227 1.00 0.00 C ATOM 91 OG1 THR A 8 4.059 12.791 5.412 1.00 0.00 O ATOM 92 CG2 THR A 8 4.432 12.960 3.036 1.00 0.00 C ATOM 0 H THR A 8 2.125 13.107 3.691 1.00 0.00 H new ATOM 0 HA THR A 8 3.159 10.355 3.300 1.00 0.00 H new ATOM 0 HB THR A 8 5.091 11.374 4.330 1.00 0.00 H new ATOM 0 HG1 THR A 8 4.859 13.337 5.561 1.00 0.00 H new ATOM 0 HG21 THR A 8 5.322 13.566 3.202 1.00 0.00 H new ATOM 0 HG22 THR A 8 4.559 12.371 2.128 1.00 0.00 H new ATOM 0 HG23 THR A 8 3.565 13.611 2.928 1.00 0.00 H new ATOM 100 N PHE A 9 3.299 9.665 5.869 1.00 0.00 N ATOM 101 CA PHE A 9 2.906 9.018 7.152 1.00 0.00 C ATOM 102 C PHE A 9 2.928 10.054 8.276 1.00 0.00 C ATOM 103 O PHE A 9 2.106 10.030 9.171 1.00 0.00 O ATOM 104 CB PHE A 9 3.958 7.931 7.384 1.00 0.00 C ATOM 105 CG PHE A 9 3.808 6.863 6.326 1.00 0.00 C ATOM 106 CD1 PHE A 9 2.536 6.378 6.003 1.00 0.00 C ATOM 107 CD2 PHE A 9 4.937 6.361 5.665 1.00 0.00 C ATOM 108 CE1 PHE A 9 2.390 5.392 5.020 1.00 0.00 C ATOM 109 CE2 PHE A 9 4.790 5.375 4.681 1.00 0.00 C ATOM 110 CZ PHE A 9 3.517 4.891 4.359 1.00 0.00 C ATOM 0 H PHE A 9 4.200 9.371 5.492 1.00 0.00 H new ATOM 0 HA PHE A 9 1.900 8.599 7.125 1.00 0.00 H new ATOM 0 HB2 PHE A 9 4.959 8.362 7.344 1.00 0.00 H new ATOM 0 HB3 PHE A 9 3.837 7.497 8.376 1.00 0.00 H new ATOM 0 HD1 PHE A 9 1.666 6.765 6.513 1.00 0.00 H new ATOM 0 HD2 PHE A 9 5.920 6.734 5.914 1.00 0.00 H new ATOM 0 HE1 PHE A 9 1.408 5.018 4.772 1.00 0.00 H new ATOM 0 HE2 PHE A 9 5.660 4.988 4.171 1.00 0.00 H new ATOM 0 HZ PHE A 9 3.404 4.131 3.600 1.00 0.00 H new ATOM 120 N ASP A 10 3.857 10.971 8.223 1.00 0.00 N ATOM 121 CA ASP A 10 3.939 12.029 9.273 1.00 0.00 C ATOM 122 C ASP A 10 3.610 11.449 10.654 1.00 0.00 C ATOM 123 O ASP A 10 2.907 12.055 11.434 1.00 0.00 O ATOM 124 CB ASP A 10 2.895 13.065 8.856 1.00 0.00 C ATOM 125 CG ASP A 10 2.760 14.131 9.945 1.00 0.00 C ATOM 126 OD1 ASP A 10 3.693 14.283 10.716 1.00 0.00 O ATOM 127 OD2 ASP A 10 1.725 14.776 9.991 1.00 0.00 O ATOM 0 H ASP A 10 4.567 11.033 7.493 1.00 0.00 H new ATOM 0 HA ASP A 10 4.938 12.458 9.352 1.00 0.00 H new ATOM 0 HB2 ASP A 10 3.186 13.529 7.914 1.00 0.00 H new ATOM 0 HB3 ASP A 10 1.934 12.579 8.688 1.00 0.00 H new ATOM 132 N ASP A 11 4.126 10.282 10.953 1.00 0.00 N ATOM 133 CA ASP A 11 3.863 9.636 12.281 1.00 0.00 C ATOM 134 C ASP A 11 4.188 8.140 12.197 1.00 0.00 C ATOM 135 O ASP A 11 3.312 7.298 12.212 1.00 0.00 O ATOM 136 CB ASP A 11 2.367 9.839 12.567 1.00 0.00 C ATOM 137 CG ASP A 11 1.906 8.858 13.648 1.00 0.00 C ATOM 138 OD1 ASP A 11 2.697 8.562 14.528 1.00 0.00 O ATOM 139 OD2 ASP A 11 0.769 8.420 13.577 1.00 0.00 O ATOM 0 H ASP A 11 4.725 9.742 10.328 1.00 0.00 H new ATOM 0 HA ASP A 11 4.477 10.069 13.071 1.00 0.00 H new ATOM 0 HB2 ASP A 11 2.186 10.863 12.892 1.00 0.00 H new ATOM 0 HB3 ASP A 11 1.789 9.687 11.655 1.00 0.00 H new ATOM 144 N GLY A 12 5.445 7.805 12.109 1.00 0.00 N ATOM 145 CA GLY A 12 5.831 6.369 12.025 1.00 0.00 C ATOM 146 C GLY A 12 4.909 5.639 11.047 1.00 0.00 C ATOM 147 O GLY A 12 4.159 6.255 10.317 1.00 0.00 O ATOM 0 H GLY A 12 6.223 8.465 12.092 1.00 0.00 H new ATOM 0 HA2 GLY A 12 6.867 6.280 11.697 1.00 0.00 H new ATOM 0 HA3 GLY A 12 5.768 5.908 13.011 1.00 0.00 H new ATOM 151 N PRO A 13 5.002 4.338 11.071 1.00 0.00 N ATOM 152 CA PRO A 13 4.171 3.492 10.181 1.00 0.00 C ATOM 153 C PRO A 13 2.724 3.452 10.683 1.00 0.00 C ATOM 154 O PRO A 13 2.324 2.524 11.355 1.00 0.00 O ATOM 155 CB PRO A 13 4.819 2.117 10.291 1.00 0.00 C ATOM 156 CG PRO A 13 5.504 2.115 11.621 1.00 0.00 C ATOM 157 CD PRO A 13 5.889 3.540 11.923 1.00 0.00 C ATOM 0 HA PRO A 13 4.129 3.859 9.155 1.00 0.00 H new ATOM 0 HB2 PRO A 13 4.074 1.324 10.230 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.529 1.950 9.481 1.00 0.00 H new ATOM 0 HG2 PRO A 13 4.843 1.722 12.394 1.00 0.00 H new ATOM 0 HG3 PRO A 13 6.385 1.474 11.599 1.00 0.00 H new ATOM 0 HD2 PRO A 13 5.747 3.776 12.978 1.00 0.00 H new ATOM 0 HD3 PRO A 13 6.938 3.727 11.692 1.00 0.00 H new ATOM 165 N GLU A 14 1.951 4.462 10.367 1.00 0.00 N ATOM 166 CA GLU A 14 0.525 4.511 10.822 1.00 0.00 C ATOM 167 C GLU A 14 -0.071 3.105 10.926 1.00 0.00 C ATOM 168 O GLU A 14 -0.372 2.625 12.001 1.00 0.00 O ATOM 169 CB GLU A 14 -0.202 5.317 9.745 1.00 0.00 C ATOM 170 CG GLU A 14 -0.816 6.571 10.372 1.00 0.00 C ATOM 171 CD GLU A 14 -2.008 6.175 11.245 1.00 0.00 C ATOM 172 OE1 GLU A 14 -2.153 4.994 11.516 1.00 0.00 O ATOM 173 OE2 GLU A 14 -2.756 7.059 11.629 1.00 0.00 O ATOM 0 H GLU A 14 2.249 5.262 9.808 1.00 0.00 H new ATOM 0 HA GLU A 14 0.433 4.958 11.812 1.00 0.00 H new ATOM 0 HB2 GLU A 14 0.493 5.597 8.954 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -0.981 4.709 9.285 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -0.070 7.093 10.972 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -1.137 7.261 9.591 1.00 0.00 H new ATOM 180 N GLY A 15 -0.242 2.443 9.820 1.00 0.00 N ATOM 181 CA GLY A 15 -0.819 1.068 9.858 1.00 0.00 C ATOM 182 C GLY A 15 -0.191 0.210 8.757 1.00 0.00 C ATOM 183 O GLY A 15 -0.640 -0.884 8.481 1.00 0.00 O ATOM 0 H GLY A 15 -0.008 2.791 8.890 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -0.638 0.615 10.833 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -1.900 1.114 9.724 1.00 0.00 H new ATOM 187 N TRP A 16 0.842 0.695 8.124 1.00 0.00 N ATOM 188 CA TRP A 16 1.489 -0.099 7.041 1.00 0.00 C ATOM 189 C TRP A 16 2.377 -1.189 7.642 1.00 0.00 C ATOM 190 O TRP A 16 3.554 -0.988 7.868 1.00 0.00 O ATOM 191 CB TRP A 16 2.333 0.910 6.263 1.00 0.00 C ATOM 192 CG TRP A 16 1.469 1.633 5.282 1.00 0.00 C ATOM 193 CD1 TRP A 16 0.914 2.849 5.487 1.00 0.00 C ATOM 194 CD2 TRP A 16 1.052 1.211 3.953 1.00 0.00 C ATOM 195 NE1 TRP A 16 0.181 3.200 4.367 1.00 0.00 N ATOM 196 CE2 TRP A 16 0.236 2.222 3.393 1.00 0.00 C ATOM 197 CE3 TRP A 16 1.301 0.059 3.186 1.00 0.00 C ATOM 198 CZ2 TRP A 16 -0.314 2.095 2.117 1.00 0.00 C ATOM 199 CZ3 TRP A 16 0.749 -0.073 1.901 1.00 0.00 C ATOM 200 CH2 TRP A 16 -0.057 0.944 1.368 1.00 0.00 C ATOM 0 H TRP A 16 1.265 1.604 8.309 1.00 0.00 H new ATOM 0 HA TRP A 16 0.760 -0.600 6.404 1.00 0.00 H new ATOM 0 HB2 TRP A 16 2.794 1.620 6.949 1.00 0.00 H new ATOM 0 HB3 TRP A 16 3.142 0.398 5.742 1.00 0.00 H new ATOM 0 HD1 TRP A 16 1.025 3.448 6.379 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -0.337 4.074 4.272 1.00 0.00 H new ATOM 0 HE3 TRP A 16 1.921 -0.729 3.587 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -0.934 2.881 1.711 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 0.946 -0.962 1.320 1.00 0.00 H new ATOM 0 HH2 TRP A 16 -0.479 0.837 0.379 1.00 0.00 H new ATOM 211 N VAL A 17 1.829 -2.345 7.900 1.00 0.00 N ATOM 212 CA VAL A 17 2.656 -3.442 8.483 1.00 0.00 C ATOM 213 C VAL A 17 3.368 -4.197 7.357 1.00 0.00 C ATOM 214 O VAL A 17 2.831 -4.371 6.284 1.00 0.00 O ATOM 215 CB VAL A 17 1.677 -4.369 9.241 1.00 0.00 C ATOM 216 CG1 VAL A 17 0.466 -3.571 9.740 1.00 0.00 C ATOM 217 CG2 VAL A 17 1.191 -5.502 8.323 1.00 0.00 C ATOM 0 H VAL A 17 0.850 -2.578 7.734 1.00 0.00 H new ATOM 0 HA VAL A 17 3.423 -3.063 9.158 1.00 0.00 H new ATOM 0 HB VAL A 17 2.206 -4.797 10.093 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -0.214 -4.236 10.271 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.802 -2.783 10.413 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -0.052 -3.126 8.890 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.503 -6.145 8.872 1.00 0.00 H new ATOM 0 HG22 VAL A 17 0.680 -5.077 7.460 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.045 -6.089 7.986 1.00 0.00 H new ATOM 227 N ALA A 18 4.562 -4.653 7.590 1.00 0.00 N ATOM 228 CA ALA A 18 5.281 -5.400 6.524 1.00 0.00 C ATOM 229 C ALA A 18 5.794 -6.729 7.075 1.00 0.00 C ATOM 230 O ALA A 18 6.433 -6.783 8.108 1.00 0.00 O ATOM 231 CB ALA A 18 6.435 -4.495 6.109 1.00 0.00 C ATOM 0 H ALA A 18 5.071 -4.543 8.467 1.00 0.00 H new ATOM 0 HA ALA A 18 4.639 -5.638 5.676 1.00 0.00 H new ATOM 0 HB1 ALA A 18 7.013 -4.980 5.323 1.00 0.00 H new ATOM 0 HB2 ALA A 18 6.040 -3.549 5.738 1.00 0.00 H new ATOM 0 HB3 ALA A 18 7.078 -4.307 6.969 1.00 0.00 H new ATOM 237 N TYR A 19 5.505 -7.803 6.398 1.00 0.00 N ATOM 238 CA TYR A 19 5.958 -9.137 6.882 1.00 0.00 C ATOM 239 C TYR A 19 6.993 -9.729 5.923 1.00 0.00 C ATOM 240 O TYR A 19 6.927 -9.538 4.725 1.00 0.00 O ATOM 241 CB TYR A 19 4.690 -9.990 6.897 1.00 0.00 C ATOM 242 CG TYR A 19 3.968 -9.826 5.582 1.00 0.00 C ATOM 243 CD1 TYR A 19 4.334 -10.612 4.485 1.00 0.00 C ATOM 244 CD2 TYR A 19 2.939 -8.883 5.456 1.00 0.00 C ATOM 245 CE1 TYR A 19 3.674 -10.460 3.261 1.00 0.00 C ATOM 246 CE2 TYR A 19 2.278 -8.731 4.231 1.00 0.00 C ATOM 247 CZ TYR A 19 2.646 -9.519 3.133 1.00 0.00 C ATOM 248 OH TYR A 19 1.994 -9.369 1.926 1.00 0.00 O ATOM 0 H TYR A 19 4.973 -7.816 5.528 1.00 0.00 H new ATOM 0 HA TYR A 19 6.434 -9.086 7.861 1.00 0.00 H new ATOM 0 HB2 TYR A 19 4.944 -11.038 7.058 1.00 0.00 H new ATOM 0 HB3 TYR A 19 4.044 -9.688 7.721 1.00 0.00 H new ATOM 0 HD1 TYR A 19 5.128 -11.338 4.583 1.00 0.00 H new ATOM 0 HD2 TYR A 19 2.656 -8.275 6.302 1.00 0.00 H new ATOM 0 HE1 TYR A 19 3.958 -11.069 2.415 1.00 0.00 H new ATOM 0 HE2 TYR A 19 1.484 -8.006 4.133 1.00 0.00 H new ATOM 0 HH TYR A 19 1.307 -8.675 2.009 1.00 0.00 H new ATOM 258 N GLY A 20 7.948 -10.448 6.447 1.00 0.00 N ATOM 259 CA GLY A 20 8.993 -11.057 5.578 1.00 0.00 C ATOM 260 C GLY A 20 10.246 -11.324 6.414 1.00 0.00 C ATOM 261 O GLY A 20 10.394 -12.371 7.011 1.00 0.00 O ATOM 0 H GLY A 20 8.049 -10.640 7.444 1.00 0.00 H new ATOM 0 HA2 GLY A 20 8.626 -11.987 5.143 1.00 0.00 H new ATOM 0 HA3 GLY A 20 9.229 -10.389 4.749 1.00 0.00 H new ATOM 265 N THR A 21 11.148 -10.381 6.466 1.00 0.00 N ATOM 266 CA THR A 21 12.390 -10.580 7.272 1.00 0.00 C ATOM 267 C THR A 21 12.922 -9.229 7.759 1.00 0.00 C ATOM 268 O THR A 21 14.071 -9.101 8.131 1.00 0.00 O ATOM 269 CB THR A 21 13.397 -11.232 6.320 1.00 0.00 C ATOM 270 OG1 THR A 21 13.979 -10.231 5.497 1.00 0.00 O ATOM 271 CG2 THR A 21 12.693 -12.271 5.445 1.00 0.00 C ATOM 0 H THR A 21 11.080 -9.483 5.987 1.00 0.00 H new ATOM 0 HA THR A 21 12.209 -11.196 8.153 1.00 0.00 H new ATOM 0 HB THR A 21 14.174 -11.728 6.902 1.00 0.00 H new ATOM 0 HG1 THR A 21 14.861 -9.989 5.850 1.00 0.00 H new ATOM 0 HG21 THR A 21 13.417 -12.730 4.771 1.00 0.00 H new ATOM 0 HG22 THR A 21 12.249 -13.039 6.078 1.00 0.00 H new ATOM 0 HG23 THR A 21 11.911 -11.785 4.861 1.00 0.00 H new ATOM 279 N ASP A 22 12.094 -8.222 7.760 1.00 0.00 N ATOM 280 CA ASP A 22 12.548 -6.882 8.223 1.00 0.00 C ATOM 281 C ASP A 22 12.032 -6.609 9.638 1.00 0.00 C ATOM 282 O ASP A 22 10.964 -7.049 10.015 1.00 0.00 O ATOM 283 CB ASP A 22 11.936 -5.894 7.232 1.00 0.00 C ATOM 284 CG ASP A 22 10.438 -6.170 7.086 1.00 0.00 C ATOM 285 OD1 ASP A 22 9.745 -6.115 8.089 1.00 0.00 O ATOM 286 OD2 ASP A 22 10.010 -6.430 5.974 1.00 0.00 O ATOM 0 H ASP A 22 11.120 -8.270 7.459 1.00 0.00 H new ATOM 0 HA ASP A 22 13.635 -6.804 8.260 1.00 0.00 H new ATOM 0 HB2 ASP A 22 12.095 -4.872 7.577 1.00 0.00 H new ATOM 0 HB3 ASP A 22 12.428 -5.984 6.264 1.00 0.00 H new ATOM 291 N GLY A 23 12.779 -5.882 10.423 1.00 0.00 N ATOM 292 CA GLY A 23 12.327 -5.579 11.810 1.00 0.00 C ATOM 293 C GLY A 23 11.151 -4.602 11.757 1.00 0.00 C ATOM 294 O GLY A 23 10.271 -4.735 10.929 1.00 0.00 O ATOM 0 H GLY A 23 13.682 -5.485 10.164 1.00 0.00 H new ATOM 0 HA2 GLY A 23 12.029 -6.497 12.316 1.00 0.00 H new ATOM 0 HA3 GLY A 23 13.146 -5.149 12.386 1.00 0.00 H new ATOM 298 N PRO A 24 11.179 -3.648 12.646 1.00 0.00 N ATOM 299 CA PRO A 24 10.101 -2.631 12.703 1.00 0.00 C ATOM 300 C PRO A 24 10.233 -1.649 11.535 1.00 0.00 C ATOM 301 O PRO A 24 11.306 -1.156 11.246 1.00 0.00 O ATOM 302 CB PRO A 24 10.345 -1.927 14.036 1.00 0.00 C ATOM 303 CG PRO A 24 11.799 -2.131 14.323 1.00 0.00 C ATOM 304 CD PRO A 24 12.205 -3.428 13.671 1.00 0.00 C ATOM 0 HA PRO A 24 9.101 -3.059 12.629 1.00 0.00 H new ATOM 0 HB2 PRO A 24 10.101 -0.867 13.973 1.00 0.00 H new ATOM 0 HB3 PRO A 24 9.724 -2.351 14.825 1.00 0.00 H new ATOM 0 HG2 PRO A 24 12.388 -1.302 13.931 1.00 0.00 H new ATOM 0 HG3 PRO A 24 11.977 -2.168 15.398 1.00 0.00 H new ATOM 0 HD2 PRO A 24 13.200 -3.359 13.231 1.00 0.00 H new ATOM 0 HD3 PRO A 24 12.231 -4.246 14.391 1.00 0.00 H new ATOM 312 N LEU A 25 9.152 -1.362 10.861 1.00 0.00 N ATOM 313 CA LEU A 25 9.219 -0.412 9.713 1.00 0.00 C ATOM 314 C LEU A 25 10.104 0.785 10.072 1.00 0.00 C ATOM 315 O LEU A 25 9.774 1.576 10.934 1.00 0.00 O ATOM 316 CB LEU A 25 7.776 0.038 9.486 1.00 0.00 C ATOM 317 CG LEU A 25 6.925 -1.162 9.068 1.00 0.00 C ATOM 318 CD1 LEU A 25 5.494 -0.975 9.576 1.00 0.00 C ATOM 319 CD2 LEU A 25 6.911 -1.269 7.541 1.00 0.00 C ATOM 0 H LEU A 25 8.226 -1.744 11.055 1.00 0.00 H new ATOM 0 HA LEU A 25 9.647 -0.870 8.821 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.375 0.481 10.397 1.00 0.00 H new ATOM 0 HB3 LEU A 25 7.741 0.808 8.715 1.00 0.00 H new ATOM 0 HG LEU A 25 7.347 -2.072 9.494 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.887 -1.830 9.278 1.00 0.00 H new ATOM 0 HD12 LEU A 25 5.501 -0.896 10.663 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.072 -0.065 9.149 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.305 -2.124 7.242 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.489 -0.358 7.116 1.00 0.00 H new ATOM 0 HD23 LEU A 25 7.930 -1.401 7.176 1.00 0.00 H new ATOM 331 N ASP A 26 11.225 0.924 9.420 1.00 0.00 N ATOM 332 CA ASP A 26 12.130 2.069 9.727 1.00 0.00 C ATOM 333 C ASP A 26 11.464 3.390 9.331 1.00 0.00 C ATOM 334 O ASP A 26 11.432 3.758 8.174 1.00 0.00 O ATOM 335 CB ASP A 26 13.381 1.821 8.883 1.00 0.00 C ATOM 336 CG ASP A 26 14.403 2.929 9.145 1.00 0.00 C ATOM 337 OD1 ASP A 26 15.064 2.868 10.169 1.00 0.00 O ATOM 338 OD2 ASP A 26 14.508 3.818 8.317 1.00 0.00 O ATOM 0 H ASP A 26 11.554 0.295 8.688 1.00 0.00 H new ATOM 0 HA ASP A 26 12.364 2.139 10.789 1.00 0.00 H new ATOM 0 HB2 ASP A 26 13.811 0.850 9.128 1.00 0.00 H new ATOM 0 HB3 ASP A 26 13.120 1.796 7.825 1.00 0.00 H new ATOM 343 N THR A 27 10.932 4.104 10.284 1.00 0.00 N ATOM 344 CA THR A 27 10.267 5.398 9.966 1.00 0.00 C ATOM 345 C THR A 27 10.976 6.543 10.695 1.00 0.00 C ATOM 346 O THR A 27 11.796 7.240 10.130 1.00 0.00 O ATOM 347 CB THR A 27 8.839 5.237 10.488 1.00 0.00 C ATOM 348 OG1 THR A 27 8.864 4.486 11.693 1.00 0.00 O ATOM 349 CG2 THR A 27 7.980 4.509 9.448 1.00 0.00 C ATOM 0 H THR A 27 10.929 3.846 11.271 1.00 0.00 H new ATOM 0 HA THR A 27 10.292 5.632 8.902 1.00 0.00 H new ATOM 0 HB THR A 27 8.410 6.221 10.676 1.00 0.00 H new ATOM 0 HG1 THR A 27 8.375 4.971 12.391 1.00 0.00 H new ATOM 0 HG21 THR A 27 6.964 4.399 9.828 1.00 0.00 H new ATOM 0 HG22 THR A 27 7.961 5.086 8.524 1.00 0.00 H new ATOM 0 HG23 THR A 27 8.403 3.524 9.252 1.00 0.00 H new ATOM 357 N SER A 28 10.668 6.740 11.949 1.00 0.00 N ATOM 358 CA SER A 28 11.325 7.836 12.719 1.00 0.00 C ATOM 359 C SER A 28 11.424 9.104 11.866 1.00 0.00 C ATOM 360 O SER A 28 12.386 9.841 11.945 1.00 0.00 O ATOM 361 CB SER A 28 12.719 7.304 13.050 1.00 0.00 C ATOM 362 OG SER A 28 13.331 6.819 11.862 1.00 0.00 O ATOM 0 H SER A 28 9.989 6.189 12.474 1.00 0.00 H new ATOM 0 HA SER A 28 10.764 8.102 13.615 1.00 0.00 H new ATOM 0 HB2 SER A 28 13.327 8.094 13.490 1.00 0.00 H new ATOM 0 HB3 SER A 28 12.650 6.506 13.789 1.00 0.00 H new ATOM 0 HG SER A 28 13.010 7.337 11.094 1.00 0.00 H new ATOM 368 N THR A 29 10.437 9.363 11.054 1.00 0.00 N ATOM 369 CA THR A 29 10.475 10.584 10.199 1.00 0.00 C ATOM 370 C THR A 29 9.189 10.693 9.376 1.00 0.00 C ATOM 371 O THR A 29 8.722 11.774 9.076 1.00 0.00 O ATOM 372 CB THR A 29 11.683 10.389 9.280 1.00 0.00 C ATOM 373 OG1 THR A 29 11.966 11.607 8.607 1.00 0.00 O ATOM 374 CG2 THR A 29 11.375 9.296 8.255 1.00 0.00 C ATOM 0 H THR A 29 9.605 8.782 10.945 1.00 0.00 H new ATOM 0 HA THR A 29 10.555 11.497 10.788 1.00 0.00 H new ATOM 0 HB THR A 29 12.548 10.093 9.874 1.00 0.00 H new ATOM 0 HG1 THR A 29 12.740 11.484 8.019 1.00 0.00 H new ATOM 0 HG21 THR A 29 12.236 9.158 7.601 1.00 0.00 H new ATOM 0 HG22 THR A 29 11.159 8.362 8.773 1.00 0.00 H new ATOM 0 HG23 THR A 29 10.510 9.589 7.660 1.00 0.00 H new ATOM 382 N GLY A 30 8.615 9.581 9.008 1.00 0.00 N ATOM 383 CA GLY A 30 7.361 9.620 8.204 1.00 0.00 C ATOM 384 C GLY A 30 7.538 8.779 6.938 1.00 0.00 C ATOM 385 O GLY A 30 6.654 8.697 6.109 1.00 0.00 O ATOM 0 H GLY A 30 8.960 8.647 9.229 1.00 0.00 H new ATOM 0 HA2 GLY A 30 6.527 9.238 8.793 1.00 0.00 H new ATOM 0 HA3 GLY A 30 7.119 10.649 7.939 1.00 0.00 H new ATOM 389 N ALA A 31 8.673 8.153 6.781 1.00 0.00 N ATOM 390 CA ALA A 31 8.901 7.319 5.567 1.00 0.00 C ATOM 391 C ALA A 31 8.960 5.837 5.946 1.00 0.00 C ATOM 392 O ALA A 31 9.897 5.383 6.572 1.00 0.00 O ATOM 393 CB ALA A 31 10.248 7.784 5.012 1.00 0.00 C ATOM 0 H ALA A 31 9.451 8.183 7.440 1.00 0.00 H new ATOM 0 HA ALA A 31 8.100 7.428 4.836 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.487 7.215 4.114 1.00 0.00 H new ATOM 0 HB2 ALA A 31 10.194 8.844 4.766 1.00 0.00 H new ATOM 0 HB3 ALA A 31 11.024 7.624 5.760 1.00 0.00 H new ATOM 399 N LEU A 32 7.965 5.080 5.571 1.00 0.00 N ATOM 400 CA LEU A 32 7.965 3.627 5.909 1.00 0.00 C ATOM 401 C LEU A 32 9.064 2.908 5.124 1.00 0.00 C ATOM 402 O LEU A 32 8.923 2.633 3.950 1.00 0.00 O ATOM 403 CB LEU A 32 6.585 3.123 5.487 1.00 0.00 C ATOM 404 CG LEU A 32 6.426 1.661 5.905 1.00 0.00 C ATOM 405 CD1 LEU A 32 5.463 1.571 7.089 1.00 0.00 C ATOM 406 CD2 LEU A 32 5.866 0.853 4.732 1.00 0.00 C ATOM 0 H LEU A 32 7.153 5.404 5.046 1.00 0.00 H new ATOM 0 HA LEU A 32 8.157 3.445 6.966 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.807 3.731 5.949 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.466 3.219 4.408 1.00 0.00 H new ATOM 0 HG LEU A 32 7.397 1.259 6.194 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.349 0.529 7.387 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.860 2.147 7.925 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.492 1.973 6.800 1.00 0.00 H new ATOM 0 HD21 LEU A 32 5.752 -0.189 5.030 1.00 0.00 H new ATOM 0 HD22 LEU A 32 4.895 1.256 4.443 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.551 0.916 3.887 1.00 0.00 H new ATOM 418 N CYS A 33 10.160 2.607 5.764 1.00 0.00 N ATOM 419 CA CYS A 33 11.271 1.912 5.052 1.00 0.00 C ATOM 420 C CYS A 33 11.380 0.457 5.518 1.00 0.00 C ATOM 421 O CYS A 33 11.885 0.174 6.586 1.00 0.00 O ATOM 422 CB CYS A 33 12.530 2.692 5.430 1.00 0.00 C ATOM 423 SG CYS A 33 12.612 4.216 4.456 1.00 0.00 S ATOM 0 H CYS A 33 10.335 2.812 6.748 1.00 0.00 H new ATOM 0 HA CYS A 33 11.114 1.884 3.974 1.00 0.00 H new ATOM 0 HB2 CYS A 33 12.518 2.928 6.494 1.00 0.00 H new ATOM 0 HB3 CYS A 33 13.416 2.084 5.248 1.00 0.00 H new ATOM 428 N VAL A 34 10.917 -0.468 4.721 1.00 0.00 N ATOM 429 CA VAL A 34 11.002 -1.904 5.115 1.00 0.00 C ATOM 430 C VAL A 34 12.323 -2.498 4.623 1.00 0.00 C ATOM 431 O VAL A 34 12.921 -2.011 3.683 1.00 0.00 O ATOM 432 CB VAL A 34 9.813 -2.579 4.432 1.00 0.00 C ATOM 433 CG1 VAL A 34 8.513 -2.072 5.058 1.00 0.00 C ATOM 434 CG2 VAL A 34 9.824 -2.247 2.938 1.00 0.00 C ATOM 0 H VAL A 34 10.484 -0.292 3.815 1.00 0.00 H new ATOM 0 HA VAL A 34 10.972 -2.043 6.196 1.00 0.00 H new ATOM 0 HB VAL A 34 9.884 -3.659 4.563 1.00 0.00 H new ATOM 0 HG11 VAL A 34 7.664 -2.552 4.572 1.00 0.00 H new ATOM 0 HG12 VAL A 34 8.505 -2.310 6.122 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.443 -0.992 4.927 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.976 -2.729 2.452 1.00 0.00 H new ATOM 0 HG22 VAL A 34 9.753 -1.167 2.805 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.751 -2.608 2.492 1.00 0.00 H new ATOM 444 N ALA A 35 12.792 -3.538 5.259 1.00 0.00 N ATOM 445 CA ALA A 35 14.086 -4.148 4.837 1.00 0.00 C ATOM 446 C ALA A 35 13.862 -5.447 4.058 1.00 0.00 C ATOM 447 O ALA A 35 13.626 -6.493 4.631 1.00 0.00 O ATOM 448 CB ALA A 35 14.826 -4.435 6.143 1.00 0.00 C ATOM 0 H ALA A 35 12.336 -3.991 6.051 1.00 0.00 H new ATOM 0 HA ALA A 35 14.644 -3.487 4.174 1.00 0.00 H new ATOM 0 HB1 ALA A 35 15.793 -4.887 5.922 1.00 0.00 H new ATOM 0 HB2 ALA A 35 14.977 -3.503 6.688 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.236 -5.120 6.752 1.00 0.00 H new ATOM 454 N VAL A 36 13.958 -5.396 2.757 1.00 0.00 N ATOM 455 CA VAL A 36 13.776 -6.637 1.950 1.00 0.00 C ATOM 456 C VAL A 36 15.108 -7.395 1.892 1.00 0.00 C ATOM 457 O VAL A 36 16.112 -6.849 1.478 1.00 0.00 O ATOM 458 CB VAL A 36 13.358 -6.155 0.559 1.00 0.00 C ATOM 459 CG1 VAL A 36 13.215 -7.355 -0.378 1.00 0.00 C ATOM 460 CG2 VAL A 36 12.015 -5.425 0.655 1.00 0.00 C ATOM 0 H VAL A 36 14.154 -4.552 2.219 1.00 0.00 H new ATOM 0 HA VAL A 36 13.032 -7.314 2.371 1.00 0.00 H new ATOM 0 HB VAL A 36 14.117 -5.477 0.168 1.00 0.00 H new ATOM 0 HG11 VAL A 36 12.917 -7.010 -1.368 1.00 0.00 H new ATOM 0 HG12 VAL A 36 14.169 -7.878 -0.448 1.00 0.00 H new ATOM 0 HG13 VAL A 36 12.457 -8.034 0.013 1.00 0.00 H new ATOM 0 HG21 VAL A 36 11.716 -5.081 -0.335 1.00 0.00 H new ATOM 0 HG22 VAL A 36 11.258 -6.105 1.047 1.00 0.00 H new ATOM 0 HG23 VAL A 36 12.113 -4.569 1.322 1.00 0.00 H new ATOM 470 N PRO A 37 15.076 -8.626 2.329 1.00 0.00 N ATOM 471 CA PRO A 37 16.306 -9.464 2.351 1.00 0.00 C ATOM 472 C PRO A 37 16.780 -9.795 0.934 1.00 0.00 C ATOM 473 O PRO A 37 15.991 -9.947 0.022 1.00 0.00 O ATOM 474 CB PRO A 37 15.860 -10.728 3.085 1.00 0.00 C ATOM 475 CG PRO A 37 14.381 -10.783 2.879 1.00 0.00 C ATOM 476 CD PRO A 37 13.906 -9.356 2.833 1.00 0.00 C ATOM 0 HA PRO A 37 17.148 -8.964 2.830 1.00 0.00 H new ATOM 0 HB2 PRO A 37 16.349 -11.614 2.681 1.00 0.00 H new ATOM 0 HB3 PRO A 37 16.111 -10.680 4.145 1.00 0.00 H new ATOM 0 HG2 PRO A 37 14.137 -11.304 1.953 1.00 0.00 H new ATOM 0 HG3 PRO A 37 13.896 -11.328 3.689 1.00 0.00 H new ATOM 0 HD2 PRO A 37 13.045 -9.240 2.175 1.00 0.00 H new ATOM 0 HD3 PRO A 37 13.604 -9.001 3.818 1.00 0.00 H new ATOM 484 N ALA A 38 18.069 -9.915 0.745 1.00 0.00 N ATOM 485 CA ALA A 38 18.597 -10.244 -0.610 1.00 0.00 C ATOM 486 C ALA A 38 17.810 -11.409 -1.203 1.00 0.00 C ATOM 487 O ALA A 38 17.816 -12.507 -0.683 1.00 0.00 O ATOM 488 CB ALA A 38 20.056 -10.638 -0.391 1.00 0.00 C ATOM 0 H ALA A 38 18.777 -9.799 1.470 1.00 0.00 H new ATOM 0 HA ALA A 38 18.508 -9.408 -1.303 1.00 0.00 H new ATOM 0 HB1 ALA A 38 20.511 -10.894 -1.348 1.00 0.00 H new ATOM 0 HB2 ALA A 38 20.595 -9.803 0.055 1.00 0.00 H new ATOM 0 HB3 ALA A 38 20.104 -11.499 0.276 1.00 0.00 H new ATOM 494 N GLY A 39 17.125 -11.173 -2.282 1.00 0.00 N ATOM 495 CA GLY A 39 16.327 -12.260 -2.906 1.00 0.00 C ATOM 496 C GLY A 39 15.046 -12.462 -2.099 1.00 0.00 C ATOM 497 O GLY A 39 14.888 -13.443 -1.401 1.00 0.00 O ATOM 0 H GLY A 39 17.083 -10.273 -2.760 1.00 0.00 H new ATOM 0 HA2 GLY A 39 16.086 -12.005 -3.938 1.00 0.00 H new ATOM 0 HA3 GLY A 39 16.905 -13.184 -2.933 1.00 0.00 H new ATOM 501 N SER A 40 14.128 -11.538 -2.189 1.00 0.00 N ATOM 502 CA SER A 40 12.854 -11.675 -1.426 1.00 0.00 C ATOM 503 C SER A 40 11.860 -12.530 -2.223 1.00 0.00 C ATOM 504 O SER A 40 10.689 -12.225 -2.323 1.00 0.00 O ATOM 505 CB SER A 40 12.349 -10.241 -1.249 1.00 0.00 C ATOM 506 OG SER A 40 11.233 -10.013 -2.099 1.00 0.00 O ATOM 0 H SER A 40 14.205 -10.695 -2.758 1.00 0.00 H new ATOM 0 HA SER A 40 12.984 -12.171 -0.464 1.00 0.00 H new ATOM 0 HB2 SER A 40 12.067 -10.071 -0.210 1.00 0.00 H new ATOM 0 HB3 SER A 40 13.145 -9.534 -1.482 1.00 0.00 H new ATOM 0 HG SER A 40 11.317 -9.132 -2.519 1.00 0.00 H new ATOM 512 N ALA A 41 12.333 -13.609 -2.782 1.00 0.00 N ATOM 513 CA ALA A 41 11.447 -14.509 -3.576 1.00 0.00 C ATOM 514 C ALA A 41 10.804 -15.549 -2.662 1.00 0.00 C ATOM 515 O ALA A 41 10.386 -15.243 -1.568 1.00 0.00 O ATOM 516 CB ALA A 41 12.380 -15.180 -4.585 1.00 0.00 C ATOM 0 H ALA A 41 13.306 -13.910 -2.722 1.00 0.00 H new ATOM 0 HA ALA A 41 10.634 -13.972 -4.065 1.00 0.00 H new ATOM 0 HB1 ALA A 41 11.807 -15.862 -5.213 1.00 0.00 H new ATOM 0 HB2 ALA A 41 12.848 -14.419 -5.209 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.151 -15.737 -4.053 1.00 0.00 H new ATOM 522 N GLN A 42 10.709 -16.767 -3.111 1.00 0.00 N ATOM 523 CA GLN A 42 10.080 -17.837 -2.276 1.00 0.00 C ATOM 524 C GLN A 42 8.816 -17.308 -1.598 1.00 0.00 C ATOM 525 O GLN A 42 8.052 -16.582 -2.200 1.00 0.00 O ATOM 526 CB GLN A 42 11.152 -18.257 -1.256 1.00 0.00 C ATOM 527 CG GLN A 42 11.338 -17.190 -0.171 1.00 0.00 C ATOM 528 CD GLN A 42 12.502 -16.268 -0.547 1.00 0.00 C ATOM 529 OE1 GLN A 42 12.402 -15.063 -0.427 1.00 0.00 O ATOM 530 NE2 GLN A 42 13.613 -16.788 -0.995 1.00 0.00 N ATOM 0 H GLN A 42 11.041 -17.074 -4.025 1.00 0.00 H new ATOM 0 HA GLN A 42 9.764 -18.693 -2.872 1.00 0.00 H new ATOM 0 HB2 GLN A 42 10.867 -19.202 -0.794 1.00 0.00 H new ATOM 0 HB3 GLN A 42 12.099 -18.426 -1.769 1.00 0.00 H new ATOM 0 HG2 GLN A 42 10.423 -16.609 -0.059 1.00 0.00 H new ATOM 0 HG3 GLN A 42 11.534 -17.665 0.790 1.00 0.00 H new ATOM 0 HE21 GLN A 42 13.698 -17.799 -1.096 1.00 0.00 H new ATOM 0 HE22 GLN A 42 14.395 -16.183 -1.244 1.00 0.00 H new ATOM 539 N TYR A 43 8.586 -17.688 -0.367 1.00 0.00 N ATOM 540 CA TYR A 43 7.357 -17.230 0.366 1.00 0.00 C ATOM 541 C TYR A 43 6.897 -15.855 -0.140 1.00 0.00 C ATOM 542 O TYR A 43 5.720 -15.610 -0.310 1.00 0.00 O ATOM 543 CB TYR A 43 7.761 -17.182 1.844 1.00 0.00 C ATOM 544 CG TYR A 43 8.516 -15.910 2.142 1.00 0.00 C ATOM 545 CD1 TYR A 43 7.816 -14.728 2.402 1.00 0.00 C ATOM 546 CD2 TYR A 43 9.914 -15.917 2.171 1.00 0.00 C ATOM 547 CE1 TYR A 43 8.516 -13.549 2.690 1.00 0.00 C ATOM 548 CE2 TYR A 43 10.615 -14.740 2.457 1.00 0.00 C ATOM 549 CZ TYR A 43 9.916 -13.555 2.717 1.00 0.00 C ATOM 550 OH TYR A 43 10.606 -12.395 3.002 1.00 0.00 O ATOM 0 H TYR A 43 9.200 -18.301 0.170 1.00 0.00 H new ATOM 0 HA TYR A 43 6.513 -17.901 0.208 1.00 0.00 H new ATOM 0 HB2 TYR A 43 6.872 -17.241 2.473 1.00 0.00 H new ATOM 0 HB3 TYR A 43 8.381 -18.045 2.086 1.00 0.00 H new ATOM 0 HD1 TYR A 43 6.736 -14.724 2.381 1.00 0.00 H new ATOM 0 HD2 TYR A 43 10.453 -16.831 1.973 1.00 0.00 H new ATOM 0 HE1 TYR A 43 7.976 -12.636 2.891 1.00 0.00 H new ATOM 0 HE2 TYR A 43 11.695 -14.746 2.477 1.00 0.00 H new ATOM 0 HH TYR A 43 11.395 -12.333 2.423 1.00 0.00 H new ATOM 560 N GLY A 44 7.818 -14.971 -0.413 1.00 0.00 N ATOM 561 CA GLY A 44 7.433 -13.631 -0.946 1.00 0.00 C ATOM 562 C GLY A 44 7.199 -12.644 0.195 1.00 0.00 C ATOM 563 O GLY A 44 6.508 -12.933 1.151 1.00 0.00 O ATOM 0 H GLY A 44 8.820 -15.118 -0.290 1.00 0.00 H new ATOM 0 HA2 GLY A 44 8.218 -13.256 -1.603 1.00 0.00 H new ATOM 0 HA3 GLY A 44 6.529 -13.720 -1.548 1.00 0.00 H new ATOM 567 N VAL A 45 7.754 -11.468 0.089 1.00 0.00 N ATOM 568 CA VAL A 45 7.553 -10.450 1.158 1.00 0.00 C ATOM 569 C VAL A 45 6.312 -9.623 0.827 1.00 0.00 C ATOM 570 O VAL A 45 5.668 -9.846 -0.178 1.00 0.00 O ATOM 571 CB VAL A 45 8.816 -9.581 1.123 1.00 0.00 C ATOM 572 CG1 VAL A 45 8.972 -8.842 2.452 1.00 0.00 C ATOM 573 CG2 VAL A 45 10.047 -10.466 0.889 1.00 0.00 C ATOM 0 H VAL A 45 8.338 -11.168 -0.692 1.00 0.00 H new ATOM 0 HA VAL A 45 7.402 -10.888 2.145 1.00 0.00 H new ATOM 0 HB VAL A 45 8.727 -8.858 0.312 1.00 0.00 H new ATOM 0 HG11 VAL A 45 9.871 -8.226 2.422 1.00 0.00 H new ATOM 0 HG12 VAL A 45 8.102 -8.207 2.620 1.00 0.00 H new ATOM 0 HG13 VAL A 45 9.055 -9.565 3.263 1.00 0.00 H new ATOM 0 HG21 VAL A 45 10.942 -9.845 0.865 1.00 0.00 H new ATOM 0 HG22 VAL A 45 10.131 -11.193 1.697 1.00 0.00 H new ATOM 0 HG23 VAL A 45 9.943 -10.990 -0.061 1.00 0.00 H new ATOM 583 N GLY A 46 5.958 -8.678 1.652 1.00 0.00 N ATOM 584 CA GLY A 46 4.750 -7.866 1.344 1.00 0.00 C ATOM 585 C GLY A 46 4.420 -6.928 2.505 1.00 0.00 C ATOM 586 O GLY A 46 5.116 -6.873 3.499 1.00 0.00 O ATOM 0 H GLY A 46 6.445 -8.435 2.515 1.00 0.00 H new ATOM 0 HA2 GLY A 46 4.917 -7.285 0.437 1.00 0.00 H new ATOM 0 HA3 GLY A 46 3.903 -8.524 1.149 1.00 0.00 H new ATOM 590 N VAL A 47 3.349 -6.195 2.376 1.00 0.00 N ATOM 591 CA VAL A 47 2.933 -5.251 3.449 1.00 0.00 C ATOM 592 C VAL A 47 1.412 -5.105 3.413 1.00 0.00 C ATOM 593 O VAL A 47 0.826 -4.916 2.367 1.00 0.00 O ATOM 594 CB VAL A 47 3.613 -3.924 3.103 1.00 0.00 C ATOM 595 CG1 VAL A 47 3.416 -2.929 4.247 1.00 0.00 C ATOM 596 CG2 VAL A 47 5.109 -4.157 2.884 1.00 0.00 C ATOM 0 H VAL A 47 2.736 -6.211 1.561 1.00 0.00 H new ATOM 0 HA VAL A 47 3.212 -5.589 4.447 1.00 0.00 H new ATOM 0 HB VAL A 47 3.170 -3.520 2.193 1.00 0.00 H new ATOM 0 HG11 VAL A 47 3.902 -1.986 3.997 1.00 0.00 H new ATOM 0 HG12 VAL A 47 2.351 -2.759 4.402 1.00 0.00 H new ATOM 0 HG13 VAL A 47 3.855 -3.332 5.160 1.00 0.00 H new ATOM 0 HG21 VAL A 47 5.592 -3.212 2.638 1.00 0.00 H new ATOM 0 HG22 VAL A 47 5.551 -4.564 3.793 1.00 0.00 H new ATOM 0 HG23 VAL A 47 5.251 -4.862 2.065 1.00 0.00 H new ATOM 606 N VAL A 48 0.763 -5.201 4.536 1.00 0.00 N ATOM 607 CA VAL A 48 -0.725 -5.077 4.534 1.00 0.00 C ATOM 608 C VAL A 48 -1.170 -3.897 5.399 1.00 0.00 C ATOM 609 O VAL A 48 -0.734 -3.737 6.522 1.00 0.00 O ATOM 610 CB VAL A 48 -1.238 -6.396 5.114 1.00 0.00 C ATOM 611 CG1 VAL A 48 -0.885 -7.543 4.166 1.00 0.00 C ATOM 612 CG2 VAL A 48 -0.587 -6.644 6.475 1.00 0.00 C ATOM 0 H VAL A 48 1.190 -5.358 5.449 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.116 -4.893 3.533 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.320 -6.342 5.233 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.251 -8.483 4.580 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.349 -7.369 3.195 1.00 0.00 H new ATOM 0 HG13 VAL A 48 0.197 -7.596 4.046 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.953 -7.584 6.888 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.495 -6.697 6.356 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.838 -5.828 7.153 1.00 0.00 H new ATOM 622 N LEU A 49 -2.037 -3.070 4.881 1.00 0.00 N ATOM 623 CA LEU A 49 -2.513 -1.899 5.672 1.00 0.00 C ATOM 624 C LEU A 49 -4.040 -1.914 5.779 1.00 0.00 C ATOM 625 O LEU A 49 -4.735 -1.369 4.945 1.00 0.00 O ATOM 626 CB LEU A 49 -2.047 -0.672 4.889 1.00 0.00 C ATOM 627 CG LEU A 49 -2.709 0.580 5.466 1.00 0.00 C ATOM 628 CD1 LEU A 49 -2.138 0.863 6.856 1.00 0.00 C ATOM 629 CD2 LEU A 49 -2.431 1.773 4.550 1.00 0.00 C ATOM 0 H LEU A 49 -2.436 -3.154 3.946 1.00 0.00 H new ATOM 0 HA LEU A 49 -2.122 -1.907 6.690 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.962 -0.582 4.945 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.304 -0.780 3.835 1.00 0.00 H new ATOM 0 HG LEU A 49 -3.785 0.421 5.539 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.609 1.755 7.268 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -2.335 0.014 7.510 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.062 1.022 6.782 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.903 2.665 4.961 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.355 1.932 4.477 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.837 1.573 3.558 1.00 0.00 H new ATOM 641 N ASN A 50 -4.567 -2.533 6.801 1.00 0.00 N ATOM 642 CA ASN A 50 -6.049 -2.580 6.962 1.00 0.00 C ATOM 643 C ASN A 50 -6.572 -1.226 7.445 1.00 0.00 C ATOM 644 O ASN A 50 -5.921 -0.531 8.199 1.00 0.00 O ATOM 645 CB ASN A 50 -6.299 -3.660 8.016 1.00 0.00 C ATOM 646 CG ASN A 50 -5.441 -3.378 9.250 1.00 0.00 C ATOM 647 OD1 ASN A 50 -5.381 -2.259 9.720 1.00 0.00 O ATOM 648 ND2 ASN A 50 -4.768 -4.353 9.799 1.00 0.00 N ATOM 0 H ASN A 50 -4.036 -3.008 7.531 1.00 0.00 H new ATOM 0 HA ASN A 50 -6.560 -2.800 6.024 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -7.354 -3.678 8.290 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -6.058 -4.642 7.609 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -4.192 -4.175 10.622 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -4.818 -5.292 9.405 1.00 0.00 H new ATOM 655 N GLY A 51 -7.746 -0.845 7.017 1.00 0.00 N ATOM 656 CA GLY A 51 -8.307 0.465 7.455 1.00 0.00 C ATOM 657 C GLY A 51 -8.605 1.333 6.231 1.00 0.00 C ATOM 658 O GLY A 51 -8.024 2.384 6.048 1.00 0.00 O ATOM 0 H GLY A 51 -8.339 -1.383 6.385 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -9.219 0.307 8.031 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.600 0.974 8.110 1.00 0.00 H new ATOM 662 N VAL A 52 -9.509 0.904 5.392 1.00 0.00 N ATOM 663 CA VAL A 52 -9.846 1.709 4.182 1.00 0.00 C ATOM 664 C VAL A 52 -11.339 2.052 4.181 1.00 0.00 C ATOM 665 O VAL A 52 -12.096 1.565 4.997 1.00 0.00 O ATOM 666 CB VAL A 52 -9.497 0.808 2.997 1.00 0.00 C ATOM 667 CG1 VAL A 52 -10.050 1.419 1.710 1.00 0.00 C ATOM 668 CG2 VAL A 52 -7.976 0.682 2.886 1.00 0.00 C ATOM 0 H VAL A 52 -10.028 0.032 5.492 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.303 2.653 4.145 1.00 0.00 H new ATOM 0 HB VAL A 52 -9.936 -0.178 3.149 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -9.801 0.776 0.866 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -11.133 1.512 1.788 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -9.611 2.405 1.557 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.725 0.040 2.042 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.539 1.669 2.734 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -7.579 0.247 3.803 1.00 0.00 H new ATOM 678 N ALA A 53 -11.771 2.889 3.276 1.00 0.00 N ATOM 679 CA ALA A 53 -13.216 3.258 3.239 1.00 0.00 C ATOM 680 C ALA A 53 -13.707 3.390 1.794 1.00 0.00 C ATOM 681 O ALA A 53 -13.867 4.480 1.280 1.00 0.00 O ATOM 682 CB ALA A 53 -13.297 4.606 3.956 1.00 0.00 C ATOM 0 H ALA A 53 -11.189 3.331 2.564 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.842 2.501 3.712 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.332 4.948 3.972 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.935 4.497 4.978 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -12.682 5.336 3.430 1.00 0.00 H new ATOM 688 N ILE A 54 -13.959 2.290 1.138 1.00 0.00 N ATOM 689 CA ILE A 54 -14.454 2.355 -0.268 1.00 0.00 C ATOM 690 C ILE A 54 -15.900 1.853 -0.328 1.00 0.00 C ATOM 691 O ILE A 54 -16.356 1.150 0.552 1.00 0.00 O ATOM 692 CB ILE A 54 -13.528 1.435 -1.065 1.00 0.00 C ATOM 693 CG1 ILE A 54 -12.093 1.962 -0.985 1.00 0.00 C ATOM 694 CG2 ILE A 54 -13.976 1.403 -2.527 1.00 0.00 C ATOM 695 CD1 ILE A 54 -12.061 3.427 -1.420 1.00 0.00 C ATOM 0 H ILE A 54 -13.844 1.349 1.514 1.00 0.00 H new ATOM 0 HA ILE A 54 -14.447 3.370 -0.666 1.00 0.00 H new ATOM 0 HB ILE A 54 -13.570 0.429 -0.649 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -11.716 1.866 0.033 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -11.440 1.368 -1.624 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -13.316 0.747 -3.095 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -14.998 1.029 -2.586 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -13.933 2.410 -2.943 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -11.039 3.801 -1.363 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -12.421 3.510 -2.446 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -12.700 4.016 -0.762 1.00 0.00 H new ATOM 707 N GLU A 55 -16.629 2.209 -1.351 1.00 0.00 N ATOM 708 CA GLU A 55 -18.045 1.748 -1.443 1.00 0.00 C ATOM 709 C GLU A 55 -18.503 1.685 -2.901 1.00 0.00 C ATOM 710 O GLU A 55 -18.313 2.611 -3.665 1.00 0.00 O ATOM 711 CB GLU A 55 -18.850 2.796 -0.675 1.00 0.00 C ATOM 712 CG GLU A 55 -20.210 2.212 -0.286 1.00 0.00 C ATOM 713 CD GLU A 55 -20.394 2.312 1.229 1.00 0.00 C ATOM 714 OE1 GLU A 55 -19.654 1.653 1.940 1.00 0.00 O ATOM 715 OE2 GLU A 55 -21.272 3.046 1.652 1.00 0.00 O ATOM 0 H GLU A 55 -16.309 2.795 -2.122 1.00 0.00 H new ATOM 0 HA GLU A 55 -18.174 0.746 -1.034 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -18.306 3.105 0.218 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -18.987 3.686 -1.289 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -21.008 2.751 -0.796 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -20.275 1.171 -0.603 1.00 0.00 H new ATOM 722 N GLU A 56 -19.117 0.596 -3.282 1.00 0.00 N ATOM 723 CA GLU A 56 -19.610 0.449 -4.683 1.00 0.00 C ATOM 724 C GLU A 56 -18.629 1.074 -5.678 1.00 0.00 C ATOM 725 O GLU A 56 -17.451 1.197 -5.410 1.00 0.00 O ATOM 726 CB GLU A 56 -20.947 1.186 -4.704 1.00 0.00 C ATOM 727 CG GLU A 56 -20.701 2.690 -4.616 1.00 0.00 C ATOM 728 CD GLU A 56 -21.994 3.441 -4.940 1.00 0.00 C ATOM 729 OE1 GLU A 56 -23.049 2.839 -4.829 1.00 0.00 O ATOM 730 OE2 GLU A 56 -21.907 4.606 -5.293 1.00 0.00 O ATOM 0 H GLU A 56 -19.300 -0.205 -2.677 1.00 0.00 H new ATOM 0 HA GLU A 56 -19.711 -0.597 -4.974 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -21.491 0.949 -5.618 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -21.568 0.859 -3.870 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -20.356 2.954 -3.617 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -19.915 2.982 -5.312 1.00 0.00 H new ATOM 737 N GLY A 57 -19.108 1.463 -6.829 1.00 0.00 N ATOM 738 CA GLY A 57 -18.208 2.075 -7.846 1.00 0.00 C ATOM 739 C GLY A 57 -18.080 3.577 -7.587 1.00 0.00 C ATOM 740 O GLY A 57 -18.730 4.384 -8.222 1.00 0.00 O ATOM 0 H GLY A 57 -20.086 1.383 -7.108 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -17.226 1.605 -7.806 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -18.604 1.902 -8.847 1.00 0.00 H new ATOM 744 N THR A 58 -17.243 3.959 -6.663 1.00 0.00 N ATOM 745 CA THR A 58 -17.069 5.410 -6.367 1.00 0.00 C ATOM 746 C THR A 58 -15.731 5.898 -6.937 1.00 0.00 C ATOM 747 O THR A 58 -14.938 5.122 -7.434 1.00 0.00 O ATOM 748 CB THR A 58 -17.095 5.502 -4.835 1.00 0.00 C ATOM 749 OG1 THR A 58 -18.442 5.595 -4.396 1.00 0.00 O ATOM 750 CG2 THR A 58 -16.321 6.738 -4.363 1.00 0.00 C ATOM 0 H THR A 58 -16.671 3.330 -6.099 1.00 0.00 H new ATOM 0 HA THR A 58 -17.843 6.033 -6.815 1.00 0.00 H new ATOM 0 HB THR A 58 -16.627 4.611 -4.417 1.00 0.00 H new ATOM 0 HG1 THR A 58 -18.735 4.725 -4.053 1.00 0.00 H new ATOM 0 HG21 THR A 58 -16.348 6.790 -3.275 1.00 0.00 H new ATOM 0 HG22 THR A 58 -15.286 6.669 -4.698 1.00 0.00 H new ATOM 0 HG23 THR A 58 -16.778 7.635 -4.781 1.00 0.00 H new ATOM 758 N THR A 59 -15.475 7.176 -6.873 1.00 0.00 N ATOM 759 CA THR A 59 -14.192 7.708 -7.417 1.00 0.00 C ATOM 760 C THR A 59 -13.110 7.703 -6.334 1.00 0.00 C ATOM 761 O THR A 59 -13.398 7.753 -5.154 1.00 0.00 O ATOM 762 CB THR A 59 -14.509 9.140 -7.849 1.00 0.00 C ATOM 763 OG1 THR A 59 -15.870 9.221 -8.251 1.00 0.00 O ATOM 764 CG2 THR A 59 -13.605 9.535 -9.018 1.00 0.00 C ATOM 0 H THR A 59 -16.098 7.875 -6.468 1.00 0.00 H new ATOM 0 HA THR A 59 -13.815 7.105 -8.243 1.00 0.00 H new ATOM 0 HB THR A 59 -14.335 9.819 -7.014 1.00 0.00 H new ATOM 0 HG1 THR A 59 -16.076 10.139 -8.527 1.00 0.00 H new ATOM 0 HG21 THR A 59 -13.832 10.556 -9.325 1.00 0.00 H new ATOM 0 HG22 THR A 59 -12.562 9.473 -8.708 1.00 0.00 H new ATOM 0 HG23 THR A 59 -13.776 8.858 -9.855 1.00 0.00 H new ATOM 772 N TYR A 60 -11.867 7.645 -6.727 1.00 0.00 N ATOM 773 CA TYR A 60 -10.766 7.639 -5.721 1.00 0.00 C ATOM 774 C TYR A 60 -9.449 8.064 -6.373 1.00 0.00 C ATOM 775 O TYR A 60 -9.384 8.320 -7.559 1.00 0.00 O ATOM 776 CB TYR A 60 -10.674 6.192 -5.239 1.00 0.00 C ATOM 777 CG TYR A 60 -11.818 5.897 -4.301 1.00 0.00 C ATOM 778 CD1 TYR A 60 -11.776 6.354 -2.979 1.00 0.00 C ATOM 779 CD2 TYR A 60 -12.920 5.166 -4.753 1.00 0.00 C ATOM 780 CE1 TYR A 60 -12.838 6.078 -2.110 1.00 0.00 C ATOM 781 CE2 TYR A 60 -13.982 4.890 -3.887 1.00 0.00 C ATOM 782 CZ TYR A 60 -13.941 5.346 -2.564 1.00 0.00 C ATOM 783 OH TYR A 60 -14.989 5.075 -1.708 1.00 0.00 O ATOM 0 H TYR A 60 -11.566 7.602 -7.701 1.00 0.00 H new ATOM 0 HA TYR A 60 -10.957 8.333 -4.902 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -10.704 5.512 -6.090 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -9.723 6.027 -4.732 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -10.925 6.919 -2.629 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -12.951 4.814 -5.773 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -12.806 6.430 -1.089 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -14.833 4.326 -4.238 1.00 0.00 H new ATOM 0 HH TYR A 60 -15.766 4.777 -2.226 1.00 0.00 H new ATOM 793 N THR A 61 -8.397 8.135 -5.605 1.00 0.00 N ATOM 794 CA THR A 61 -7.081 8.538 -6.175 1.00 0.00 C ATOM 795 C THR A 61 -5.947 7.875 -5.389 1.00 0.00 C ATOM 796 O THR A 61 -5.843 8.024 -4.188 1.00 0.00 O ATOM 797 CB THR A 61 -7.028 10.058 -6.019 1.00 0.00 C ATOM 798 OG1 THR A 61 -7.999 10.654 -6.867 1.00 0.00 O ATOM 799 CG2 THR A 61 -5.635 10.564 -6.399 1.00 0.00 C ATOM 0 H THR A 61 -8.392 7.931 -4.606 1.00 0.00 H new ATOM 0 HA THR A 61 -6.968 8.235 -7.216 1.00 0.00 H new ATOM 0 HB THR A 61 -7.238 10.325 -4.983 1.00 0.00 H new ATOM 0 HG1 THR A 61 -7.967 11.628 -6.767 1.00 0.00 H new ATOM 0 HG21 THR A 61 -5.599 11.648 -6.287 1.00 0.00 H new ATOM 0 HG22 THR A 61 -4.891 10.107 -5.746 1.00 0.00 H new ATOM 0 HG23 THR A 61 -5.421 10.299 -7.434 1.00 0.00 H new ATOM 807 N LEU A 62 -5.097 7.143 -6.055 1.00 0.00 N ATOM 808 CA LEU A 62 -3.975 6.474 -5.339 1.00 0.00 C ATOM 809 C LEU A 62 -2.758 7.399 -5.290 1.00 0.00 C ATOM 810 O LEU A 62 -2.216 7.785 -6.307 1.00 0.00 O ATOM 811 CB LEU A 62 -3.664 5.224 -6.161 1.00 0.00 C ATOM 812 CG LEU A 62 -2.404 4.556 -5.611 1.00 0.00 C ATOM 813 CD1 LEU A 62 -2.765 3.712 -4.388 1.00 0.00 C ATOM 814 CD2 LEU A 62 -1.793 3.657 -6.688 1.00 0.00 C ATOM 0 H LEU A 62 -5.131 6.980 -7.061 1.00 0.00 H new ATOM 0 HA LEU A 62 -4.232 6.228 -4.309 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.504 4.530 -6.121 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.520 5.490 -7.208 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.683 5.322 -5.323 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.866 3.236 -3.996 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.201 4.351 -3.620 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.486 2.946 -4.674 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.894 3.180 -6.297 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -2.514 2.892 -6.975 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.535 4.258 -7.560 1.00 0.00 H new ATOM 826 N ARG A 63 -2.328 7.761 -4.114 1.00 0.00 N ATOM 827 CA ARG A 63 -1.149 8.666 -3.997 1.00 0.00 C ATOM 828 C ARG A 63 -0.110 8.061 -3.049 1.00 0.00 C ATOM 829 O ARG A 63 -0.348 7.917 -1.870 1.00 0.00 O ATOM 830 CB ARG A 63 -1.716 9.967 -3.421 1.00 0.00 C ATOM 831 CG ARG A 63 -0.587 10.804 -2.815 1.00 0.00 C ATOM 832 CD ARG A 63 0.347 11.283 -3.928 1.00 0.00 C ATOM 833 NE ARG A 63 0.837 12.613 -3.472 1.00 0.00 N ATOM 834 CZ ARG A 63 0.969 13.588 -4.329 1.00 0.00 C ATOM 835 NH1 ARG A 63 -0.065 14.004 -5.008 1.00 0.00 N ATOM 836 NH2 ARG A 63 2.135 14.147 -4.508 1.00 0.00 N ATOM 0 H ARG A 63 -2.741 7.470 -3.228 1.00 0.00 H new ATOM 0 HA ARG A 63 -0.647 8.825 -4.951 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -2.220 10.533 -4.205 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -2.463 9.743 -2.660 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -1.001 11.659 -2.280 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -0.031 10.212 -2.088 1.00 0.00 H new ATOM 0 HD2 ARG A 63 1.173 10.588 -4.077 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -0.180 11.361 -4.879 1.00 0.00 H new ATOM 0 HE ARG A 63 1.069 12.762 -2.490 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -0.976 13.567 -4.869 1.00 0.00 H new ATOM 0 HH12 ARG A 63 0.038 14.766 -5.678 1.00 0.00 H new ATOM 0 HH21 ARG A 63 2.943 13.822 -3.978 1.00 0.00 H new ATOM 0 HH22 ARG A 63 2.238 14.909 -5.178 1.00 0.00 H new ATOM 850 N TYR A 64 1.042 7.711 -3.553 1.00 0.00 N ATOM 851 CA TYR A 64 2.093 7.125 -2.671 1.00 0.00 C ATOM 852 C TYR A 64 3.476 7.302 -3.312 1.00 0.00 C ATOM 853 O TYR A 64 3.636 7.178 -4.510 1.00 0.00 O ATOM 854 CB TYR A 64 1.713 5.640 -2.523 1.00 0.00 C ATOM 855 CG TYR A 64 2.396 4.801 -3.583 1.00 0.00 C ATOM 856 CD1 TYR A 64 3.763 4.511 -3.478 1.00 0.00 C ATOM 857 CD2 TYR A 64 1.660 4.314 -4.669 1.00 0.00 C ATOM 858 CE1 TYR A 64 4.391 3.735 -4.460 1.00 0.00 C ATOM 859 CE2 TYR A 64 2.288 3.538 -5.650 1.00 0.00 C ATOM 860 CZ TYR A 64 3.653 3.248 -5.546 1.00 0.00 C ATOM 861 OH TYR A 64 4.272 2.483 -6.513 1.00 0.00 O ATOM 0 H TYR A 64 1.301 7.805 -4.535 1.00 0.00 H new ATOM 0 HA TYR A 64 2.146 7.612 -1.697 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.997 5.284 -1.533 1.00 0.00 H new ATOM 0 HB3 TYR A 64 0.632 5.527 -2.604 1.00 0.00 H new ATOM 0 HD1 TYR A 64 4.332 4.886 -2.640 1.00 0.00 H new ATOM 0 HD2 TYR A 64 0.606 4.537 -4.750 1.00 0.00 H new ATOM 0 HE1 TYR A 64 5.445 3.512 -4.380 1.00 0.00 H new ATOM 0 HE2 TYR A 64 1.719 3.163 -6.488 1.00 0.00 H new ATOM 0 HH TYR A 64 5.220 2.377 -6.289 1.00 0.00 H new ATOM 871 N THR A 65 4.473 7.595 -2.523 1.00 0.00 N ATOM 872 CA THR A 65 5.840 7.783 -3.087 1.00 0.00 C ATOM 873 C THR A 65 6.801 6.761 -2.479 1.00 0.00 C ATOM 874 O THR A 65 7.296 6.934 -1.383 1.00 0.00 O ATOM 875 CB THR A 65 6.242 9.203 -2.685 1.00 0.00 C ATOM 876 OG1 THR A 65 5.192 10.102 -3.015 1.00 0.00 O ATOM 877 CG2 THR A 65 7.516 9.606 -3.429 1.00 0.00 C ATOM 0 H THR A 65 4.400 7.712 -1.512 1.00 0.00 H new ATOM 0 HA THR A 65 5.867 7.644 -4.168 1.00 0.00 H new ATOM 0 HB THR A 65 6.426 9.238 -1.611 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.427 11.004 -2.713 1.00 0.00 H new ATOM 0 HG21 THR A 65 7.801 10.618 -3.141 1.00 0.00 H new ATOM 0 HG22 THR A 65 8.320 8.916 -3.173 1.00 0.00 H new ATOM 0 HG23 THR A 65 7.336 9.571 -4.504 1.00 0.00 H new ATOM 885 N ALA A 66 7.065 5.694 -3.182 1.00 0.00 N ATOM 886 CA ALA A 66 7.988 4.656 -2.643 1.00 0.00 C ATOM 887 C ALA A 66 9.358 4.759 -3.318 1.00 0.00 C ATOM 888 O ALA A 66 9.475 5.202 -4.444 1.00 0.00 O ATOM 889 CB ALA A 66 7.319 3.324 -2.983 1.00 0.00 C ATOM 0 H ALA A 66 6.681 5.496 -4.106 1.00 0.00 H new ATOM 0 HA ALA A 66 8.157 4.768 -1.572 1.00 0.00 H new ATOM 0 HB1 ALA A 66 7.937 2.503 -2.619 1.00 0.00 H new ATOM 0 HB2 ALA A 66 6.339 3.278 -2.509 1.00 0.00 H new ATOM 0 HB3 ALA A 66 7.204 3.240 -4.064 1.00 0.00 H new ATOM 895 N THR A 67 10.396 4.354 -2.639 1.00 0.00 N ATOM 896 CA THR A 67 11.757 4.427 -3.242 1.00 0.00 C ATOM 897 C THR A 67 12.646 3.314 -2.682 1.00 0.00 C ATOM 898 O THR A 67 13.057 3.352 -1.539 1.00 0.00 O ATOM 899 CB THR A 67 12.299 5.799 -2.838 1.00 0.00 C ATOM 900 OG1 THR A 67 11.456 6.813 -3.367 1.00 0.00 O ATOM 901 CG2 THR A 67 13.716 5.972 -3.386 1.00 0.00 C ATOM 0 H THR A 67 10.361 3.976 -1.692 1.00 0.00 H new ATOM 0 HA THR A 67 11.734 4.301 -4.324 1.00 0.00 H new ATOM 0 HB THR A 67 12.322 5.876 -1.751 1.00 0.00 H new ATOM 0 HG1 THR A 67 11.472 7.594 -2.775 1.00 0.00 H new ATOM 0 HG21 THR A 67 14.101 6.950 -3.097 1.00 0.00 H new ATOM 0 HG22 THR A 67 14.361 5.194 -2.979 1.00 0.00 H new ATOM 0 HG23 THR A 67 13.697 5.896 -4.473 1.00 0.00 H new ATOM 909 N ALA A 68 12.949 2.326 -3.477 1.00 0.00 N ATOM 910 CA ALA A 68 13.815 1.215 -2.987 1.00 0.00 C ATOM 911 C ALA A 68 15.278 1.507 -3.321 1.00 0.00 C ATOM 912 O ALA A 68 15.601 1.927 -4.415 1.00 0.00 O ATOM 913 CB ALA A 68 13.336 -0.030 -3.738 1.00 0.00 C ATOM 0 H ALA A 68 12.635 2.239 -4.444 1.00 0.00 H new ATOM 0 HA ALA A 68 13.749 1.087 -1.907 1.00 0.00 H new ATOM 0 HB1 ALA A 68 13.928 -0.891 -3.429 1.00 0.00 H new ATOM 0 HB2 ALA A 68 12.286 -0.211 -3.510 1.00 0.00 H new ATOM 0 HB3 ALA A 68 13.453 0.125 -4.811 1.00 0.00 H new ATOM 919 N SER A 69 16.170 1.283 -2.395 1.00 0.00 N ATOM 920 CA SER A 69 17.609 1.544 -2.679 1.00 0.00 C ATOM 921 C SER A 69 17.964 0.980 -4.055 1.00 0.00 C ATOM 922 O SER A 69 18.874 1.442 -4.715 1.00 0.00 O ATOM 923 CB SER A 69 18.373 0.806 -1.580 1.00 0.00 C ATOM 924 OG SER A 69 19.746 0.720 -1.939 1.00 0.00 O ATOM 0 H SER A 69 15.966 0.932 -1.459 1.00 0.00 H new ATOM 0 HA SER A 69 17.851 2.607 -2.689 1.00 0.00 H new ATOM 0 HB2 SER A 69 18.266 1.331 -0.631 1.00 0.00 H new ATOM 0 HB3 SER A 69 17.958 -0.192 -1.441 1.00 0.00 H new ATOM 0 HG SER A 69 20.239 0.249 -1.235 1.00 0.00 H new ATOM 930 N THR A 70 17.242 -0.015 -4.491 1.00 0.00 N ATOM 931 CA THR A 70 17.517 -0.618 -5.823 1.00 0.00 C ATOM 932 C THR A 70 16.339 -0.350 -6.768 1.00 0.00 C ATOM 933 O THR A 70 15.361 0.266 -6.395 1.00 0.00 O ATOM 934 CB THR A 70 17.662 -2.119 -5.546 1.00 0.00 C ATOM 935 OG1 THR A 70 18.375 -2.728 -6.613 1.00 0.00 O ATOM 936 CG2 THR A 70 16.277 -2.762 -5.422 1.00 0.00 C ATOM 0 H THR A 70 16.469 -0.438 -3.978 1.00 0.00 H new ATOM 0 HA THR A 70 18.406 -0.205 -6.299 1.00 0.00 H new ATOM 0 HB THR A 70 18.207 -2.262 -4.613 1.00 0.00 H new ATOM 0 HG1 THR A 70 18.470 -3.687 -6.437 1.00 0.00 H new ATOM 0 HG21 THR A 70 16.387 -3.828 -5.225 1.00 0.00 H new ATOM 0 HG22 THR A 70 15.732 -2.296 -4.601 1.00 0.00 H new ATOM 0 HG23 THR A 70 15.725 -2.620 -6.351 1.00 0.00 H new ATOM 944 N ASP A 71 16.418 -0.820 -7.982 1.00 0.00 N ATOM 945 CA ASP A 71 15.294 -0.603 -8.937 1.00 0.00 C ATOM 946 C ASP A 71 14.356 -1.812 -8.907 1.00 0.00 C ATOM 947 O ASP A 71 14.286 -2.580 -9.846 1.00 0.00 O ATOM 948 CB ASP A 71 15.958 -0.469 -10.309 1.00 0.00 C ATOM 949 CG ASP A 71 14.887 -0.221 -11.372 1.00 0.00 C ATOM 950 OD1 ASP A 71 13.826 0.263 -11.015 1.00 0.00 O ATOM 951 OD2 ASP A 71 15.147 -0.518 -12.527 1.00 0.00 O ATOM 0 H ASP A 71 17.210 -1.344 -8.354 1.00 0.00 H new ATOM 0 HA ASP A 71 14.698 0.276 -8.692 1.00 0.00 H new ATOM 0 HB2 ASP A 71 16.674 0.353 -10.300 1.00 0.00 H new ATOM 0 HB3 ASP A 71 16.516 -1.375 -10.545 1.00 0.00 H new ATOM 956 N VAL A 72 13.644 -1.995 -7.827 1.00 0.00 N ATOM 957 CA VAL A 72 12.723 -3.165 -7.731 1.00 0.00 C ATOM 958 C VAL A 72 11.317 -2.798 -8.209 1.00 0.00 C ATOM 959 O VAL A 72 10.857 -1.687 -8.038 1.00 0.00 O ATOM 960 CB VAL A 72 12.700 -3.535 -6.244 1.00 0.00 C ATOM 961 CG1 VAL A 72 11.819 -2.546 -5.476 1.00 0.00 C ATOM 962 CG2 VAL A 72 12.129 -4.944 -6.081 1.00 0.00 C ATOM 0 H VAL A 72 13.660 -1.386 -7.009 1.00 0.00 H new ATOM 0 HA VAL A 72 13.058 -3.992 -8.358 1.00 0.00 H new ATOM 0 HB VAL A 72 13.716 -3.498 -5.850 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.807 -2.814 -4.420 1.00 0.00 H new ATOM 0 HG12 VAL A 72 12.219 -1.538 -5.590 1.00 0.00 H new ATOM 0 HG13 VAL A 72 10.804 -2.580 -5.871 1.00 0.00 H new ATOM 0 HG21 VAL A 72 12.112 -5.210 -5.024 1.00 0.00 H new ATOM 0 HG22 VAL A 72 11.115 -4.974 -6.479 1.00 0.00 H new ATOM 0 HG23 VAL A 72 12.753 -5.654 -6.623 1.00 0.00 H new ATOM 972 N THR A 73 10.629 -3.739 -8.792 1.00 0.00 N ATOM 973 CA THR A 73 9.243 -3.474 -9.270 1.00 0.00 C ATOM 974 C THR A 73 8.313 -4.559 -8.724 1.00 0.00 C ATOM 975 O THR A 73 8.115 -5.587 -9.340 1.00 0.00 O ATOM 976 CB THR A 73 9.323 -3.546 -10.796 1.00 0.00 C ATOM 977 OG1 THR A 73 9.913 -2.354 -11.294 1.00 0.00 O ATOM 978 CG2 THR A 73 7.916 -3.703 -11.375 1.00 0.00 C ATOM 0 H THR A 73 10.969 -4.686 -8.959 1.00 0.00 H new ATOM 0 HA THR A 73 8.856 -2.510 -8.940 1.00 0.00 H new ATOM 0 HB THR A 73 9.931 -4.402 -11.089 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.967 -2.399 -12.271 1.00 0.00 H new ATOM 0 HG21 THR A 73 7.974 -3.754 -12.462 1.00 0.00 H new ATOM 0 HG22 THR A 73 7.465 -4.618 -10.992 1.00 0.00 H new ATOM 0 HG23 THR A 73 7.305 -2.848 -11.084 1.00 0.00 H new ATOM 986 N VAL A 74 7.754 -4.347 -7.564 1.00 0.00 N ATOM 987 CA VAL A 74 6.855 -5.380 -6.977 1.00 0.00 C ATOM 988 C VAL A 74 5.411 -5.150 -7.425 1.00 0.00 C ATOM 989 O VAL A 74 5.161 -4.637 -8.497 1.00 0.00 O ATOM 990 CB VAL A 74 6.997 -5.210 -5.463 1.00 0.00 C ATOM 991 CG1 VAL A 74 8.481 -5.233 -5.084 1.00 0.00 C ATOM 992 CG2 VAL A 74 6.386 -3.874 -5.040 1.00 0.00 C ATOM 0 H VAL A 74 7.880 -3.507 -7.000 1.00 0.00 H new ATOM 0 HA VAL A 74 7.117 -6.389 -7.297 1.00 0.00 H new ATOM 0 HB VAL A 74 6.478 -6.024 -4.956 1.00 0.00 H new ATOM 0 HG11 VAL A 74 8.583 -5.112 -4.006 1.00 0.00 H new ATOM 0 HG12 VAL A 74 8.919 -6.185 -5.385 1.00 0.00 H new ATOM 0 HG13 VAL A 74 8.999 -4.419 -5.591 1.00 0.00 H new ATOM 0 HG21 VAL A 74 6.487 -3.753 -3.961 1.00 0.00 H new ATOM 0 HG22 VAL A 74 6.904 -3.060 -5.547 1.00 0.00 H new ATOM 0 HG23 VAL A 74 5.330 -3.855 -5.310 1.00 0.00 H new ATOM 1002 N ARG A 75 4.458 -5.539 -6.623 1.00 0.00 N ATOM 1003 CA ARG A 75 3.032 -5.352 -7.020 1.00 0.00 C ATOM 1004 C ARG A 75 2.251 -4.635 -5.916 1.00 0.00 C ATOM 1005 O ARG A 75 2.394 -4.929 -4.745 1.00 0.00 O ATOM 1006 CB ARG A 75 2.490 -6.767 -7.221 1.00 0.00 C ATOM 1007 CG ARG A 75 2.693 -7.193 -8.675 1.00 0.00 C ATOM 1008 CD ARG A 75 1.621 -8.215 -9.057 1.00 0.00 C ATOM 1009 NE ARG A 75 1.808 -9.343 -8.103 1.00 0.00 N ATOM 1010 CZ ARG A 75 2.411 -10.433 -8.490 1.00 0.00 C ATOM 1011 NH1 ARG A 75 3.595 -10.367 -9.034 1.00 0.00 N ATOM 1012 NH2 ARG A 75 1.829 -11.591 -8.334 1.00 0.00 N ATOM 0 H ARG A 75 4.603 -5.977 -5.713 1.00 0.00 H new ATOM 0 HA ARG A 75 2.937 -4.741 -7.918 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.001 -7.461 -6.554 1.00 0.00 H new ATOM 0 HB3 ARG A 75 1.431 -6.801 -6.966 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.635 -6.325 -9.332 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.686 -7.624 -8.804 1.00 0.00 H new ATOM 0 HD2 ARG A 75 0.621 -7.789 -8.973 1.00 0.00 H new ATOM 0 HD3 ARG A 75 1.741 -8.546 -10.089 1.00 0.00 H new ATOM 0 HE ARG A 75 1.464 -9.263 -7.146 1.00 0.00 H new ATOM 0 HH11 ARG A 75 4.050 -9.462 -9.157 1.00 0.00 H new ATOM 0 HH12 ARG A 75 4.066 -11.220 -9.336 1.00 0.00 H new ATOM 0 HH21 ARG A 75 0.903 -11.643 -7.910 1.00 0.00 H new ATOM 0 HH22 ARG A 75 2.300 -12.444 -8.637 1.00 0.00 H new ATOM 1026 N ALA A 76 1.416 -3.702 -6.285 1.00 0.00 N ATOM 1027 CA ALA A 76 0.612 -2.969 -5.268 1.00 0.00 C ATOM 1028 C ALA A 76 -0.816 -2.764 -5.782 1.00 0.00 C ATOM 1029 O ALA A 76 -1.063 -2.757 -6.975 1.00 0.00 O ATOM 1030 CB ALA A 76 1.319 -1.626 -5.086 1.00 0.00 C ATOM 0 H ALA A 76 1.256 -3.415 -7.251 1.00 0.00 H new ATOM 0 HA ALA A 76 0.539 -3.514 -4.327 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.782 -1.029 -4.349 1.00 0.00 H new ATOM 0 HB2 ALA A 76 2.339 -1.796 -4.742 1.00 0.00 H new ATOM 0 HB3 ALA A 76 1.340 -1.094 -6.037 1.00 0.00 H new ATOM 1036 N LEU A 77 -1.758 -2.603 -4.893 1.00 0.00 N ATOM 1037 CA LEU A 77 -3.169 -2.408 -5.328 1.00 0.00 C ATOM 1038 C LEU A 77 -4.092 -2.362 -4.106 1.00 0.00 C ATOM 1039 O LEU A 77 -3.665 -2.075 -3.005 1.00 0.00 O ATOM 1040 CB LEU A 77 -3.482 -3.628 -6.202 1.00 0.00 C ATOM 1041 CG LEU A 77 -2.964 -4.896 -5.521 1.00 0.00 C ATOM 1042 CD1 LEU A 77 -3.755 -5.149 -4.236 1.00 0.00 C ATOM 1043 CD2 LEU A 77 -3.137 -6.088 -6.466 1.00 0.00 C ATOM 0 H LEU A 77 -1.611 -2.598 -3.884 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.316 -1.473 -5.869 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.557 -3.704 -6.365 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.018 -3.514 -7.182 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.909 -4.771 -5.279 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.384 -6.053 -3.753 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.634 -4.301 -3.562 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.811 -5.273 -4.477 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.768 -6.992 -5.982 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -4.193 -6.210 -6.708 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.573 -5.911 -7.382 1.00 0.00 H new ATOM 1055 N VAL A 78 -5.351 -2.647 -4.289 1.00 0.00 N ATOM 1056 CA VAL A 78 -6.301 -2.626 -3.142 1.00 0.00 C ATOM 1057 C VAL A 78 -7.388 -3.679 -3.363 1.00 0.00 C ATOM 1058 O VAL A 78 -7.512 -4.233 -4.437 1.00 0.00 O ATOM 1059 CB VAL A 78 -6.904 -1.221 -3.147 1.00 0.00 C ATOM 1060 CG1 VAL A 78 -7.607 -0.961 -1.813 1.00 0.00 C ATOM 1061 CG2 VAL A 78 -5.792 -0.188 -3.343 1.00 0.00 C ATOM 0 H VAL A 78 -5.765 -2.895 -5.188 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.817 -2.850 -2.191 1.00 0.00 H new ATOM 0 HB VAL A 78 -7.625 -1.140 -3.961 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -8.037 0.041 -1.817 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -8.400 -1.695 -1.670 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.886 -1.043 -1.000 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.222 0.813 -3.347 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.071 -0.270 -2.529 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.289 -0.370 -4.293 1.00 0.00 H new ATOM 1071 N GLY A 79 -8.175 -3.965 -2.365 1.00 0.00 N ATOM 1072 CA GLY A 79 -9.242 -4.988 -2.547 1.00 0.00 C ATOM 1073 C GLY A 79 -10.065 -5.113 -1.269 1.00 0.00 C ATOM 1074 O GLY A 79 -9.783 -4.481 -0.270 1.00 0.00 O ATOM 0 H GLY A 79 -8.127 -3.540 -1.439 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -9.888 -4.709 -3.380 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.796 -5.950 -2.798 1.00 0.00 H new ATOM 1078 N GLN A 80 -11.084 -5.927 -1.291 1.00 0.00 N ATOM 1079 CA GLN A 80 -11.924 -6.093 -0.075 1.00 0.00 C ATOM 1080 C GLN A 80 -11.666 -7.452 0.573 1.00 0.00 C ATOM 1081 O GLN A 80 -11.617 -8.473 -0.084 1.00 0.00 O ATOM 1082 CB GLN A 80 -13.373 -6.005 -0.564 1.00 0.00 C ATOM 1083 CG GLN A 80 -14.321 -6.606 0.487 1.00 0.00 C ATOM 1084 CD GLN A 80 -13.876 -6.195 1.896 1.00 0.00 C ATOM 1085 OE1 GLN A 80 -13.320 -5.131 2.084 1.00 0.00 O ATOM 1086 NE2 GLN A 80 -14.098 -7.003 2.901 1.00 0.00 N ATOM 0 H GLN A 80 -11.370 -6.483 -2.097 1.00 0.00 H new ATOM 0 HA GLN A 80 -11.701 -5.334 0.675 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -13.639 -4.965 -0.753 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -13.480 -6.538 -1.509 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -15.340 -6.265 0.305 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -14.328 -7.693 0.402 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -14.565 -7.896 2.744 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -13.804 -6.740 3.842 1.00 0.00 H new ATOM 1095 N ASN A 81 -11.527 -7.465 1.864 1.00 0.00 N ATOM 1096 CA ASN A 81 -11.303 -8.746 2.584 1.00 0.00 C ATOM 1097 C ASN A 81 -12.396 -8.918 3.641 1.00 0.00 C ATOM 1098 O ASN A 81 -12.330 -8.380 4.736 1.00 0.00 O ATOM 1099 CB ASN A 81 -9.915 -8.629 3.224 1.00 0.00 C ATOM 1100 CG ASN A 81 -8.863 -9.176 2.257 1.00 0.00 C ATOM 1101 OD1 ASN A 81 -8.909 -8.904 1.074 1.00 0.00 O ATOM 1102 ND2 ASN A 81 -7.910 -9.940 2.714 1.00 0.00 N ATOM 0 H ASN A 81 -11.559 -6.637 2.458 1.00 0.00 H new ATOM 0 HA ASN A 81 -11.346 -9.615 1.927 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -9.699 -7.588 3.463 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -9.887 -9.184 4.162 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -7.203 -10.309 2.078 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -7.871 -10.168 3.707 1.00 0.00 H new ATOM 1109 N GLY A 82 -13.417 -9.653 3.308 1.00 0.00 N ATOM 1110 CA GLY A 82 -14.530 -9.857 4.268 1.00 0.00 C ATOM 1111 C GLY A 82 -15.868 -9.636 3.556 1.00 0.00 C ATOM 1112 O GLY A 82 -16.817 -9.147 4.136 1.00 0.00 O ATOM 0 H GLY A 82 -13.528 -10.122 2.409 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -14.488 -10.865 4.681 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -14.433 -9.166 5.105 1.00 0.00 H new ATOM 1116 N ALA A 83 -15.950 -9.992 2.301 1.00 0.00 N ATOM 1117 CA ALA A 83 -17.222 -9.802 1.547 1.00 0.00 C ATOM 1118 C ALA A 83 -17.604 -8.315 1.516 1.00 0.00 C ATOM 1119 O ALA A 83 -17.385 -7.607 2.479 1.00 0.00 O ATOM 1120 CB ALA A 83 -18.263 -10.608 2.323 1.00 0.00 C ATOM 0 H ALA A 83 -15.188 -10.407 1.765 1.00 0.00 H new ATOM 0 HA ALA A 83 -17.142 -10.129 0.510 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -19.232 -10.520 1.831 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -17.964 -11.656 2.352 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -18.336 -10.224 3.340 1.00 0.00 H new ATOM 1126 N PRO A 84 -18.167 -7.883 0.411 1.00 0.00 N ATOM 1127 CA PRO A 84 -18.417 -8.781 -0.744 1.00 0.00 C ATOM 1128 C PRO A 84 -17.151 -8.939 -1.598 1.00 0.00 C ATOM 1129 O PRO A 84 -17.214 -9.342 -2.743 1.00 0.00 O ATOM 1130 CB PRO A 84 -19.501 -8.053 -1.530 1.00 0.00 C ATOM 1131 CG PRO A 84 -19.351 -6.604 -1.175 1.00 0.00 C ATOM 1132 CD PRO A 84 -18.628 -6.517 0.149 1.00 0.00 C ATOM 0 HA PRO A 84 -18.707 -9.788 -0.442 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -19.380 -8.209 -2.602 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -20.492 -8.421 -1.265 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -18.792 -6.078 -1.949 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -20.328 -6.126 -1.107 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.792 -5.820 0.099 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -19.290 -6.164 0.940 1.00 0.00 H new ATOM 1140 N TYR A 85 -16.006 -8.623 -1.055 1.00 0.00 N ATOM 1141 CA TYR A 85 -14.742 -8.754 -1.838 1.00 0.00 C ATOM 1142 C TYR A 85 -14.820 -7.923 -3.123 1.00 0.00 C ATOM 1143 O TYR A 85 -15.864 -7.417 -3.484 1.00 0.00 O ATOM 1144 CB TYR A 85 -14.628 -10.243 -2.172 1.00 0.00 C ATOM 1145 CG TYR A 85 -14.469 -11.038 -0.898 1.00 0.00 C ATOM 1146 CD1 TYR A 85 -13.228 -11.086 -0.253 1.00 0.00 C ATOM 1147 CD2 TYR A 85 -15.563 -11.730 -0.364 1.00 0.00 C ATOM 1148 CE1 TYR A 85 -13.080 -11.825 0.927 1.00 0.00 C ATOM 1149 CE2 TYR A 85 -15.415 -12.468 0.816 1.00 0.00 C ATOM 1150 CZ TYR A 85 -14.174 -12.516 1.461 1.00 0.00 C ATOM 1151 OH TYR A 85 -14.028 -13.245 2.624 1.00 0.00 O ATOM 0 H TYR A 85 -15.891 -8.279 -0.102 1.00 0.00 H new ATOM 0 HA TYR A 85 -13.878 -8.394 -1.279 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -15.516 -10.574 -2.711 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -13.775 -10.414 -2.828 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -12.384 -10.553 -0.666 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -16.520 -11.694 -0.862 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -12.122 -11.862 1.425 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -16.259 -13.001 1.229 1.00 0.00 H new ATOM 0 HH TYR A 85 -14.883 -13.662 2.858 1.00 0.00 H new ATOM 1161 N GLY A 86 -13.721 -7.781 -3.814 1.00 0.00 N ATOM 1162 CA GLY A 86 -13.729 -6.985 -5.075 1.00 0.00 C ATOM 1163 C GLY A 86 -12.492 -6.086 -5.121 1.00 0.00 C ATOM 1164 O GLY A 86 -12.309 -5.222 -4.287 1.00 0.00 O ATOM 0 H GLY A 86 -12.818 -8.182 -3.560 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -13.739 -7.651 -5.938 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -14.634 -6.379 -5.129 1.00 0.00 H new ATOM 1168 N THR A 87 -11.640 -6.280 -6.093 1.00 0.00 N ATOM 1169 CA THR A 87 -10.416 -5.432 -6.192 1.00 0.00 C ATOM 1170 C THR A 87 -10.639 -4.298 -7.195 1.00 0.00 C ATOM 1171 O THR A 87 -11.326 -4.458 -8.185 1.00 0.00 O ATOM 1172 CB THR A 87 -9.314 -6.373 -6.685 1.00 0.00 C ATOM 1173 OG1 THR A 87 -9.886 -7.393 -7.491 1.00 0.00 O ATOM 1174 CG2 THR A 87 -8.602 -7.003 -5.487 1.00 0.00 C ATOM 0 H THR A 87 -11.738 -6.987 -6.821 1.00 0.00 H new ATOM 0 HA THR A 87 -10.159 -4.970 -5.239 1.00 0.00 H new ATOM 0 HB THR A 87 -8.593 -5.808 -7.275 1.00 0.00 H new ATOM 0 HG1 THR A 87 -9.180 -7.994 -7.808 1.00 0.00 H new ATOM 0 HG21 THR A 87 -7.818 -7.673 -5.841 1.00 0.00 H new ATOM 0 HG22 THR A 87 -8.160 -6.219 -4.873 1.00 0.00 H new ATOM 0 HG23 THR A 87 -9.320 -7.568 -4.892 1.00 0.00 H new ATOM 1182 N VAL A 88 -10.065 -3.153 -6.947 1.00 0.00 N ATOM 1183 CA VAL A 88 -10.246 -2.009 -7.888 1.00 0.00 C ATOM 1184 C VAL A 88 -8.886 -1.492 -8.366 1.00 0.00 C ATOM 1185 O VAL A 88 -8.790 -0.793 -9.355 1.00 0.00 O ATOM 1186 CB VAL A 88 -10.971 -0.938 -7.073 1.00 0.00 C ATOM 1187 CG1 VAL A 88 -12.363 -1.442 -6.691 1.00 0.00 C ATOM 1188 CG2 VAL A 88 -10.171 -0.638 -5.803 1.00 0.00 C ATOM 0 H VAL A 88 -9.479 -2.959 -6.135 1.00 0.00 H new ATOM 0 HA VAL A 88 -10.806 -2.293 -8.779 1.00 0.00 H new ATOM 0 HB VAL A 88 -11.065 -0.030 -7.668 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -12.880 -0.678 -6.110 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -12.933 -1.657 -7.595 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -12.270 -2.350 -6.095 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -10.686 0.126 -5.220 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -10.078 -1.547 -5.208 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.178 -0.279 -6.075 1.00 0.00 H new ATOM 1198 N LEU A 89 -7.833 -1.831 -7.673 1.00 0.00 N ATOM 1199 CA LEU A 89 -6.482 -1.358 -8.090 1.00 0.00 C ATOM 1200 C LEU A 89 -5.651 -2.507 -8.660 1.00 0.00 C ATOM 1201 O LEU A 89 -5.629 -3.599 -8.128 1.00 0.00 O ATOM 1202 CB LEU A 89 -5.839 -0.813 -6.826 1.00 0.00 C ATOM 1203 CG LEU A 89 -6.135 0.677 -6.735 1.00 0.00 C ATOM 1204 CD1 LEU A 89 -7.518 0.884 -6.124 1.00 0.00 C ATOM 1205 CD2 LEU A 89 -5.076 1.342 -5.864 1.00 0.00 C ATOM 0 H LEU A 89 -7.850 -2.415 -6.837 1.00 0.00 H new ATOM 0 HA LEU A 89 -6.547 -0.604 -8.874 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -6.229 -1.331 -5.950 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -4.763 -0.985 -6.845 1.00 0.00 H new ATOM 0 HG LEU A 89 -6.117 1.121 -7.730 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -7.731 1.951 -6.058 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -8.268 0.402 -6.751 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.544 0.447 -5.126 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.281 2.410 -5.794 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.096 0.902 -4.867 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.092 1.190 -6.308 1.00 0.00 H new ATOM 1217 N ASP A 90 -4.962 -2.262 -9.737 1.00 0.00 N ATOM 1218 CA ASP A 90 -4.119 -3.329 -10.349 1.00 0.00 C ATOM 1219 C ASP A 90 -2.928 -2.698 -11.074 1.00 0.00 C ATOM 1220 O ASP A 90 -2.955 -2.504 -12.273 1.00 0.00 O ATOM 1221 CB ASP A 90 -5.038 -4.040 -11.343 1.00 0.00 C ATOM 1222 CG ASP A 90 -4.702 -5.532 -11.370 1.00 0.00 C ATOM 1223 OD1 ASP A 90 -3.525 -5.854 -11.382 1.00 0.00 O ATOM 1224 OD2 ASP A 90 -5.627 -6.328 -11.380 1.00 0.00 O ATOM 0 H ASP A 90 -4.945 -1.366 -10.223 1.00 0.00 H new ATOM 0 HA ASP A 90 -3.715 -4.018 -9.607 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -6.080 -3.896 -11.058 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -4.917 -3.611 -12.338 1.00 0.00 H new ATOM 1229 N THR A 91 -1.884 -2.366 -10.361 1.00 0.00 N ATOM 1230 CA THR A 91 -0.707 -1.740 -11.031 1.00 0.00 C ATOM 1231 C THR A 91 0.600 -2.285 -10.451 1.00 0.00 C ATOM 1232 O THR A 91 0.601 -3.094 -9.544 1.00 0.00 O ATOM 1233 CB THR A 91 -0.839 -0.245 -10.739 1.00 0.00 C ATOM 1234 OG1 THR A 91 -1.275 -0.062 -9.399 1.00 0.00 O ATOM 1235 CG2 THR A 91 -1.855 0.377 -11.698 1.00 0.00 C ATOM 0 H THR A 91 -1.795 -2.500 -9.354 1.00 0.00 H new ATOM 0 HA THR A 91 -0.685 -1.952 -12.100 1.00 0.00 H new ATOM 0 HB THR A 91 0.128 0.239 -10.876 1.00 0.00 H new ATOM 0 HG1 THR A 91 -1.358 0.896 -9.210 1.00 0.00 H new ATOM 0 HG21 THR A 91 -1.948 1.443 -11.489 1.00 0.00 H new ATOM 0 HG22 THR A 91 -1.519 0.237 -12.725 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.824 -0.105 -11.565 1.00 0.00 H new ATOM 1243 N SER A 92 1.713 -1.842 -10.970 1.00 0.00 N ATOM 1244 CA SER A 92 3.025 -2.326 -10.455 1.00 0.00 C ATOM 1245 C SER A 92 3.840 -1.146 -9.916 1.00 0.00 C ATOM 1246 O SER A 92 4.268 -0.292 -10.666 1.00 0.00 O ATOM 1247 CB SER A 92 3.720 -2.949 -11.665 1.00 0.00 C ATOM 1248 OG SER A 92 2.805 -3.799 -12.345 1.00 0.00 O ATOM 0 H SER A 92 1.770 -1.164 -11.730 1.00 0.00 H new ATOM 0 HA SER A 92 2.914 -3.040 -9.639 1.00 0.00 H new ATOM 0 HB2 SER A 92 4.077 -2.168 -12.336 1.00 0.00 H new ATOM 0 HB3 SER A 92 4.593 -3.517 -11.345 1.00 0.00 H new ATOM 0 HG SER A 92 3.247 -4.199 -13.123 1.00 0.00 H new ATOM 1254 N PRO A 93 4.022 -1.139 -8.624 1.00 0.00 N ATOM 1255 CA PRO A 93 4.789 -0.052 -7.964 1.00 0.00 C ATOM 1256 C PRO A 93 6.277 -0.147 -8.310 1.00 0.00 C ATOM 1257 O PRO A 93 7.011 -0.921 -7.729 1.00 0.00 O ATOM 1258 CB PRO A 93 4.563 -0.309 -6.476 1.00 0.00 C ATOM 1259 CG PRO A 93 4.244 -1.765 -6.384 1.00 0.00 C ATOM 1260 CD PRO A 93 3.538 -2.134 -7.661 1.00 0.00 C ATOM 0 HA PRO A 93 4.471 0.942 -8.278 1.00 0.00 H new ATOM 0 HB2 PRO A 93 5.450 -0.061 -5.893 1.00 0.00 H new ATOM 0 HB3 PRO A 93 3.746 0.300 -6.089 1.00 0.00 H new ATOM 0 HG2 PRO A 93 5.153 -2.353 -6.260 1.00 0.00 H new ATOM 0 HG3 PRO A 93 3.612 -1.969 -5.520 1.00 0.00 H new ATOM 0 HD2 PRO A 93 3.783 -3.148 -7.976 1.00 0.00 H new ATOM 0 HD3 PRO A 93 2.455 -2.088 -7.548 1.00 0.00 H new ATOM 1268 N ALA A 94 6.729 0.641 -9.246 1.00 0.00 N ATOM 1269 CA ALA A 94 8.171 0.602 -9.619 1.00 0.00 C ATOM 1270 C ALA A 94 8.999 1.326 -8.554 1.00 0.00 C ATOM 1271 O ALA A 94 8.513 2.205 -7.872 1.00 0.00 O ATOM 1272 CB ALA A 94 8.257 1.335 -10.958 1.00 0.00 C ATOM 0 H ALA A 94 6.163 1.310 -9.768 1.00 0.00 H new ATOM 0 HA ALA A 94 8.556 -0.415 -9.692 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.292 1.348 -11.300 1.00 0.00 H new ATOM 0 HB2 ALA A 94 7.638 0.822 -11.694 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.902 2.358 -10.836 1.00 0.00 H new ATOM 1278 N LEU A 95 10.242 0.964 -8.401 1.00 0.00 N ATOM 1279 CA LEU A 95 11.086 1.637 -7.372 1.00 0.00 C ATOM 1280 C LEU A 95 12.517 1.816 -7.886 1.00 0.00 C ATOM 1281 O LEU A 95 12.899 1.265 -8.899 1.00 0.00 O ATOM 1282 CB LEU A 95 11.061 0.699 -6.165 1.00 0.00 C ATOM 1283 CG LEU A 95 9.692 0.780 -5.487 1.00 0.00 C ATOM 1284 CD1 LEU A 95 9.601 -0.282 -4.391 1.00 0.00 C ATOM 1285 CD2 LEU A 95 9.513 2.168 -4.868 1.00 0.00 C ATOM 0 H LEU A 95 10.709 0.235 -8.940 1.00 0.00 H new ATOM 0 HA LEU A 95 10.716 2.632 -7.124 1.00 0.00 H new ATOM 0 HB2 LEU A 95 11.262 -0.324 -6.482 1.00 0.00 H new ATOM 0 HB3 LEU A 95 11.845 0.975 -5.460 1.00 0.00 H new ATOM 0 HG LEU A 95 8.910 0.606 -6.226 1.00 0.00 H new ATOM 0 HD11 LEU A 95 8.625 -0.224 -3.908 1.00 0.00 H new ATOM 0 HD12 LEU A 95 9.730 -1.271 -4.831 1.00 0.00 H new ATOM 0 HD13 LEU A 95 10.383 -0.109 -3.651 1.00 0.00 H new ATOM 0 HD21 LEU A 95 8.538 2.228 -4.384 1.00 0.00 H new ATOM 0 HD22 LEU A 95 10.296 2.341 -4.129 1.00 0.00 H new ATOM 0 HD23 LEU A 95 9.578 2.926 -5.649 1.00 0.00 H new ATOM 1297 N THR A 96 13.309 2.585 -7.190 1.00 0.00 N ATOM 1298 CA THR A 96 14.717 2.807 -7.630 1.00 0.00 C ATOM 1299 C THR A 96 15.451 3.684 -6.615 1.00 0.00 C ATOM 1300 O THR A 96 14.898 4.082 -5.609 1.00 0.00 O ATOM 1301 CB THR A 96 14.612 3.522 -8.980 1.00 0.00 C ATOM 1302 OG1 THR A 96 15.853 4.144 -9.283 1.00 0.00 O ATOM 1303 CG2 THR A 96 13.511 4.582 -8.923 1.00 0.00 C ATOM 0 H THR A 96 13.042 3.070 -6.334 1.00 0.00 H new ATOM 0 HA THR A 96 15.274 1.874 -7.711 1.00 0.00 H new ATOM 0 HB THR A 96 14.368 2.794 -9.754 1.00 0.00 H new ATOM 0 HG1 THR A 96 15.788 4.601 -10.148 1.00 0.00 H new ATOM 0 HG21 THR A 96 13.442 5.087 -9.887 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.558 4.105 -8.694 1.00 0.00 H new ATOM 0 HG23 THR A 96 13.747 5.311 -8.148 1.00 0.00 H new ATOM 1311 N SER A 97 16.692 3.990 -6.870 1.00 0.00 N ATOM 1312 CA SER A 97 17.459 4.844 -5.917 1.00 0.00 C ATOM 1313 C SER A 97 16.875 6.258 -5.889 1.00 0.00 C ATOM 1314 O SER A 97 17.247 7.078 -5.073 1.00 0.00 O ATOM 1315 CB SER A 97 18.886 4.863 -6.461 1.00 0.00 C ATOM 1316 OG SER A 97 19.791 4.535 -5.415 1.00 0.00 O ATOM 0 H SER A 97 17.209 3.687 -7.695 1.00 0.00 H new ATOM 0 HA SER A 97 17.419 4.463 -4.896 1.00 0.00 H new ATOM 0 HB2 SER A 97 18.985 4.151 -7.280 1.00 0.00 H new ATOM 0 HB3 SER A 97 19.121 5.848 -6.865 1.00 0.00 H new ATOM 0 HG SER A 97 19.609 3.626 -5.098 1.00 0.00 H new ATOM 1322 N GLU A 98 15.960 6.549 -6.772 1.00 0.00 N ATOM 1323 CA GLU A 98 15.350 7.910 -6.794 1.00 0.00 C ATOM 1324 C GLU A 98 13.925 7.857 -6.236 1.00 0.00 C ATOM 1325 O GLU A 98 13.369 6.792 -6.054 1.00 0.00 O ATOM 1326 CB GLU A 98 15.334 8.313 -8.269 1.00 0.00 C ATOM 1327 CG GLU A 98 16.590 9.124 -8.591 1.00 0.00 C ATOM 1328 CD GLU A 98 16.599 9.484 -10.078 1.00 0.00 C ATOM 1329 OE1 GLU A 98 16.641 8.571 -10.887 1.00 0.00 O ATOM 1330 OE2 GLU A 98 16.564 10.664 -10.382 1.00 0.00 O ATOM 0 H GLU A 98 15.608 5.904 -7.479 1.00 0.00 H new ATOM 0 HA GLU A 98 15.905 8.623 -6.184 1.00 0.00 H new ATOM 0 HB2 GLU A 98 15.291 7.425 -8.899 1.00 0.00 H new ATOM 0 HB3 GLU A 98 14.443 8.902 -8.486 1.00 0.00 H new ATOM 0 HG2 GLU A 98 16.615 10.031 -7.986 1.00 0.00 H new ATOM 0 HG3 GLU A 98 17.481 8.549 -8.340 1.00 0.00 H new ATOM 1337 N PRO A 99 13.383 9.016 -5.984 1.00 0.00 N ATOM 1338 CA PRO A 99 12.006 9.112 -5.440 1.00 0.00 C ATOM 1339 C PRO A 99 10.980 8.767 -6.523 1.00 0.00 C ATOM 1340 O PRO A 99 11.023 9.287 -7.620 1.00 0.00 O ATOM 1341 CB PRO A 99 11.888 10.575 -5.024 1.00 0.00 C ATOM 1342 CG PRO A 99 12.879 11.302 -5.876 1.00 0.00 C ATOM 1343 CD PRO A 99 13.995 10.334 -6.180 1.00 0.00 C ATOM 0 HA PRO A 99 11.820 8.424 -4.616 1.00 0.00 H new ATOM 0 HB2 PRO A 99 10.878 10.951 -5.186 1.00 0.00 H new ATOM 0 HB3 PRO A 99 12.110 10.703 -3.964 1.00 0.00 H new ATOM 0 HG2 PRO A 99 12.412 11.653 -6.796 1.00 0.00 H new ATOM 0 HG3 PRO A 99 13.262 12.181 -5.357 1.00 0.00 H new ATOM 0 HD2 PRO A 99 14.363 10.456 -7.199 1.00 0.00 H new ATOM 0 HD3 PRO A 99 14.845 10.483 -5.514 1.00 0.00 H new ATOM 1351 N ARG A 100 10.055 7.895 -6.224 1.00 0.00 N ATOM 1352 CA ARG A 100 9.030 7.522 -7.240 1.00 0.00 C ATOM 1353 C ARG A 100 7.628 7.860 -6.727 1.00 0.00 C ATOM 1354 O ARG A 100 6.992 7.068 -6.059 1.00 0.00 O ATOM 1355 CB ARG A 100 9.183 6.012 -7.427 1.00 0.00 C ATOM 1356 CG ARG A 100 8.116 5.507 -8.399 1.00 0.00 C ATOM 1357 CD ARG A 100 8.693 4.372 -9.247 1.00 0.00 C ATOM 1358 NE ARG A 100 9.131 5.024 -10.512 1.00 0.00 N ATOM 1359 CZ ARG A 100 8.245 5.528 -11.327 1.00 0.00 C ATOM 1360 NH1 ARG A 100 6.980 5.245 -11.173 1.00 0.00 N ATOM 1361 NH2 ARG A 100 8.624 6.317 -12.296 1.00 0.00 N ATOM 0 H ARG A 100 9.965 7.426 -5.323 1.00 0.00 H new ATOM 0 HA ARG A 100 9.164 8.063 -8.177 1.00 0.00 H new ATOM 0 HB2 ARG A 100 10.177 5.781 -7.810 1.00 0.00 H new ATOM 0 HB3 ARG A 100 9.085 5.504 -6.467 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.244 5.156 -7.848 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.780 6.321 -9.042 1.00 0.00 H new ATOM 0 HD2 ARG A 100 9.529 3.887 -8.742 1.00 0.00 H new ATOM 0 HD3 ARG A 100 7.946 3.602 -9.438 1.00 0.00 H new ATOM 0 HE ARG A 100 10.123 5.077 -10.742 1.00 0.00 H new ATOM 0 HH11 ARG A 100 6.684 4.630 -10.415 1.00 0.00 H new ATOM 0 HH12 ARG A 100 6.288 5.639 -11.810 1.00 0.00 H new ATOM 0 HH21 ARG A 100 9.612 6.539 -12.416 1.00 0.00 H new ATOM 0 HH22 ARG A 100 7.932 6.711 -12.933 1.00 0.00 H new ATOM 1375 N GLN A 101 7.141 9.031 -7.038 1.00 0.00 N ATOM 1376 CA GLN A 101 5.779 9.420 -6.572 1.00 0.00 C ATOM 1377 C GLN A 101 4.716 8.693 -7.399 1.00 0.00 C ATOM 1378 O GLN A 101 4.943 8.328 -8.535 1.00 0.00 O ATOM 1379 CB GLN A 101 5.698 10.930 -6.803 1.00 0.00 C ATOM 1380 CG GLN A 101 6.117 11.665 -5.528 1.00 0.00 C ATOM 1381 CD GLN A 101 5.144 12.814 -5.258 1.00 0.00 C ATOM 1382 OE1 GLN A 101 4.187 12.999 -5.984 1.00 0.00 O ATOM 1383 NE2 GLN A 101 5.349 13.600 -4.236 1.00 0.00 N ATOM 0 H GLN A 101 7.627 9.734 -7.594 1.00 0.00 H new ATOM 0 HA GLN A 101 5.606 9.159 -5.528 1.00 0.00 H new ATOM 0 HB2 GLN A 101 6.346 11.217 -7.631 1.00 0.00 H new ATOM 0 HB3 GLN A 101 4.682 11.212 -7.081 1.00 0.00 H new ATOM 0 HG2 GLN A 101 6.125 10.975 -4.684 1.00 0.00 H new ATOM 0 HG3 GLN A 101 7.131 12.050 -5.634 1.00 0.00 H new ATOM 0 HE21 GLN A 101 6.152 13.445 -3.626 1.00 0.00 H new ATOM 0 HE22 GLN A 101 4.706 14.369 -4.047 1.00 0.00 H new ATOM 1392 N VAL A 102 3.558 8.477 -6.839 1.00 0.00 N ATOM 1393 CA VAL A 102 2.486 7.772 -7.598 1.00 0.00 C ATOM 1394 C VAL A 102 1.173 8.554 -7.517 1.00 0.00 C ATOM 1395 O VAL A 102 0.764 8.993 -6.461 1.00 0.00 O ATOM 1396 CB VAL A 102 2.345 6.413 -6.915 1.00 0.00 C ATOM 1397 CG1 VAL A 102 1.353 5.551 -7.696 1.00 0.00 C ATOM 1398 CG2 VAL A 102 3.708 5.719 -6.881 1.00 0.00 C ATOM 0 H VAL A 102 3.308 8.757 -5.891 1.00 0.00 H new ATOM 0 HA VAL A 102 2.728 7.673 -8.656 1.00 0.00 H new ATOM 0 HB VAL A 102 1.981 6.552 -5.897 1.00 0.00 H new ATOM 0 HG11 VAL A 102 1.252 4.581 -7.209 1.00 0.00 H new ATOM 0 HG12 VAL A 102 0.383 6.047 -7.723 1.00 0.00 H new ATOM 0 HG13 VAL A 102 1.716 5.410 -8.714 1.00 0.00 H new ATOM 0 HG21 VAL A 102 3.610 4.749 -6.394 1.00 0.00 H new ATOM 0 HG22 VAL A 102 4.070 5.579 -7.899 1.00 0.00 H new ATOM 0 HG23 VAL A 102 4.416 6.334 -6.325 1.00 0.00 H new ATOM 1408 N THR A 103 0.512 8.731 -8.627 1.00 0.00 N ATOM 1409 CA THR A 103 -0.776 9.485 -8.619 1.00 0.00 C ATOM 1410 C THR A 103 -1.691 8.974 -9.736 1.00 0.00 C ATOM 1411 O THR A 103 -1.321 8.955 -10.893 1.00 0.00 O ATOM 1412 CB THR A 103 -0.389 10.946 -8.869 1.00 0.00 C ATOM 1413 OG1 THR A 103 0.989 11.023 -9.211 1.00 0.00 O ATOM 1414 CG2 THR A 103 -0.649 11.767 -7.606 1.00 0.00 C ATOM 0 H THR A 103 0.807 8.386 -9.541 1.00 0.00 H new ATOM 0 HA THR A 103 -1.318 9.365 -7.681 1.00 0.00 H new ATOM 0 HB THR A 103 -0.987 11.343 -9.689 1.00 0.00 H new ATOM 0 HG1 THR A 103 1.234 11.958 -9.372 1.00 0.00 H new ATOM 0 HG21 THR A 103 -0.373 12.806 -7.785 1.00 0.00 H new ATOM 0 HG22 THR A 103 -1.706 11.711 -7.347 1.00 0.00 H new ATOM 0 HG23 THR A 103 -0.053 11.370 -6.785 1.00 0.00 H new ATOM 1422 N GLU A 104 -2.882 8.560 -9.399 1.00 0.00 N ATOM 1423 CA GLU A 104 -3.815 8.052 -10.445 1.00 0.00 C ATOM 1424 C GLU A 104 -5.264 8.152 -9.959 1.00 0.00 C ATOM 1425 O GLU A 104 -5.534 8.143 -8.775 1.00 0.00 O ATOM 1426 CB GLU A 104 -3.420 6.589 -10.651 1.00 0.00 C ATOM 1427 CG GLU A 104 -2.040 6.520 -11.310 1.00 0.00 C ATOM 1428 CD GLU A 104 -1.798 5.106 -11.841 1.00 0.00 C ATOM 1429 OE1 GLU A 104 -1.354 4.273 -11.068 1.00 0.00 O ATOM 1430 OE2 GLU A 104 -2.060 4.880 -13.011 1.00 0.00 O ATOM 0 H GLU A 104 -3.249 8.551 -8.447 1.00 0.00 H new ATOM 0 HA GLU A 104 -3.750 8.627 -11.369 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -3.404 6.067 -9.694 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -4.158 6.086 -11.276 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -1.978 7.241 -12.125 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -1.267 6.786 -10.589 1.00 0.00 H new ATOM 1437 N THR A 105 -6.198 8.244 -10.866 1.00 0.00 N ATOM 1438 CA THR A 105 -7.628 8.342 -10.458 1.00 0.00 C ATOM 1439 C THR A 105 -8.407 7.132 -10.981 1.00 0.00 C ATOM 1440 O THR A 105 -8.557 6.946 -12.172 1.00 0.00 O ATOM 1441 CB THR A 105 -8.139 9.630 -11.106 1.00 0.00 C ATOM 1442 OG1 THR A 105 -7.141 10.636 -11.004 1.00 0.00 O ATOM 1443 CG2 THR A 105 -9.409 10.094 -10.392 1.00 0.00 C ATOM 0 H THR A 105 -6.032 8.256 -11.872 1.00 0.00 H new ATOM 0 HA THR A 105 -7.750 8.357 -9.375 1.00 0.00 H new ATOM 0 HB THR A 105 -8.364 9.445 -12.156 1.00 0.00 H new ATOM 0 HG1 THR A 105 -7.465 11.462 -11.420 1.00 0.00 H new ATOM 0 HG21 THR A 105 -9.772 11.012 -10.855 1.00 0.00 H new ATOM 0 HG22 THR A 105 -10.174 9.321 -10.470 1.00 0.00 H new ATOM 0 HG23 THR A 105 -9.188 10.280 -9.341 1.00 0.00 H new ATOM 1451 N PHE A 106 -8.901 6.305 -10.100 1.00 0.00 N ATOM 1452 CA PHE A 106 -9.665 5.106 -10.550 1.00 0.00 C ATOM 1453 C PHE A 106 -11.029 5.052 -9.855 1.00 0.00 C ATOM 1454 O PHE A 106 -11.212 5.592 -8.782 1.00 0.00 O ATOM 1455 CB PHE A 106 -8.805 3.912 -10.135 1.00 0.00 C ATOM 1456 CG PHE A 106 -8.874 3.735 -8.637 1.00 0.00 C ATOM 1457 CD1 PHE A 106 -7.968 4.409 -7.809 1.00 0.00 C ATOM 1458 CD2 PHE A 106 -9.846 2.898 -8.075 1.00 0.00 C ATOM 1459 CE1 PHE A 106 -8.034 4.245 -6.420 1.00 0.00 C ATOM 1460 CE2 PHE A 106 -9.912 2.735 -6.686 1.00 0.00 C ATOM 1461 CZ PHE A 106 -9.005 3.408 -5.859 1.00 0.00 C ATOM 0 H PHE A 106 -8.809 6.407 -9.089 1.00 0.00 H new ATOM 0 HA PHE A 106 -9.858 5.119 -11.623 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -9.154 3.008 -10.635 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -7.772 4.069 -10.446 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -7.219 5.055 -8.242 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -10.545 2.378 -8.713 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -7.335 4.765 -5.781 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -10.662 2.090 -6.253 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.055 3.281 -4.788 1.00 0.00 H new ATOM 1471 N THR A 107 -11.985 4.399 -10.457 1.00 0.00 N ATOM 1472 CA THR A 107 -13.334 4.304 -9.829 1.00 0.00 C ATOM 1473 C THR A 107 -13.434 3.024 -8.996 1.00 0.00 C ATOM 1474 O THR A 107 -13.840 1.986 -9.481 1.00 0.00 O ATOM 1475 CB THR A 107 -14.315 4.261 -11.002 1.00 0.00 C ATOM 1476 OG1 THR A 107 -14.342 5.529 -11.641 1.00 0.00 O ATOM 1477 CG2 THR A 107 -15.713 3.917 -10.487 1.00 0.00 C ATOM 0 H THR A 107 -11.891 3.927 -11.356 1.00 0.00 H new ATOM 0 HA THR A 107 -13.540 5.138 -9.158 1.00 0.00 H new ATOM 0 HB THR A 107 -13.996 3.501 -11.716 1.00 0.00 H new ATOM 0 HG1 THR A 107 -14.969 5.503 -12.394 1.00 0.00 H new ATOM 0 HG21 THR A 107 -16.412 3.887 -11.323 1.00 0.00 H new ATOM 0 HG22 THR A 107 -15.691 2.944 -9.997 1.00 0.00 H new ATOM 0 HG23 THR A 107 -16.035 4.675 -9.773 1.00 0.00 H new ATOM 1485 N ALA A 108 -13.064 3.088 -7.746 1.00 0.00 N ATOM 1486 CA ALA A 108 -13.135 1.874 -6.884 1.00 0.00 C ATOM 1487 C ALA A 108 -14.442 1.119 -7.135 1.00 0.00 C ATOM 1488 O ALA A 108 -15.485 1.480 -6.628 1.00 0.00 O ATOM 1489 CB ALA A 108 -13.089 2.403 -5.451 1.00 0.00 C ATOM 0 H ALA A 108 -12.716 3.928 -7.284 1.00 0.00 H new ATOM 0 HA ALA A 108 -12.323 1.176 -7.088 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -13.137 1.567 -4.753 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -12.161 2.953 -5.296 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -13.937 3.067 -5.281 1.00 0.00 H new ATOM 1495 N SER A 109 -14.394 0.073 -7.914 1.00 0.00 N ATOM 1496 CA SER A 109 -15.635 -0.705 -8.196 1.00 0.00 C ATOM 1497 C SER A 109 -15.824 -1.797 -7.140 1.00 0.00 C ATOM 1498 O SER A 109 -16.010 -2.955 -7.457 1.00 0.00 O ATOM 1499 CB SER A 109 -15.409 -1.324 -9.574 1.00 0.00 C ATOM 1500 OG SER A 109 -14.185 -2.048 -9.568 1.00 0.00 O ATOM 0 H SER A 109 -13.550 -0.277 -8.367 1.00 0.00 H new ATOM 0 HA SER A 109 -16.529 -0.082 -8.172 1.00 0.00 H new ATOM 0 HB2 SER A 109 -16.236 -1.987 -9.828 1.00 0.00 H new ATOM 0 HB3 SER A 109 -15.380 -0.545 -10.335 1.00 0.00 H new ATOM 0 HG SER A 109 -14.037 -2.448 -10.450 1.00 0.00 H new ATOM 1506 N ALA A 110 -15.777 -1.437 -5.886 1.00 0.00 N ATOM 1507 CA ALA A 110 -15.953 -2.456 -4.811 1.00 0.00 C ATOM 1508 C ALA A 110 -16.372 -1.781 -3.503 1.00 0.00 C ATOM 1509 O ALA A 110 -16.979 -0.728 -3.502 1.00 0.00 O ATOM 1510 CB ALA A 110 -14.580 -3.112 -4.659 1.00 0.00 C ATOM 0 H ALA A 110 -15.625 -0.483 -5.559 1.00 0.00 H new ATOM 0 HA ALA A 110 -16.728 -3.182 -5.055 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -14.626 -3.877 -3.884 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -14.289 -3.571 -5.604 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -13.845 -2.357 -4.381 1.00 0.00 H new ATOM 1516 N THR A 111 -16.053 -2.380 -2.389 1.00 0.00 N ATOM 1517 CA THR A 111 -16.432 -1.775 -1.081 1.00 0.00 C ATOM 1518 C THR A 111 -15.458 -2.225 0.012 1.00 0.00 C ATOM 1519 O THR A 111 -15.336 -3.398 0.303 1.00 0.00 O ATOM 1520 CB THR A 111 -17.840 -2.299 -0.795 1.00 0.00 C ATOM 1521 OG1 THR A 111 -18.668 -2.069 -1.926 1.00 0.00 O ATOM 1522 CG2 THR A 111 -18.420 -1.573 0.420 1.00 0.00 C ATOM 0 H THR A 111 -15.546 -3.263 -2.328 1.00 0.00 H new ATOM 0 HA THR A 111 -16.400 -0.686 -1.105 1.00 0.00 H new ATOM 0 HB THR A 111 -17.795 -3.368 -0.589 1.00 0.00 H new ATOM 0 HG1 THR A 111 -19.570 -2.406 -1.745 1.00 0.00 H new ATOM 0 HG21 THR A 111 -19.423 -1.947 0.623 1.00 0.00 H new ATOM 0 HG22 THR A 111 -17.784 -1.750 1.288 1.00 0.00 H new ATOM 0 HG23 THR A 111 -18.466 -0.503 0.217 1.00 0.00 H new ATOM 1530 N TYR A 112 -14.769 -1.300 0.622 1.00 0.00 N ATOM 1531 CA TYR A 112 -13.806 -1.674 1.699 1.00 0.00 C ATOM 1532 C TYR A 112 -14.286 -1.121 3.044 1.00 0.00 C ATOM 1533 O TYR A 112 -13.942 -0.018 3.420 1.00 0.00 O ATOM 1534 CB TYR A 112 -12.479 -1.025 1.296 1.00 0.00 C ATOM 1535 CG TYR A 112 -12.044 -1.531 -0.063 1.00 0.00 C ATOM 1536 CD1 TYR A 112 -12.551 -2.738 -0.563 1.00 0.00 C ATOM 1537 CD2 TYR A 112 -11.130 -0.790 -0.822 1.00 0.00 C ATOM 1538 CE1 TYR A 112 -12.145 -3.200 -1.822 1.00 0.00 C ATOM 1539 CE2 TYR A 112 -10.724 -1.253 -2.080 1.00 0.00 C ATOM 1540 CZ TYR A 112 -11.232 -2.457 -2.579 1.00 0.00 C ATOM 1541 OH TYR A 112 -10.836 -2.908 -3.821 1.00 0.00 O ATOM 0 H TYR A 112 -14.830 -0.302 0.422 1.00 0.00 H new ATOM 0 HA TYR A 112 -13.710 -2.754 1.810 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -12.588 0.059 1.271 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -11.714 -1.251 2.039 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -13.254 -3.312 0.022 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -10.738 0.140 -0.437 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -12.537 -4.129 -2.208 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -10.019 -0.681 -2.665 1.00 0.00 H new ATOM 0 HH TYR A 112 -11.387 -3.676 -4.081 1.00 0.00 H new ATOM 1551 N PRO A 113 -15.069 -1.913 3.724 1.00 0.00 N ATOM 1552 CA PRO A 113 -15.609 -1.503 5.044 1.00 0.00 C ATOM 1553 C PRO A 113 -14.500 -1.512 6.101 1.00 0.00 C ATOM 1554 O PRO A 113 -13.329 -1.441 5.786 1.00 0.00 O ATOM 1555 CB PRO A 113 -16.663 -2.566 5.344 1.00 0.00 C ATOM 1556 CG PRO A 113 -16.240 -3.763 4.554 1.00 0.00 C ATOM 1557 CD PRO A 113 -15.520 -3.252 3.333 1.00 0.00 C ATOM 0 HA PRO A 113 -16.019 -0.493 5.047 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -16.705 -2.791 6.410 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -17.657 -2.230 5.050 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -15.588 -4.405 5.146 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -17.105 -4.363 4.269 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -14.681 -3.894 3.066 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -16.180 -3.214 2.467 1.00 0.00 H new ATOM 1565 N ALA A 114 -14.860 -1.597 7.353 1.00 0.00 N ATOM 1566 CA ALA A 114 -13.825 -1.610 8.427 1.00 0.00 C ATOM 1567 C ALA A 114 -14.357 -2.335 9.667 1.00 0.00 C ATOM 1568 O ALA A 114 -14.076 -1.956 10.787 1.00 0.00 O ATOM 1569 CB ALA A 114 -13.560 -0.137 8.739 1.00 0.00 C ATOM 0 H ALA A 114 -15.825 -1.658 7.679 1.00 0.00 H new ATOM 0 HA ALA A 114 -12.918 -2.131 8.120 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -12.807 -0.061 9.523 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -13.201 0.366 7.841 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -14.483 0.335 9.076 1.00 0.00 H new ATOM 1661 N GLU A 122 -12.635 -6.747 6.573 1.00 0.00 N ATOM 1662 CA GLU A 122 -12.781 -5.499 5.759 1.00 0.00 C ATOM 1663 C GLU A 122 -11.769 -5.467 4.612 1.00 0.00 C ATOM 1664 O GLU A 122 -11.109 -6.441 4.334 1.00 0.00 O ATOM 1665 CB GLU A 122 -12.533 -4.348 6.740 1.00 0.00 C ATOM 1666 CG GLU A 122 -11.042 -4.255 7.079 1.00 0.00 C ATOM 1667 CD GLU A 122 -10.750 -2.899 7.723 1.00 0.00 C ATOM 1668 OE1 GLU A 122 -11.026 -2.753 8.902 1.00 0.00 O ATOM 1669 OE2 GLU A 122 -10.254 -2.029 7.025 1.00 0.00 O ATOM 0 HA GLU A 122 -13.765 -5.433 5.295 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -12.874 -3.409 6.304 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -13.111 -4.505 7.650 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -10.761 -5.060 7.758 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -10.444 -4.377 6.176 1.00 0.00 H new ATOM 1676 N GLY A 123 -11.651 -4.353 3.938 1.00 0.00 N ATOM 1677 CA GLY A 123 -10.690 -4.264 2.800 1.00 0.00 C ATOM 1678 C GLY A 123 -9.471 -3.436 3.207 1.00 0.00 C ATOM 1679 O GLY A 123 -9.519 -2.656 4.137 1.00 0.00 O ATOM 0 H GLY A 123 -12.179 -3.501 4.127 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -10.377 -5.264 2.499 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -11.177 -3.809 1.937 1.00 0.00 H new ATOM 1683 N GLN A 124 -8.376 -3.603 2.516 1.00 0.00 N ATOM 1684 CA GLN A 124 -7.150 -2.830 2.863 1.00 0.00 C ATOM 1685 C GLN A 124 -6.288 -2.597 1.617 1.00 0.00 C ATOM 1686 O GLN A 124 -6.780 -2.544 0.504 1.00 0.00 O ATOM 1687 CB GLN A 124 -6.407 -3.712 3.866 1.00 0.00 C ATOM 1688 CG GLN A 124 -5.897 -4.971 3.162 1.00 0.00 C ATOM 1689 CD GLN A 124 -5.450 -5.994 4.207 1.00 0.00 C ATOM 1690 OE1 GLN A 124 -4.513 -5.758 4.943 1.00 0.00 O ATOM 1691 NE2 GLN A 124 -6.086 -7.130 4.304 1.00 0.00 N ATOM 0 H GLN A 124 -8.278 -4.241 1.726 1.00 0.00 H new ATOM 0 HA GLN A 124 -7.385 -1.846 3.269 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -5.572 -3.162 4.300 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -7.070 -3.985 4.687 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -6.683 -5.394 2.536 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -5.065 -4.721 2.504 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -6.873 -7.328 3.686 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -5.796 -7.819 4.998 1.00 0.00 H new ATOM 1700 N ILE A 125 -5.001 -2.468 1.804 1.00 0.00 N ATOM 1701 CA ILE A 125 -4.087 -2.246 0.646 1.00 0.00 C ATOM 1702 C ILE A 125 -3.092 -3.404 0.554 1.00 0.00 C ATOM 1703 O ILE A 125 -2.699 -3.974 1.555 1.00 0.00 O ATOM 1704 CB ILE A 125 -3.362 -0.934 0.956 1.00 0.00 C ATOM 1705 CG1 ILE A 125 -4.290 0.244 0.648 1.00 0.00 C ATOM 1706 CG2 ILE A 125 -2.100 -0.827 0.095 1.00 0.00 C ATOM 1707 CD1 ILE A 125 -3.817 1.481 1.414 1.00 0.00 C ATOM 0 H ILE A 125 -4.542 -2.507 2.714 1.00 0.00 H new ATOM 0 HA ILE A 125 -4.617 -2.195 -0.305 1.00 0.00 H new ATOM 0 HB ILE A 125 -3.083 -0.915 2.010 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -4.295 0.446 -0.423 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -5.314 -0.002 0.930 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -1.586 0.108 0.318 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -1.439 -1.666 0.313 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -2.376 -0.847 -0.959 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -4.478 2.320 1.195 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -3.835 1.275 2.484 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -2.801 1.731 1.110 1.00 0.00 H new ATOM 1719 N ALA A 126 -2.696 -3.770 -0.636 1.00 0.00 N ATOM 1720 CA ALA A 126 -1.746 -4.910 -0.781 1.00 0.00 C ATOM 1721 C ALA A 126 -0.409 -4.462 -1.381 1.00 0.00 C ATOM 1722 O ALA A 126 -0.325 -4.062 -2.526 1.00 0.00 O ATOM 1723 CB ALA A 126 -2.449 -5.886 -1.724 1.00 0.00 C ATOM 0 H ALA A 126 -2.988 -3.331 -1.509 1.00 0.00 H new ATOM 0 HA ALA A 126 -1.508 -5.354 0.186 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -1.815 -6.758 -1.885 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -3.394 -6.202 -1.282 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -2.640 -5.396 -2.679 1.00 0.00 H new ATOM 1729 N PHE A 127 0.640 -4.564 -0.614 1.00 0.00 N ATOM 1730 CA PHE A 127 1.998 -4.193 -1.109 1.00 0.00 C ATOM 1731 C PHE A 127 2.892 -5.430 -1.026 1.00 0.00 C ATOM 1732 O PHE A 127 3.705 -5.561 -0.134 1.00 0.00 O ATOM 1733 CB PHE A 127 2.495 -3.113 -0.149 1.00 0.00 C ATOM 1734 CG PHE A 127 2.128 -1.746 -0.670 1.00 0.00 C ATOM 1735 CD1 PHE A 127 0.805 -1.458 -1.018 1.00 0.00 C ATOM 1736 CD2 PHE A 127 3.118 -0.764 -0.801 1.00 0.00 C ATOM 1737 CE1 PHE A 127 0.469 -0.186 -1.498 1.00 0.00 C ATOM 1738 CE2 PHE A 127 2.782 0.507 -1.281 1.00 0.00 C ATOM 1739 CZ PHE A 127 1.458 0.796 -1.629 1.00 0.00 C ATOM 0 H PHE A 127 0.615 -4.894 0.351 1.00 0.00 H new ATOM 0 HA PHE A 127 1.998 -3.836 -2.139 1.00 0.00 H new ATOM 0 HB2 PHE A 127 2.058 -3.264 0.838 1.00 0.00 H new ATOM 0 HB3 PHE A 127 3.576 -3.188 -0.033 1.00 0.00 H new ATOM 0 HD1 PHE A 127 0.042 -2.216 -0.917 1.00 0.00 H new ATOM 0 HD2 PHE A 127 4.140 -0.987 -0.532 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -0.553 0.037 -1.767 1.00 0.00 H new ATOM 0 HE2 PHE A 127 3.545 1.265 -1.383 1.00 0.00 H new ATOM 0 HZ PHE A 127 1.199 1.777 -1.999 1.00 0.00 H new ATOM 1749 N GLN A 128 2.725 -6.355 -1.928 1.00 0.00 N ATOM 1750 CA GLN A 128 3.536 -7.605 -1.864 1.00 0.00 C ATOM 1751 C GLN A 128 4.861 -7.464 -2.613 1.00 0.00 C ATOM 1752 O GLN A 128 4.900 -7.176 -3.793 1.00 0.00 O ATOM 1753 CB GLN A 128 2.663 -8.669 -2.530 1.00 0.00 C ATOM 1754 CG GLN A 128 1.413 -8.909 -1.681 1.00 0.00 C ATOM 1755 CD GLN A 128 0.222 -9.201 -2.596 1.00 0.00 C ATOM 1756 OE1 GLN A 128 -0.389 -8.294 -3.126 1.00 0.00 O ATOM 1757 NE2 GLN A 128 -0.137 -10.438 -2.805 1.00 0.00 N ATOM 0 H GLN A 128 2.065 -6.302 -2.704 1.00 0.00 H new ATOM 0 HA GLN A 128 3.799 -7.854 -0.836 1.00 0.00 H new ATOM 0 HB2 GLN A 128 2.379 -8.346 -3.532 1.00 0.00 H new ATOM 0 HB3 GLN A 128 3.224 -9.597 -2.641 1.00 0.00 H new ATOM 0 HG2 GLN A 128 1.577 -9.746 -1.002 1.00 0.00 H new ATOM 0 HG3 GLN A 128 1.206 -8.034 -1.065 1.00 0.00 H new ATOM 0 HE21 GLN A 128 0.375 -11.200 -2.361 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -0.930 -10.643 -3.413 1.00 0.00 H new ATOM 1766 N LEU A 129 5.948 -7.693 -1.926 1.00 0.00 N ATOM 1767 CA LEU A 129 7.284 -7.608 -2.575 1.00 0.00 C ATOM 1768 C LEU A 129 7.846 -9.024 -2.735 1.00 0.00 C ATOM 1769 O LEU A 129 8.953 -9.320 -2.329 1.00 0.00 O ATOM 1770 CB LEU A 129 8.160 -6.785 -1.622 1.00 0.00 C ATOM 1771 CG LEU A 129 7.339 -5.658 -0.985 1.00 0.00 C ATOM 1772 CD1 LEU A 129 8.284 -4.644 -0.339 1.00 0.00 C ATOM 1773 CD2 LEU A 129 6.501 -4.961 -2.060 1.00 0.00 C ATOM 0 H LEU A 129 5.965 -7.937 -0.936 1.00 0.00 H new ATOM 0 HA LEU A 129 7.243 -7.147 -3.562 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.569 -7.430 -0.845 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.006 -6.365 -2.166 1.00 0.00 H new ATOM 0 HG LEU A 129 6.678 -6.076 -0.226 1.00 0.00 H new ATOM 0 HD11 LEU A 129 7.702 -3.842 0.115 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.879 -5.139 0.428 1.00 0.00 H new ATOM 0 HD13 LEU A 129 8.945 -4.228 -1.099 1.00 0.00 H new ATOM 0 HD21 LEU A 129 5.918 -4.160 -1.605 1.00 0.00 H new ATOM 0 HD22 LEU A 129 7.160 -4.543 -2.821 1.00 0.00 H new ATOM 0 HD23 LEU A 129 5.827 -5.683 -2.521 1.00 0.00 H new ATOM 1785 N GLY A 130 7.078 -9.905 -3.311 1.00 0.00 N ATOM 1786 CA GLY A 130 7.554 -11.306 -3.494 1.00 0.00 C ATOM 1787 C GLY A 130 8.136 -11.471 -4.900 1.00 0.00 C ATOM 1788 O GLY A 130 7.528 -11.094 -5.882 1.00 0.00 O ATOM 0 H GLY A 130 6.140 -9.716 -3.664 1.00 0.00 H new ATOM 0 HA2 GLY A 130 8.310 -11.544 -2.746 1.00 0.00 H new ATOM 0 HA3 GLY A 130 6.729 -12.003 -3.347 1.00 0.00 H new ATOM 1792 N GLY A 131 9.310 -12.031 -5.004 1.00 0.00 N ATOM 1793 CA GLY A 131 9.934 -12.221 -6.344 1.00 0.00 C ATOM 1794 C GLY A 131 9.915 -10.896 -7.110 1.00 0.00 C ATOM 1795 O GLY A 131 8.950 -10.563 -7.767 1.00 0.00 O ATOM 0 H GLY A 131 9.865 -12.366 -4.217 1.00 0.00 H new ATOM 0 HA2 GLY A 131 10.959 -12.574 -6.232 1.00 0.00 H new ATOM 0 HA3 GLY A 131 9.393 -12.984 -6.904 1.00 0.00 H new ATOM 1799 N PHE A 132 10.975 -10.137 -7.029 1.00 0.00 N ATOM 1800 CA PHE A 132 11.011 -8.833 -7.754 1.00 0.00 C ATOM 1801 C PHE A 132 12.458 -8.376 -7.960 1.00 0.00 C ATOM 1802 O PHE A 132 13.012 -8.506 -9.034 1.00 0.00 O ATOM 1803 CB PHE A 132 10.261 -7.858 -6.847 1.00 0.00 C ATOM 1804 CG PHE A 132 8.775 -8.049 -7.030 1.00 0.00 C ATOM 1805 CD1 PHE A 132 8.236 -8.157 -8.318 1.00 0.00 C ATOM 1806 CD2 PHE A 132 7.934 -8.118 -5.912 1.00 0.00 C ATOM 1807 CE1 PHE A 132 6.858 -8.334 -8.488 1.00 0.00 C ATOM 1808 CE2 PHE A 132 6.555 -8.295 -6.083 1.00 0.00 C ATOM 1809 CZ PHE A 132 6.017 -8.403 -7.371 1.00 0.00 C ATOM 0 H PHE A 132 11.814 -10.362 -6.495 1.00 0.00 H new ATOM 0 HA PHE A 132 10.560 -8.899 -8.744 1.00 0.00 H new ATOM 0 HB2 PHE A 132 10.536 -8.027 -5.806 1.00 0.00 H new ATOM 0 HB3 PHE A 132 10.540 -6.832 -7.087 1.00 0.00 H new ATOM 0 HD1 PHE A 132 8.884 -8.104 -9.180 1.00 0.00 H new ATOM 0 HD2 PHE A 132 8.349 -8.035 -4.918 1.00 0.00 H new ATOM 0 HE1 PHE A 132 6.443 -8.417 -9.482 1.00 0.00 H new ATOM 0 HE2 PHE A 132 5.907 -8.348 -5.221 1.00 0.00 H new ATOM 0 HZ PHE A 132 4.954 -8.539 -7.503 1.00 0.00 H new ATOM 1819 N SER A 133 13.076 -7.838 -6.943 1.00 0.00 N ATOM 1820 CA SER A 133 14.485 -7.372 -7.091 1.00 0.00 C ATOM 1821 C SER A 133 15.459 -8.505 -6.752 1.00 0.00 C ATOM 1822 O SER A 133 15.075 -9.529 -6.224 1.00 0.00 O ATOM 1823 CB SER A 133 14.630 -6.225 -6.093 1.00 0.00 C ATOM 1824 OG SER A 133 15.973 -6.171 -5.632 1.00 0.00 O ATOM 0 H SER A 133 12.667 -7.701 -6.018 1.00 0.00 H new ATOM 0 HA SER A 133 14.709 -7.057 -8.110 1.00 0.00 H new ATOM 0 HB2 SER A 133 14.357 -5.281 -6.564 1.00 0.00 H new ATOM 0 HB3 SER A 133 13.951 -6.370 -5.253 1.00 0.00 H new ATOM 0 HG SER A 133 15.981 -6.001 -4.667 1.00 0.00 H new ATOM 1830 N ALA A 134 16.717 -8.329 -7.055 1.00 0.00 N ATOM 1831 CA ALA A 134 17.714 -9.396 -6.752 1.00 0.00 C ATOM 1832 C ALA A 134 18.447 -9.083 -5.444 1.00 0.00 C ATOM 1833 O ALA A 134 18.011 -9.456 -4.375 1.00 0.00 O ATOM 1834 CB ALA A 134 18.685 -9.376 -7.932 1.00 0.00 C ATOM 0 H ALA A 134 17.097 -7.493 -7.499 1.00 0.00 H new ATOM 0 HA ALA A 134 17.248 -10.373 -6.625 1.00 0.00 H new ATOM 0 HB1 ALA A 134 19.453 -10.136 -7.785 1.00 0.00 H new ATOM 0 HB2 ALA A 134 18.142 -9.583 -8.854 1.00 0.00 H new ATOM 0 HB3 ALA A 134 19.154 -8.395 -8.000 1.00 0.00 H new ATOM 1840 N ASP A 135 19.558 -8.402 -5.518 1.00 0.00 N ATOM 1841 CA ASP A 135 20.313 -8.071 -4.275 1.00 0.00 C ATOM 1842 C ASP A 135 19.363 -7.531 -3.203 1.00 0.00 C ATOM 1843 O ASP A 135 18.286 -7.050 -3.498 1.00 0.00 O ATOM 1844 CB ASP A 135 21.314 -6.994 -4.696 1.00 0.00 C ATOM 1845 CG ASP A 135 22.604 -7.657 -5.183 1.00 0.00 C ATOM 1846 OD1 ASP A 135 22.554 -8.327 -6.201 1.00 0.00 O ATOM 1847 OD2 ASP A 135 23.620 -7.483 -4.529 1.00 0.00 O ATOM 0 H ASP A 135 19.975 -8.061 -6.384 1.00 0.00 H new ATOM 0 HA ASP A 135 20.807 -8.944 -3.848 1.00 0.00 H new ATOM 0 HB2 ASP A 135 20.889 -6.377 -5.488 1.00 0.00 H new ATOM 0 HB3 ASP A 135 21.527 -6.333 -3.856 1.00 0.00 H new ATOM 1852 N ALA A 136 19.754 -7.608 -1.960 1.00 0.00 N ATOM 1853 CA ALA A 136 18.875 -7.100 -0.866 1.00 0.00 C ATOM 1854 C ALA A 136 18.485 -5.646 -1.130 1.00 0.00 C ATOM 1855 O ALA A 136 19.323 -4.800 -1.372 1.00 0.00 O ATOM 1856 CB ALA A 136 19.722 -7.206 0.402 1.00 0.00 C ATOM 0 H ALA A 136 20.644 -8.001 -1.654 1.00 0.00 H new ATOM 0 HA ALA A 136 17.947 -7.666 -0.786 1.00 0.00 H new ATOM 0 HB1 ALA A 136 19.145 -6.850 1.256 1.00 0.00 H new ATOM 0 HB2 ALA A 136 20.006 -8.246 0.564 1.00 0.00 H new ATOM 0 HB3 ALA A 136 20.620 -6.598 0.292 1.00 0.00 H new ATOM 1862 N TRP A 137 17.217 -5.348 -1.078 1.00 0.00 N ATOM 1863 CA TRP A 137 16.769 -3.949 -1.318 1.00 0.00 C ATOM 1864 C TRP A 137 15.733 -3.547 -0.275 1.00 0.00 C ATOM 1865 O TRP A 137 15.619 -4.165 0.765 1.00 0.00 O ATOM 1866 CB TRP A 137 16.181 -3.947 -2.731 1.00 0.00 C ATOM 1867 CG TRP A 137 14.799 -4.522 -2.730 1.00 0.00 C ATOM 1868 CD1 TRP A 137 13.671 -3.821 -2.477 1.00 0.00 C ATOM 1869 CD2 TRP A 137 14.375 -5.891 -3.009 1.00 0.00 C ATOM 1870 NE1 TRP A 137 12.584 -4.668 -2.584 1.00 0.00 N ATOM 1871 CE2 TRP A 137 12.965 -5.953 -2.909 1.00 0.00 C ATOM 1872 CE3 TRP A 137 15.067 -7.075 -3.336 1.00 0.00 C ATOM 1873 CZ2 TRP A 137 12.265 -7.139 -3.125 1.00 0.00 C ATOM 1874 CZ3 TRP A 137 14.362 -8.273 -3.554 1.00 0.00 C ATOM 1875 CH2 TRP A 137 12.964 -8.302 -3.449 1.00 0.00 C ATOM 0 H TRP A 137 16.471 -6.014 -0.879 1.00 0.00 H new ATOM 0 HA TRP A 137 17.583 -3.229 -1.235 1.00 0.00 H new ATOM 0 HB2 TRP A 137 16.156 -2.928 -3.118 1.00 0.00 H new ATOM 0 HB3 TRP A 137 16.821 -4.526 -3.397 1.00 0.00 H new ATOM 0 HD1 TRP A 137 13.627 -2.770 -2.231 1.00 0.00 H new ATOM 0 HE1 TRP A 137 11.617 -4.378 -2.440 1.00 0.00 H new ATOM 0 HE3 TRP A 137 16.144 -7.062 -3.420 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 11.188 -7.157 -3.042 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 14.901 -9.175 -3.804 1.00 0.00 H new ATOM 0 HH2 TRP A 137 12.429 -9.224 -3.619 1.00 0.00 H new ATOM 1886 N THR A 138 15.000 -2.502 -0.519 1.00 0.00 N ATOM 1887 CA THR A 138 14.006 -2.062 0.493 1.00 0.00 C ATOM 1888 C THR A 138 12.950 -1.150 -0.145 1.00 0.00 C ATOM 1889 O THR A 138 13.027 -0.807 -1.307 1.00 0.00 O ATOM 1890 CB THR A 138 14.873 -1.320 1.525 1.00 0.00 C ATOM 1891 OG1 THR A 138 15.023 -2.135 2.677 1.00 0.00 O ATOM 1892 CG2 THR A 138 14.239 0.016 1.932 1.00 0.00 C ATOM 0 H THR A 138 15.044 -1.937 -1.367 1.00 0.00 H new ATOM 0 HA THR A 138 13.437 -2.878 0.939 1.00 0.00 H new ATOM 0 HB THR A 138 15.843 -1.113 1.073 1.00 0.00 H new ATOM 0 HG1 THR A 138 14.461 -1.786 3.400 1.00 0.00 H new ATOM 0 HG21 THR A 138 14.877 0.514 2.662 1.00 0.00 H new ATOM 0 HG22 THR A 138 14.130 0.650 1.052 1.00 0.00 H new ATOM 0 HG23 THR A 138 13.258 -0.166 2.372 1.00 0.00 H new ATOM 1900 N LEU A 139 11.973 -0.747 0.621 1.00 0.00 N ATOM 1901 CA LEU A 139 10.915 0.157 0.083 1.00 0.00 C ATOM 1902 C LEU A 139 10.669 1.300 1.066 1.00 0.00 C ATOM 1903 O LEU A 139 10.411 1.080 2.231 1.00 0.00 O ATOM 1904 CB LEU A 139 9.661 -0.707 -0.048 1.00 0.00 C ATOM 1905 CG LEU A 139 9.612 -1.331 -1.441 1.00 0.00 C ATOM 1906 CD1 LEU A 139 10.309 -2.693 -1.420 1.00 0.00 C ATOM 1907 CD2 LEU A 139 8.151 -1.505 -1.864 1.00 0.00 C ATOM 0 H LEU A 139 11.861 -1.006 1.601 1.00 0.00 H new ATOM 0 HA LEU A 139 11.199 0.597 -0.873 1.00 0.00 H new ATOM 0 HB2 LEU A 139 9.665 -1.489 0.712 1.00 0.00 H new ATOM 0 HB3 LEU A 139 8.771 -0.102 0.122 1.00 0.00 H new ATOM 0 HG LEU A 139 10.122 -0.680 -2.151 1.00 0.00 H new ATOM 0 HD11 LEU A 139 10.272 -3.136 -2.415 1.00 0.00 H new ATOM 0 HD12 LEU A 139 11.348 -2.565 -1.118 1.00 0.00 H new ATOM 0 HD13 LEU A 139 9.803 -3.350 -0.712 1.00 0.00 H new ATOM 0 HD21 LEU A 139 8.111 -1.950 -2.858 1.00 0.00 H new ATOM 0 HD22 LEU A 139 7.642 -2.156 -1.154 1.00 0.00 H new ATOM 0 HD23 LEU A 139 7.659 -0.532 -1.882 1.00 0.00 H new ATOM 1919 N CYS A 140 10.752 2.520 0.615 1.00 0.00 N ATOM 1920 CA CYS A 140 10.529 3.663 1.545 1.00 0.00 C ATOM 1921 C CYS A 140 9.383 4.550 1.055 1.00 0.00 C ATOM 1922 O CYS A 140 9.562 5.399 0.204 1.00 0.00 O ATOM 1923 CB CYS A 140 11.846 4.440 1.538 1.00 0.00 C ATOM 1924 SG CYS A 140 13.052 3.589 2.587 1.00 0.00 S ATOM 0 H CYS A 140 10.963 2.775 -0.350 1.00 0.00 H new ATOM 0 HA CYS A 140 10.253 3.325 2.544 1.00 0.00 H new ATOM 0 HB2 CYS A 140 12.227 4.522 0.520 1.00 0.00 H new ATOM 0 HB3 CYS A 140 11.684 5.455 1.901 1.00 0.00 H new ATOM 1929 N LEU A 141 8.209 4.374 1.599 1.00 0.00 N ATOM 1930 CA LEU A 141 7.062 5.224 1.175 1.00 0.00 C ATOM 1931 C LEU A 141 7.007 6.475 2.054 1.00 0.00 C ATOM 1932 O LEU A 141 7.820 6.654 2.939 1.00 0.00 O ATOM 1933 CB LEU A 141 5.812 4.367 1.387 1.00 0.00 C ATOM 1934 CG LEU A 141 5.960 3.039 0.644 1.00 0.00 C ATOM 1935 CD1 LEU A 141 5.410 1.912 1.516 1.00 0.00 C ATOM 1936 CD2 LEU A 141 5.171 3.092 -0.668 1.00 0.00 C ATOM 0 H LEU A 141 7.996 3.681 2.316 1.00 0.00 H new ATOM 0 HA LEU A 141 7.148 5.549 0.138 1.00 0.00 H new ATOM 0 HB2 LEU A 141 5.662 4.184 2.451 1.00 0.00 H new ATOM 0 HB3 LEU A 141 4.931 4.898 1.028 1.00 0.00 H new ATOM 0 HG LEU A 141 7.013 2.860 0.427 1.00 0.00 H new ATOM 0 HD11 LEU A 141 5.513 0.962 0.991 1.00 0.00 H new ATOM 0 HD12 LEU A 141 5.967 1.871 2.452 1.00 0.00 H new ATOM 0 HD13 LEU A 141 4.357 2.097 1.728 1.00 0.00 H new ATOM 0 HD21 LEU A 141 5.278 2.144 -1.196 1.00 0.00 H new ATOM 0 HD22 LEU A 141 4.118 3.270 -0.452 1.00 0.00 H new ATOM 0 HD23 LEU A 141 5.555 3.900 -1.291 1.00 0.00 H new ATOM 1948 N ASP A 142 6.057 7.337 1.823 1.00 0.00 N ATOM 1949 CA ASP A 142 5.951 8.578 2.651 1.00 0.00 C ATOM 1950 C ASP A 142 4.964 9.555 2.010 1.00 0.00 C ATOM 1951 O ASP A 142 5.192 10.747 1.969 1.00 0.00 O ATOM 1952 CB ASP A 142 7.359 9.187 2.670 1.00 0.00 C ATOM 1953 CG ASP A 142 8.004 9.048 1.289 1.00 0.00 C ATOM 1954 OD1 ASP A 142 7.273 9.047 0.312 1.00 0.00 O ATOM 1955 OD2 ASP A 142 9.218 8.944 1.231 1.00 0.00 O ATOM 0 H ASP A 142 5.347 7.239 1.097 1.00 0.00 H new ATOM 0 HA ASP A 142 5.591 8.362 3.657 1.00 0.00 H new ATOM 0 HB2 ASP A 142 7.306 10.238 2.952 1.00 0.00 H new ATOM 0 HB3 ASP A 142 7.972 8.686 3.419 1.00 0.00 H new ATOM 1960 N ASP A 143 3.870 9.058 1.508 1.00 0.00 N ATOM 1961 CA ASP A 143 2.866 9.952 0.866 1.00 0.00 C ATOM 1962 C ASP A 143 1.632 9.142 0.476 1.00 0.00 C ATOM 1963 O ASP A 143 1.189 9.172 -0.654 1.00 0.00 O ATOM 1964 CB ASP A 143 3.563 10.506 -0.377 1.00 0.00 C ATOM 1965 CG ASP A 143 3.493 12.034 -0.364 1.00 0.00 C ATOM 1966 OD1 ASP A 143 2.422 12.560 -0.618 1.00 0.00 O ATOM 1967 OD2 ASP A 143 4.511 12.652 -0.101 1.00 0.00 O ATOM 0 H ASP A 143 3.626 8.068 1.514 1.00 0.00 H new ATOM 0 HA ASP A 143 2.532 10.750 1.528 1.00 0.00 H new ATOM 0 HB2 ASP A 143 4.603 10.179 -0.400 1.00 0.00 H new ATOM 0 HB3 ASP A 143 3.087 10.117 -1.277 1.00 0.00 H new ATOM 1972 N VAL A 144 1.078 8.410 1.403 1.00 0.00 N ATOM 1973 CA VAL A 144 -0.123 7.585 1.084 1.00 0.00 C ATOM 1974 C VAL A 144 -1.395 8.405 1.314 1.00 0.00 C ATOM 1975 O VAL A 144 -1.648 8.888 2.400 1.00 0.00 O ATOM 1976 CB VAL A 144 -0.076 6.386 2.041 1.00 0.00 C ATOM 1977 CG1 VAL A 144 -0.754 5.188 1.376 1.00 0.00 C ATOM 1978 CG2 VAL A 144 1.377 6.017 2.364 1.00 0.00 C ATOM 0 H VAL A 144 1.404 8.347 2.367 1.00 0.00 H new ATOM 0 HA VAL A 144 -0.128 7.261 0.043 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.591 6.651 2.964 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -0.724 4.332 2.051 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -1.791 5.436 1.150 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -0.231 4.940 0.452 1.00 0.00 H new ATOM 0 HG21 VAL A 144 1.394 5.165 3.044 1.00 0.00 H new ATOM 0 HG22 VAL A 144 1.900 5.757 1.443 1.00 0.00 H new ATOM 0 HG23 VAL A 144 1.872 6.866 2.835 1.00 0.00 H new ATOM 1988 N ALA A 145 -2.194 8.570 0.295 1.00 0.00 N ATOM 1989 CA ALA A 145 -3.445 9.365 0.450 1.00 0.00 C ATOM 1990 C ALA A 145 -4.565 8.765 -0.405 1.00 0.00 C ATOM 1991 O ALA A 145 -4.344 8.326 -1.517 1.00 0.00 O ATOM 1992 CB ALA A 145 -3.083 10.765 -0.047 1.00 0.00 C ATOM 0 H ALA A 145 -2.034 8.189 -0.638 1.00 0.00 H new ATOM 0 HA ALA A 145 -3.804 9.375 1.479 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -3.953 11.416 0.034 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -2.271 11.168 0.559 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -2.766 10.711 -1.088 1.00 0.00 H new ATOM 1998 N LEU A 146 -5.767 8.747 0.107 1.00 0.00 N ATOM 1999 CA LEU A 146 -6.904 8.180 -0.674 1.00 0.00 C ATOM 2000 C LEU A 146 -8.201 8.916 -0.324 1.00 0.00 C ATOM 2001 O LEU A 146 -8.594 8.989 0.824 1.00 0.00 O ATOM 2002 CB LEU A 146 -6.988 6.714 -0.246 1.00 0.00 C ATOM 2003 CG LEU A 146 -8.141 6.032 -0.983 1.00 0.00 C ATOM 2004 CD1 LEU A 146 -7.687 5.639 -2.390 1.00 0.00 C ATOM 2005 CD2 LEU A 146 -8.565 4.778 -0.216 1.00 0.00 C ATOM 0 H LEU A 146 -6.010 9.101 1.032 1.00 0.00 H new ATOM 0 HA LEU A 146 -6.759 8.282 -1.749 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -6.050 6.205 -0.467 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -7.141 6.647 0.831 1.00 0.00 H new ATOM 0 HG LEU A 146 -8.984 6.719 -1.052 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -8.509 5.153 -2.915 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -7.384 6.532 -2.937 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -6.844 4.952 -2.322 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -9.387 4.291 -0.741 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -7.721 4.091 -0.147 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -8.889 5.057 0.787 1.00 0.00 H new ATOM 2017 N ASP A 147 -8.868 9.465 -1.303 1.00 0.00 N ATOM 2018 CA ASP A 147 -10.137 10.197 -1.022 1.00 0.00 C ATOM 2019 C ASP A 147 -11.205 9.824 -2.054 1.00 0.00 C ATOM 2020 O ASP A 147 -10.986 8.999 -2.918 1.00 0.00 O ATOM 2021 CB ASP A 147 -9.774 11.678 -1.139 1.00 0.00 C ATOM 2022 CG ASP A 147 -10.594 12.486 -0.131 1.00 0.00 C ATOM 2023 OD1 ASP A 147 -11.549 11.941 0.398 1.00 0.00 O ATOM 2024 OD2 ASP A 147 -10.253 13.635 0.094 1.00 0.00 O ATOM 0 H ASP A 147 -8.590 9.439 -2.284 1.00 0.00 H new ATOM 0 HA ASP A 147 -10.545 9.952 -0.041 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -8.709 11.818 -0.953 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -9.970 12.033 -2.151 1.00 0.00 H new ATOM 2029 N SER A 148 -12.360 10.428 -1.971 1.00 0.00 N ATOM 2030 CA SER A 148 -13.442 10.109 -2.948 1.00 0.00 C ATOM 2031 C SER A 148 -14.089 11.400 -3.458 1.00 0.00 C ATOM 2032 O SER A 148 -13.794 12.481 -2.990 1.00 0.00 O ATOM 2033 CB SER A 148 -14.453 9.278 -2.160 1.00 0.00 C ATOM 2034 OG SER A 148 -14.456 9.704 -0.804 1.00 0.00 O ATOM 0 H SER A 148 -12.601 11.128 -1.270 1.00 0.00 H new ATOM 0 HA SER A 148 -13.068 9.574 -3.821 1.00 0.00 H new ATOM 0 HB2 SER A 148 -15.448 9.390 -2.591 1.00 0.00 H new ATOM 0 HB3 SER A 148 -14.197 8.220 -2.220 1.00 0.00 H new ATOM 0 HG SER A 148 -15.105 9.174 -0.296 1.00 0.00 H new