USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 602 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 220 SER OG : rot -75:sc= 1.13 USER MOD Set 1.2: A 223 THR OG1 : rot 59:sc= 1.48 USER MOD Set 2.1: A 192 TYR OH : rot 180:sc= -0.306 USER MOD Set 2.2: A 235 MET CE :methyl -130:sc= -0.776 (180deg=-3.71!) USER MOD Single : A 173 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 174 ASN : amide:sc= -4.42! C(o=-4.4!,f=-4.5!) USER MOD Single : A 176 HIS : no HD1:sc= -1.39! C(o=-1.4!,f=-3.5!) USER MOD Single : A 177 LYS NZ :NH3+ -118:sc= -0.0962 (180deg=-0.747) USER MOD Single : A 178 SER OG : rot 25:sc= 0.627 USER MOD Single : A 186 GLN : amide:sc= -0.225 X(o=-0.23,f=-0.35) USER MOD Single : A 197 LYS NZ :NH3+ 142:sc= 0.641 (180deg=-0.815) USER MOD Single : A 202 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.072) USER MOD Single : A 203 CYS SG : rot -44:sc= -2.05! USER MOD Single : A 204 TYR OH : rot -154:sc= -2.69! USER MOD Single : A 214 HIS : no HD1:sc= -0.705 X(o=-0.7,f=-0.25) USER MOD Single : A 217 SER OG : rot -106:sc= 0.0201 USER MOD Single : A 229 GLN : amide:sc= -4.43! K(o=-4.4!,f=-3.4) USER MOD Single : A 230 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 239 CYS SG : rot -171:sc= -1.75! USER MOD Single : A 244 HIS : no HE2:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 247 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 173 26.924 -1.040 3.395 1.00 0.00 N ATOM 2 CA MET A 173 27.652 -1.840 4.421 1.00 0.00 C ATOM 3 C MET A 173 26.639 -2.521 5.341 1.00 0.00 C ATOM 4 O MET A 173 26.367 -2.050 6.426 1.00 0.00 O ATOM 5 CB MET A 173 28.566 -0.915 5.238 1.00 0.00 C ATOM 6 CG MET A 173 29.465 -1.759 6.166 1.00 0.00 C ATOM 7 SD MET A 173 30.690 -0.702 6.995 1.00 0.00 S ATOM 8 CE MET A 173 31.950 -0.704 5.691 1.00 0.00 C ATOM 0 HA MET A 173 28.261 -2.600 3.932 1.00 0.00 H new ATOM 0 HB2 MET A 173 29.181 -0.313 4.569 1.00 0.00 H new ATOM 0 HB3 MET A 173 27.965 -0.223 5.828 1.00 0.00 H new ATOM 0 HG2 MET A 173 28.853 -2.269 6.910 1.00 0.00 H new ATOM 0 HG3 MET A 173 29.973 -2.530 5.587 1.00 0.00 H new ATOM 0 HE1 MET A 173 32.801 -0.101 6.007 1.00 0.00 H new ATOM 0 HE2 MET A 173 32.279 -1.726 5.504 1.00 0.00 H new ATOM 0 HE3 MET A 173 31.528 -0.286 4.777 1.00 0.00 H new ATOM 20 N ASN A 174 26.077 -3.630 4.911 1.00 0.00 N ATOM 21 CA ASN A 174 25.073 -4.358 5.756 1.00 0.00 C ATOM 22 C ASN A 174 24.126 -3.346 6.425 1.00 0.00 C ATOM 23 O ASN A 174 23.833 -3.435 7.601 1.00 0.00 O ATOM 24 CB ASN A 174 25.801 -5.198 6.827 1.00 0.00 C ATOM 25 CG ASN A 174 27.043 -4.462 7.310 1.00 0.00 C ATOM 26 OD1 ASN A 174 28.124 -4.682 6.805 1.00 0.00 O ATOM 27 ND2 ASN A 174 26.928 -3.579 8.258 1.00 0.00 N ATOM 0 H ASN A 174 26.272 -4.063 4.008 1.00 0.00 H new ATOM 0 HA ASN A 174 24.487 -5.026 5.125 1.00 0.00 H new ATOM 0 HB2 ASN A 174 25.133 -5.390 7.666 1.00 0.00 H new ATOM 0 HB3 ASN A 174 26.080 -6.167 6.413 1.00 0.00 H new ATOM 0 HD21 ASN A 174 27.749 -3.067 8.581 1.00 0.00 H new ATOM 0 HD22 ASN A 174 26.017 -3.398 8.679 1.00 0.00 H new ATOM 34 N VAL A 175 23.648 -2.384 5.679 1.00 0.00 N ATOM 35 CA VAL A 175 22.724 -1.365 6.266 1.00 0.00 C ATOM 36 C VAL A 175 21.383 -2.022 6.598 1.00 0.00 C ATOM 37 O VAL A 175 20.912 -2.877 5.873 1.00 0.00 O ATOM 38 CB VAL A 175 22.466 -0.263 5.227 1.00 0.00 C ATOM 39 CG1 VAL A 175 21.949 -0.894 3.922 1.00 0.00 C ATOM 40 CG2 VAL A 175 21.405 0.703 5.767 1.00 0.00 C ATOM 0 H VAL A 175 23.857 -2.259 4.688 1.00 0.00 H new ATOM 0 HA VAL A 175 23.175 -0.949 7.167 1.00 0.00 H new ATOM 0 HB VAL A 175 23.394 0.274 5.032 1.00 0.00 H new ATOM 0 HG11 VAL A 175 21.767 -0.111 3.186 1.00 0.00 H new ATOM 0 HG12 VAL A 175 22.693 -1.590 3.534 1.00 0.00 H new ATOM 0 HG13 VAL A 175 21.020 -1.429 4.120 1.00 0.00 H new ATOM 0 HG21 VAL A 175 21.219 1.487 5.033 1.00 0.00 H new ATOM 0 HG22 VAL A 175 20.481 0.158 5.958 1.00 0.00 H new ATOM 0 HG23 VAL A 175 21.760 1.152 6.695 1.00 0.00 H new ATOM 50 N HIS A 176 20.761 -1.639 7.684 1.00 0.00 N ATOM 51 CA HIS A 176 19.443 -2.248 8.018 1.00 0.00 C ATOM 52 C HIS A 176 18.475 -1.948 6.869 1.00 0.00 C ATOM 53 O HIS A 176 18.546 -0.891 6.263 1.00 0.00 O ATOM 54 CB HIS A 176 18.936 -1.673 9.365 1.00 0.00 C ATOM 55 CG HIS A 176 20.112 -1.097 10.130 1.00 0.00 C ATOM 56 ND1 HIS A 176 21.311 -1.780 10.224 1.00 0.00 N ATOM 57 CD2 HIS A 176 20.294 0.077 10.824 1.00 0.00 C ATOM 58 CE1 HIS A 176 22.154 -1.034 10.954 1.00 0.00 C ATOM 59 NE2 HIS A 176 21.587 0.111 11.346 1.00 0.00 N ATOM 0 H HIS A 176 21.104 -0.941 8.344 1.00 0.00 H new ATOM 0 HA HIS A 176 19.525 -3.329 8.134 1.00 0.00 H new ATOM 0 HB2 HIS A 176 18.188 -0.900 9.187 1.00 0.00 H new ATOM 0 HB3 HIS A 176 18.453 -2.455 9.950 1.00 0.00 H new ATOM 0 HD2 HIS A 176 19.551 0.852 10.946 1.00 0.00 H new ATOM 0 HE1 HIS A 176 23.166 -1.323 11.195 1.00 0.00 H new ATOM 0 HE2 HIS A 176 22.009 0.851 11.907 1.00 0.00 H new ATOM 67 N LYS A 177 17.537 -2.819 6.591 1.00 0.00 N ATOM 68 CA LYS A 177 16.562 -2.501 5.499 1.00 0.00 C ATOM 69 C LYS A 177 15.798 -1.221 5.829 1.00 0.00 C ATOM 70 O LYS A 177 15.507 -0.920 6.973 1.00 0.00 O ATOM 71 CB LYS A 177 15.591 -3.685 5.276 1.00 0.00 C ATOM 72 CG LYS A 177 16.192 -4.973 5.849 1.00 0.00 C ATOM 73 CD LYS A 177 15.313 -6.180 5.453 1.00 0.00 C ATOM 74 CE LYS A 177 15.804 -6.776 4.132 1.00 0.00 C ATOM 75 NZ LYS A 177 17.147 -7.381 4.358 1.00 0.00 N ATOM 0 H LYS A 177 17.404 -3.716 7.059 1.00 0.00 H new ATOM 0 HA LYS A 177 17.114 -2.340 4.573 1.00 0.00 H new ATOM 0 HB2 LYS A 177 14.634 -3.476 5.755 1.00 0.00 H new ATOM 0 HB3 LYS A 177 15.394 -3.809 4.211 1.00 0.00 H new ATOM 0 HG2 LYS A 177 17.206 -5.111 5.474 1.00 0.00 H new ATOM 0 HG3 LYS A 177 16.261 -4.902 6.934 1.00 0.00 H new ATOM 0 HD2 LYS A 177 15.346 -6.937 6.237 1.00 0.00 H new ATOM 0 HD3 LYS A 177 14.274 -5.867 5.356 1.00 0.00 H new ATOM 0 HE2 LYS A 177 15.104 -7.530 3.773 1.00 0.00 H new ATOM 0 HE3 LYS A 177 15.861 -6.003 3.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 17.851 -6.894 3.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 17.408 -7.282 5.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 17.121 -8.389 4.105 1.00 0.00 H new ATOM 89 N SER A 178 15.407 -0.509 4.810 1.00 0.00 N ATOM 90 CA SER A 178 14.618 0.744 5.005 1.00 0.00 C ATOM 91 C SER A 178 13.813 1.047 3.739 1.00 0.00 C ATOM 92 O SER A 178 14.122 0.583 2.660 1.00 0.00 O ATOM 93 CB SER A 178 15.563 1.909 5.325 1.00 0.00 C ATOM 94 OG SER A 178 15.844 1.928 6.719 1.00 0.00 O ATOM 0 H SER A 178 15.602 -0.743 3.837 1.00 0.00 H new ATOM 0 HA SER A 178 13.929 0.612 5.839 1.00 0.00 H new ATOM 0 HB2 SER A 178 16.489 1.805 4.759 1.00 0.00 H new ATOM 0 HB3 SER A 178 15.108 2.852 5.023 1.00 0.00 H new ATOM 0 HG SER A 178 15.727 1.028 7.089 1.00 0.00 H new ATOM 100 N GLU A 179 12.784 1.832 3.858 1.00 0.00 N ATOM 101 CA GLU A 179 11.978 2.153 2.654 1.00 0.00 C ATOM 102 C GLU A 179 12.736 3.199 1.831 1.00 0.00 C ATOM 103 O GLU A 179 12.682 4.380 2.112 1.00 0.00 O ATOM 104 CB GLU A 179 10.616 2.711 3.084 1.00 0.00 C ATOM 105 CG GLU A 179 9.715 2.824 1.852 1.00 0.00 C ATOM 106 CD GLU A 179 8.318 3.275 2.271 1.00 0.00 C ATOM 107 OE1 GLU A 179 8.132 4.471 2.424 1.00 0.00 O ATOM 108 OE2 GLU A 179 7.459 2.424 2.429 1.00 0.00 O ATOM 0 H GLU A 179 12.468 2.262 4.728 1.00 0.00 H new ATOM 0 HA GLU A 179 11.816 1.256 2.056 1.00 0.00 H new ATOM 0 HB2 GLU A 179 10.159 2.058 3.827 1.00 0.00 H new ATOM 0 HB3 GLU A 179 10.739 3.688 3.552 1.00 0.00 H new ATOM 0 HG2 GLU A 179 10.140 3.536 1.144 1.00 0.00 H new ATOM 0 HG3 GLU A 179 9.659 1.862 1.342 1.00 0.00 H new ATOM 115 N PHE A 180 13.460 2.769 0.822 1.00 0.00 N ATOM 116 CA PHE A 180 14.252 3.740 -0.015 1.00 0.00 C ATOM 117 C PHE A 180 13.559 4.026 -1.355 1.00 0.00 C ATOM 118 O PHE A 180 13.794 5.047 -1.973 1.00 0.00 O ATOM 119 CB PHE A 180 15.614 3.122 -0.349 1.00 0.00 C ATOM 120 CG PHE A 180 16.482 3.035 0.888 1.00 0.00 C ATOM 121 CD1 PHE A 180 16.939 4.207 1.504 1.00 0.00 C ATOM 122 CD2 PHE A 180 16.857 1.784 1.399 1.00 0.00 C ATOM 123 CE1 PHE A 180 17.764 4.133 2.635 1.00 0.00 C ATOM 124 CE2 PHE A 180 17.687 1.708 2.527 1.00 0.00 C ATOM 125 CZ PHE A 180 18.141 2.884 3.145 1.00 0.00 C ATOM 0 H PHE A 180 13.539 1.792 0.540 1.00 0.00 H new ATOM 0 HA PHE A 180 14.346 4.662 0.558 1.00 0.00 H new ATOM 0 HB2 PHE A 180 15.473 2.127 -0.771 1.00 0.00 H new ATOM 0 HB3 PHE A 180 16.115 3.722 -1.109 1.00 0.00 H new ATOM 0 HD1 PHE A 180 16.655 5.170 1.107 1.00 0.00 H new ATOM 0 HD2 PHE A 180 16.507 0.879 0.924 1.00 0.00 H new ATOM 0 HE1 PHE A 180 18.109 5.038 3.113 1.00 0.00 H new ATOM 0 HE2 PHE A 180 17.977 0.745 2.920 1.00 0.00 H new ATOM 0 HZ PHE A 180 18.781 2.826 4.013 1.00 0.00 H new ATOM 135 N ASP A 181 12.755 3.114 -1.828 1.00 0.00 N ATOM 136 CA ASP A 181 12.097 3.302 -3.153 1.00 0.00 C ATOM 137 C ASP A 181 10.755 4.011 -3.018 1.00 0.00 C ATOM 138 O ASP A 181 9.773 3.424 -2.616 1.00 0.00 O ATOM 139 CB ASP A 181 11.885 1.919 -3.776 1.00 0.00 C ATOM 140 CG ASP A 181 13.237 1.216 -3.883 1.00 0.00 C ATOM 141 OD1 ASP A 181 13.936 1.465 -4.850 1.00 0.00 O ATOM 142 OD2 ASP A 181 13.557 0.455 -2.988 1.00 0.00 O ATOM 0 H ASP A 181 12.524 2.242 -1.352 1.00 0.00 H new ATOM 0 HA ASP A 181 12.734 3.924 -3.782 1.00 0.00 H new ATOM 0 HB2 ASP A 181 11.201 1.330 -3.165 1.00 0.00 H new ATOM 0 HB3 ASP A 181 11.430 2.015 -4.762 1.00 0.00 H new ATOM 147 N GLU A 182 10.701 5.262 -3.387 1.00 0.00 N ATOM 148 CA GLU A 182 9.412 6.004 -3.322 1.00 0.00 C ATOM 149 C GLU A 182 8.396 5.330 -4.254 1.00 0.00 C ATOM 150 O GLU A 182 7.230 5.211 -3.939 1.00 0.00 O ATOM 151 CB GLU A 182 9.629 7.451 -3.784 1.00 0.00 C ATOM 152 CG GLU A 182 10.573 8.169 -2.813 1.00 0.00 C ATOM 153 CD GLU A 182 10.677 9.662 -3.172 1.00 0.00 C ATOM 154 OE1 GLU A 182 11.333 9.979 -4.154 1.00 0.00 O ATOM 155 OE2 GLU A 182 10.101 10.464 -2.455 1.00 0.00 O ATOM 0 H GLU A 182 11.495 5.802 -3.731 1.00 0.00 H new ATOM 0 HA GLU A 182 9.040 5.998 -2.297 1.00 0.00 H new ATOM 0 HB2 GLU A 182 10.049 7.462 -4.790 1.00 0.00 H new ATOM 0 HB3 GLU A 182 8.674 7.975 -3.832 1.00 0.00 H new ATOM 0 HG2 GLU A 182 10.208 8.058 -1.792 1.00 0.00 H new ATOM 0 HG3 GLU A 182 11.561 7.710 -2.850 1.00 0.00 H new ATOM 162 N ASP A 183 8.841 4.901 -5.408 1.00 0.00 N ATOM 163 CA ASP A 183 7.929 4.249 -6.388 1.00 0.00 C ATOM 164 C ASP A 183 7.323 2.980 -5.778 1.00 0.00 C ATOM 165 O ASP A 183 6.171 2.665 -6.000 1.00 0.00 O ATOM 166 CB ASP A 183 8.712 3.891 -7.664 1.00 0.00 C ATOM 167 CG ASP A 183 9.106 5.172 -8.417 1.00 0.00 C ATOM 168 OD1 ASP A 183 10.083 5.790 -8.026 1.00 0.00 O ATOM 169 OD2 ASP A 183 8.425 5.510 -9.373 1.00 0.00 O ATOM 0 H ASP A 183 9.811 4.977 -5.714 1.00 0.00 H new ATOM 0 HA ASP A 183 7.124 4.939 -6.640 1.00 0.00 H new ATOM 0 HB2 ASP A 183 9.605 3.323 -7.405 1.00 0.00 H new ATOM 0 HB3 ASP A 183 8.104 3.254 -8.307 1.00 0.00 H new ATOM 174 N ALA A 184 8.106 2.225 -5.050 1.00 0.00 N ATOM 175 CA ALA A 184 7.591 0.946 -4.474 1.00 0.00 C ATOM 176 C ALA A 184 6.516 1.205 -3.415 1.00 0.00 C ATOM 177 O ALA A 184 5.483 0.567 -3.417 1.00 0.00 O ATOM 178 CB ALA A 184 8.758 0.182 -3.843 1.00 0.00 C ATOM 0 H ALA A 184 9.079 2.439 -4.830 1.00 0.00 H new ATOM 0 HA ALA A 184 7.140 0.360 -5.275 1.00 0.00 H new ATOM 0 HB1 ALA A 184 8.394 -0.754 -3.419 1.00 0.00 H new ATOM 0 HB2 ALA A 184 9.507 -0.032 -4.605 1.00 0.00 H new ATOM 0 HB3 ALA A 184 9.205 0.787 -3.055 1.00 0.00 H new ATOM 184 N TRP A 185 6.730 2.126 -2.514 1.00 0.00 N ATOM 185 CA TRP A 185 5.687 2.390 -1.487 1.00 0.00 C ATOM 186 C TRP A 185 4.401 2.843 -2.185 1.00 0.00 C ATOM 187 O TRP A 185 3.314 2.445 -1.827 1.00 0.00 O ATOM 188 CB TRP A 185 6.169 3.483 -0.527 1.00 0.00 C ATOM 189 CG TRP A 185 5.120 3.744 0.508 1.00 0.00 C ATOM 190 CD1 TRP A 185 4.458 4.915 0.668 1.00 0.00 C ATOM 191 CD2 TRP A 185 4.615 2.842 1.534 1.00 0.00 C ATOM 192 NE1 TRP A 185 3.569 4.782 1.717 1.00 0.00 N ATOM 193 CE2 TRP A 185 3.629 3.524 2.283 1.00 0.00 C ATOM 194 CE3 TRP A 185 4.908 1.508 1.883 1.00 0.00 C ATOM 195 CZ2 TRP A 185 2.957 2.910 3.339 1.00 0.00 C ATOM 196 CZ3 TRP A 185 4.231 0.889 2.950 1.00 0.00 C ATOM 197 CH2 TRP A 185 3.257 1.590 3.673 1.00 0.00 C ATOM 0 H TRP A 185 7.571 2.699 -2.446 1.00 0.00 H new ATOM 0 HA TRP A 185 5.494 1.480 -0.918 1.00 0.00 H new ATOM 0 HB2 TRP A 185 7.098 3.175 -0.047 1.00 0.00 H new ATOM 0 HB3 TRP A 185 6.383 4.397 -1.080 1.00 0.00 H new ATOM 0 HD1 TRP A 185 4.601 5.805 0.074 1.00 0.00 H new ATOM 0 HE1 TRP A 185 2.944 5.523 2.035 1.00 0.00 H new ATOM 0 HE3 TRP A 185 5.655 0.959 1.329 1.00 0.00 H new ATOM 0 HZ2 TRP A 185 2.208 3.454 3.895 1.00 0.00 H new ATOM 0 HZ3 TRP A 185 4.464 -0.132 3.213 1.00 0.00 H new ATOM 0 HH2 TRP A 185 2.739 1.108 4.489 1.00 0.00 H new ATOM 208 N GLN A 186 4.516 3.669 -3.185 1.00 0.00 N ATOM 209 CA GLN A 186 3.296 4.142 -3.905 1.00 0.00 C ATOM 210 C GLN A 186 2.547 2.955 -4.506 1.00 0.00 C ATOM 211 O GLN A 186 1.332 2.910 -4.512 1.00 0.00 O ATOM 212 CB GLN A 186 3.685 5.111 -5.023 1.00 0.00 C ATOM 213 CG GLN A 186 4.082 6.461 -4.422 1.00 0.00 C ATOM 214 CD GLN A 186 2.835 7.175 -3.905 1.00 0.00 C ATOM 215 OE1 GLN A 186 1.891 7.385 -4.641 1.00 0.00 O ATOM 216 NE2 GLN A 186 2.789 7.564 -2.664 1.00 0.00 N ATOM 0 H GLN A 186 5.399 4.038 -3.537 1.00 0.00 H new ATOM 0 HA GLN A 186 2.651 4.654 -3.191 1.00 0.00 H new ATOM 0 HB2 GLN A 186 4.514 4.701 -5.600 1.00 0.00 H new ATOM 0 HB3 GLN A 186 2.850 5.240 -5.712 1.00 0.00 H new ATOM 0 HG2 GLN A 186 4.793 6.314 -3.609 1.00 0.00 H new ATOM 0 HG3 GLN A 186 4.579 7.074 -5.174 1.00 0.00 H new ATOM 0 HE21 GLN A 186 3.580 7.389 -2.045 1.00 0.00 H new ATOM 0 HE22 GLN A 186 1.962 8.044 -2.310 1.00 0.00 H new ATOM 225 N PHE A 187 3.263 2.007 -5.041 1.00 0.00 N ATOM 226 CA PHE A 187 2.597 0.841 -5.673 1.00 0.00 C ATOM 227 C PHE A 187 1.744 0.116 -4.633 1.00 0.00 C ATOM 228 O PHE A 187 0.602 -0.222 -4.883 1.00 0.00 O ATOM 229 CB PHE A 187 3.671 -0.100 -6.212 1.00 0.00 C ATOM 230 CG PHE A 187 3.044 -1.114 -7.132 1.00 0.00 C ATOM 231 CD1 PHE A 187 2.298 -2.173 -6.604 1.00 0.00 C ATOM 232 CD2 PHE A 187 3.230 -1.006 -8.516 1.00 0.00 C ATOM 233 CE1 PHE A 187 1.736 -3.123 -7.457 1.00 0.00 C ATOM 234 CE2 PHE A 187 2.671 -1.961 -9.368 1.00 0.00 C ATOM 235 CZ PHE A 187 1.923 -3.019 -8.837 1.00 0.00 C ATOM 0 H PHE A 187 4.283 1.991 -5.067 1.00 0.00 H new ATOM 0 HA PHE A 187 1.954 1.172 -6.489 1.00 0.00 H new ATOM 0 HB2 PHE A 187 4.431 0.469 -6.747 1.00 0.00 H new ATOM 0 HB3 PHE A 187 4.173 -0.605 -5.387 1.00 0.00 H new ATOM 0 HD1 PHE A 187 2.157 -2.255 -5.536 1.00 0.00 H new ATOM 0 HD2 PHE A 187 3.804 -0.187 -8.923 1.00 0.00 H new ATOM 0 HE1 PHE A 187 1.157 -3.939 -7.050 1.00 0.00 H new ATOM 0 HE2 PHE A 187 2.815 -1.884 -10.435 1.00 0.00 H new ATOM 0 HZ PHE A 187 1.490 -3.756 -9.496 1.00 0.00 H new ATOM 245 N LEU A 188 2.286 -0.126 -3.469 1.00 0.00 N ATOM 246 CA LEU A 188 1.508 -0.825 -2.402 1.00 0.00 C ATOM 247 C LEU A 188 0.264 0.003 -2.063 1.00 0.00 C ATOM 248 O LEU A 188 -0.837 -0.507 -1.998 1.00 0.00 O ATOM 249 CB LEU A 188 2.388 -0.965 -1.157 1.00 0.00 C ATOM 250 CG LEU A 188 1.632 -1.692 -0.032 1.00 0.00 C ATOM 251 CD1 LEU A 188 1.292 -3.128 -0.464 1.00 0.00 C ATOM 252 CD2 LEU A 188 2.522 -1.711 1.221 1.00 0.00 C ATOM 0 H LEU A 188 3.238 0.131 -3.209 1.00 0.00 H new ATOM 0 HA LEU A 188 1.202 -1.813 -2.747 1.00 0.00 H new ATOM 0 HB2 LEU A 188 3.295 -1.516 -1.407 1.00 0.00 H new ATOM 0 HB3 LEU A 188 2.699 0.022 -0.813 1.00 0.00 H new ATOM 0 HG LEU A 188 0.699 -1.172 0.185 1.00 0.00 H new ATOM 0 HD11 LEU A 188 0.757 -3.633 0.340 1.00 0.00 H new ATOM 0 HD12 LEU A 188 0.666 -3.101 -1.356 1.00 0.00 H new ATOM 0 HD13 LEU A 188 2.212 -3.669 -0.683 1.00 0.00 H new ATOM 0 HD21 LEU A 188 2.001 -2.223 2.030 1.00 0.00 H new ATOM 0 HD22 LEU A 188 3.452 -2.235 0.999 1.00 0.00 H new ATOM 0 HD23 LEU A 188 2.745 -0.688 1.524 1.00 0.00 H new ATOM 264 N ILE A 189 0.443 1.281 -1.832 1.00 0.00 N ATOM 265 CA ILE A 189 -0.715 2.165 -1.480 1.00 0.00 C ATOM 266 C ILE A 189 -1.729 2.210 -2.633 1.00 0.00 C ATOM 267 O ILE A 189 -2.926 2.220 -2.416 1.00 0.00 O ATOM 268 CB ILE A 189 -0.213 3.590 -1.217 1.00 0.00 C ATOM 269 CG1 ILE A 189 0.805 3.580 -0.058 1.00 0.00 C ATOM 270 CG2 ILE A 189 -1.409 4.488 -0.869 1.00 0.00 C ATOM 271 CD1 ILE A 189 0.196 2.994 1.218 1.00 0.00 C ATOM 0 H ILE A 189 1.346 1.753 -1.872 1.00 0.00 H new ATOM 0 HA ILE A 189 -1.196 1.761 -0.589 1.00 0.00 H new ATOM 0 HB ILE A 189 0.280 3.978 -2.108 1.00 0.00 H new ATOM 0 HG12 ILE A 189 1.680 2.997 -0.346 1.00 0.00 H new ATOM 0 HG13 ILE A 189 1.148 4.596 0.135 1.00 0.00 H new ATOM 0 HG21 ILE A 189 -1.059 5.503 -0.681 1.00 0.00 H new ATOM 0 HG22 ILE A 189 -2.113 4.495 -1.701 1.00 0.00 H new ATOM 0 HG23 ILE A 189 -1.905 4.104 0.022 1.00 0.00 H new ATOM 0 HD11 ILE A 189 0.941 3.002 2.014 1.00 0.00 H new ATOM 0 HD12 ILE A 189 -0.664 3.593 1.519 1.00 0.00 H new ATOM 0 HD13 ILE A 189 -0.124 1.969 1.031 1.00 0.00 H new ATOM 283 N ALA A 190 -1.261 2.265 -3.853 1.00 0.00 N ATOM 284 CA ALA A 190 -2.194 2.340 -5.020 1.00 0.00 C ATOM 285 C ALA A 190 -3.091 1.100 -5.088 1.00 0.00 C ATOM 286 O ALA A 190 -4.263 1.202 -5.371 1.00 0.00 O ATOM 287 CB ALA A 190 -1.372 2.432 -6.305 1.00 0.00 C ATOM 0 H ALA A 190 -0.270 2.261 -4.093 1.00 0.00 H new ATOM 0 HA ALA A 190 -2.828 3.219 -4.904 1.00 0.00 H new ATOM 0 HB1 ALA A 190 -2.042 2.487 -7.163 1.00 0.00 H new ATOM 0 HB2 ALA A 190 -0.748 3.325 -6.274 1.00 0.00 H new ATOM 0 HB3 ALA A 190 -0.739 1.550 -6.396 1.00 0.00 H new ATOM 293 N ASP A 191 -2.562 -0.067 -4.834 1.00 0.00 N ATOM 294 CA ASP A 191 -3.418 -1.293 -4.900 1.00 0.00 C ATOM 295 C ASP A 191 -4.405 -1.283 -3.737 1.00 0.00 C ATOM 296 O ASP A 191 -5.561 -1.628 -3.890 1.00 0.00 O ATOM 297 CB ASP A 191 -2.532 -2.544 -4.831 1.00 0.00 C ATOM 298 CG ASP A 191 -1.735 -2.679 -6.136 1.00 0.00 C ATOM 299 OD1 ASP A 191 -2.319 -3.093 -7.125 1.00 0.00 O ATOM 300 OD2 ASP A 191 -0.555 -2.366 -6.125 1.00 0.00 O ATOM 0 H ASP A 191 -1.586 -0.227 -4.586 1.00 0.00 H new ATOM 0 HA ASP A 191 -3.972 -1.305 -5.839 1.00 0.00 H new ATOM 0 HB2 ASP A 191 -1.852 -2.474 -3.982 1.00 0.00 H new ATOM 0 HB3 ASP A 191 -3.147 -3.430 -4.675 1.00 0.00 H new ATOM 305 N TYR A 192 -3.967 -0.874 -2.581 1.00 0.00 N ATOM 306 CA TYR A 192 -4.884 -0.819 -1.409 1.00 0.00 C ATOM 307 C TYR A 192 -6.048 0.125 -1.713 1.00 0.00 C ATOM 308 O TYR A 192 -7.170 -0.103 -1.307 1.00 0.00 O ATOM 309 CB TYR A 192 -4.135 -0.320 -0.178 1.00 0.00 C ATOM 310 CG TYR A 192 -5.037 -0.432 1.034 1.00 0.00 C ATOM 311 CD1 TYR A 192 -5.911 0.616 1.359 1.00 0.00 C ATOM 312 CD2 TYR A 192 -5.002 -1.585 1.834 1.00 0.00 C ATOM 313 CE1 TYR A 192 -6.746 0.512 2.480 1.00 0.00 C ATOM 314 CE2 TYR A 192 -5.839 -1.686 2.957 1.00 0.00 C ATOM 315 CZ TYR A 192 -6.709 -0.640 3.279 1.00 0.00 C ATOM 316 OH TYR A 192 -7.528 -0.738 4.388 1.00 0.00 O ATOM 0 H TYR A 192 -3.010 -0.574 -2.396 1.00 0.00 H new ATOM 0 HA TYR A 192 -5.266 -1.821 -1.212 1.00 0.00 H new ATOM 0 HB2 TYR A 192 -3.229 -0.906 -0.027 1.00 0.00 H new ATOM 0 HB3 TYR A 192 -3.825 0.715 -0.321 1.00 0.00 H new ATOM 0 HD1 TYR A 192 -5.941 1.504 0.745 1.00 0.00 H new ATOM 0 HD2 TYR A 192 -4.331 -2.394 1.586 1.00 0.00 H new ATOM 0 HE1 TYR A 192 -7.418 1.320 2.729 1.00 0.00 H new ATOM 0 HE2 TYR A 192 -5.811 -2.573 3.573 1.00 0.00 H new ATOM 0 HH TYR A 192 -7.379 -1.600 4.830 1.00 0.00 H new ATOM 326 N LEU A 193 -5.784 1.210 -2.393 1.00 0.00 N ATOM 327 CA LEU A 193 -6.875 2.186 -2.690 1.00 0.00 C ATOM 328 C LEU A 193 -7.726 1.726 -3.875 1.00 0.00 C ATOM 329 O LEU A 193 -8.724 2.338 -4.185 1.00 0.00 O ATOM 330 CB LEU A 193 -6.268 3.547 -3.018 1.00 0.00 C ATOM 331 CG LEU A 193 -5.542 4.090 -1.785 1.00 0.00 C ATOM 332 CD1 LEU A 193 -4.728 5.314 -2.185 1.00 0.00 C ATOM 333 CD2 LEU A 193 -6.550 4.489 -0.688 1.00 0.00 C ATOM 0 H LEU A 193 -4.864 1.462 -2.754 1.00 0.00 H new ATOM 0 HA LEU A 193 -7.512 2.255 -1.809 1.00 0.00 H new ATOM 0 HB2 LEU A 193 -5.573 3.456 -3.852 1.00 0.00 H new ATOM 0 HB3 LEU A 193 -7.049 4.241 -3.329 1.00 0.00 H new ATOM 0 HG LEU A 193 -4.888 3.311 -1.392 1.00 0.00 H new ATOM 0 HD11 LEU A 193 -4.208 5.706 -1.311 1.00 0.00 H new ATOM 0 HD12 LEU A 193 -3.999 5.034 -2.946 1.00 0.00 H new ATOM 0 HD13 LEU A 193 -5.394 6.079 -2.585 1.00 0.00 H new ATOM 0 HD21 LEU A 193 -6.012 4.872 0.179 1.00 0.00 H new ATOM 0 HD22 LEU A 193 -7.218 5.261 -1.071 1.00 0.00 H new ATOM 0 HD23 LEU A 193 -7.134 3.616 -0.396 1.00 0.00 H new ATOM 345 N ARG A 194 -7.369 0.664 -4.539 1.00 0.00 N ATOM 346 CA ARG A 194 -8.210 0.211 -5.688 1.00 0.00 C ATOM 347 C ARG A 194 -9.484 -0.460 -5.139 1.00 0.00 C ATOM 348 O ARG A 194 -9.471 -1.029 -4.067 1.00 0.00 O ATOM 349 CB ARG A 194 -7.421 -0.792 -6.551 1.00 0.00 C ATOM 350 CG ARG A 194 -6.474 -0.050 -7.507 1.00 0.00 C ATOM 351 CD ARG A 194 -5.723 -1.069 -8.385 1.00 0.00 C ATOM 352 NE ARG A 194 -4.367 -0.546 -8.743 1.00 0.00 N ATOM 353 CZ ARG A 194 -4.208 0.660 -9.219 1.00 0.00 C ATOM 354 NH1 ARG A 194 -5.241 1.390 -9.556 1.00 0.00 N ATOM 355 NH2 ARG A 194 -2.999 1.112 -9.425 1.00 0.00 N ATOM 0 H ARG A 194 -6.545 0.095 -4.343 1.00 0.00 H new ATOM 0 HA ARG A 194 -8.481 1.067 -6.306 1.00 0.00 H new ATOM 0 HB2 ARG A 194 -6.848 -1.462 -5.909 1.00 0.00 H new ATOM 0 HB3 ARG A 194 -8.112 -1.412 -7.122 1.00 0.00 H new ATOM 0 HG2 ARG A 194 -7.040 0.638 -8.135 1.00 0.00 H new ATOM 0 HG3 ARG A 194 -5.763 0.549 -6.938 1.00 0.00 H new ATOM 0 HD2 ARG A 194 -5.626 -2.016 -7.854 1.00 0.00 H new ATOM 0 HD3 ARG A 194 -6.294 -1.269 -9.292 1.00 0.00 H new ATOM 0 HE ARG A 194 -3.551 -1.143 -8.613 1.00 0.00 H new ATOM 0 HH11 ARG A 194 -6.185 1.019 -9.448 1.00 0.00 H new ATOM 0 HH12 ARG A 194 -5.102 2.330 -9.926 1.00 0.00 H new ATOM 0 HH21 ARG A 194 -2.192 0.525 -9.214 1.00 0.00 H new ATOM 0 HH22 ARG A 194 -2.862 2.052 -9.796 1.00 0.00 H new ATOM 369 N PRO A 195 -10.578 -0.403 -5.866 1.00 0.00 N ATOM 370 CA PRO A 195 -11.857 -1.027 -5.424 1.00 0.00 C ATOM 371 C PRO A 195 -11.721 -2.554 -5.385 1.00 0.00 C ATOM 372 O PRO A 195 -12.629 -3.260 -4.998 1.00 0.00 O ATOM 373 CB PRO A 195 -12.873 -0.582 -6.494 1.00 0.00 C ATOM 374 CG PRO A 195 -12.051 -0.283 -7.704 1.00 0.00 C ATOM 375 CD PRO A 195 -10.719 0.249 -7.177 1.00 0.00 C ATOM 0 HA PRO A 195 -12.156 -0.727 -4.420 1.00 0.00 H new ATOM 0 HB2 PRO A 195 -13.603 -1.366 -6.696 1.00 0.00 H new ATOM 0 HB3 PRO A 195 -13.431 0.296 -6.168 1.00 0.00 H new ATOM 0 HG2 PRO A 195 -11.904 -1.178 -8.308 1.00 0.00 H new ATOM 0 HG3 PRO A 195 -12.543 0.453 -8.340 1.00 0.00 H new ATOM 0 HD2 PRO A 195 -9.894 -0.007 -7.842 1.00 0.00 H new ATOM 0 HD3 PRO A 195 -10.730 1.335 -7.085 1.00 0.00 H new ATOM 383 N GLU A 196 -10.579 -3.058 -5.788 1.00 0.00 N ATOM 384 CA GLU A 196 -10.361 -4.531 -5.781 1.00 0.00 C ATOM 385 C GLU A 196 -10.382 -5.023 -4.336 1.00 0.00 C ATOM 386 O GLU A 196 -10.880 -6.090 -4.046 1.00 0.00 O ATOM 387 CB GLU A 196 -9.009 -4.879 -6.423 1.00 0.00 C ATOM 388 CG GLU A 196 -9.051 -4.617 -7.935 1.00 0.00 C ATOM 389 CD GLU A 196 -7.662 -4.853 -8.540 1.00 0.00 C ATOM 390 OE1 GLU A 196 -7.177 -5.967 -8.434 1.00 0.00 O ATOM 391 OE2 GLU A 196 -7.111 -3.922 -9.106 1.00 0.00 O ATOM 0 H GLU A 196 -9.788 -2.507 -6.122 1.00 0.00 H new ATOM 0 HA GLU A 196 -11.151 -5.014 -6.356 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -8.218 -4.284 -5.966 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -8.769 -5.926 -6.235 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -9.780 -5.275 -8.408 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -9.373 -3.594 -8.128 1.00 0.00 H new ATOM 398 N LYS A 197 -9.839 -4.245 -3.433 1.00 0.00 N ATOM 399 CA LYS A 197 -9.821 -4.646 -1.994 1.00 0.00 C ATOM 400 C LYS A 197 -9.099 -5.981 -1.821 1.00 0.00 C ATOM 401 O LYS A 197 -9.665 -6.929 -1.309 1.00 0.00 O ATOM 402 CB LYS A 197 -11.249 -4.811 -1.466 1.00 0.00 C ATOM 403 CG LYS A 197 -12.088 -3.574 -1.772 1.00 0.00 C ATOM 404 CD LYS A 197 -13.564 -3.900 -1.521 1.00 0.00 C ATOM 405 CE LYS A 197 -14.382 -2.616 -1.599 1.00 0.00 C ATOM 406 NZ LYS A 197 -14.120 -1.954 -2.901 1.00 0.00 N ATOM 0 H LYS A 197 -9.405 -3.344 -3.633 1.00 0.00 H new ATOM 0 HA LYS A 197 -9.303 -3.863 -1.440 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -11.709 -5.689 -1.919 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -11.226 -4.983 -0.390 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -11.774 -2.741 -1.143 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -11.941 -3.266 -2.807 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -13.921 -4.618 -2.260 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -13.685 -4.363 -0.542 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -15.444 -2.840 -1.497 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -14.116 -1.950 -0.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -15.001 -1.536 -3.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -13.409 -1.206 -2.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -13.766 -2.656 -3.582 1.00 0.00 H new ATOM 420 N PRO A 198 -7.859 -6.055 -2.228 1.00 0.00 N ATOM 421 CA PRO A 198 -7.045 -7.296 -2.098 1.00 0.00 C ATOM 422 C PRO A 198 -6.597 -7.503 -0.650 1.00 0.00 C ATOM 423 O PRO A 198 -6.546 -6.569 0.122 1.00 0.00 O ATOM 424 CB PRO A 198 -5.839 -7.026 -3.011 1.00 0.00 C ATOM 425 CG PRO A 198 -5.679 -5.539 -2.999 1.00 0.00 C ATOM 426 CD PRO A 198 -7.094 -4.963 -2.856 1.00 0.00 C ATOM 0 HA PRO A 198 -7.593 -8.197 -2.372 1.00 0.00 H new ATOM 0 HB2 PRO A 198 -4.943 -7.524 -2.641 1.00 0.00 H new ATOM 0 HB3 PRO A 198 -6.016 -7.397 -4.021 1.00 0.00 H new ATOM 0 HG2 PRO A 198 -5.043 -5.222 -2.173 1.00 0.00 H new ATOM 0 HG3 PRO A 198 -5.206 -5.190 -3.917 1.00 0.00 H new ATOM 0 HD2 PRO A 198 -7.099 -4.065 -2.238 1.00 0.00 H new ATOM 0 HD3 PRO A 198 -7.513 -4.687 -3.824 1.00 0.00 H new ATOM 434 N ALA A 199 -6.261 -8.706 -0.275 1.00 0.00 N ATOM 435 CA ALA A 199 -5.808 -8.935 1.124 1.00 0.00 C ATOM 436 C ALA A 199 -4.475 -8.203 1.319 1.00 0.00 C ATOM 437 O ALA A 199 -3.620 -8.223 0.458 1.00 0.00 O ATOM 438 CB ALA A 199 -5.629 -10.451 1.362 1.00 0.00 C ATOM 0 H ALA A 199 -6.280 -9.533 -0.871 1.00 0.00 H new ATOM 0 HA ALA A 199 -6.543 -8.557 1.835 1.00 0.00 H new ATOM 0 HB1 ALA A 199 -5.297 -10.622 2.386 1.00 0.00 H new ATOM 0 HB2 ALA A 199 -6.579 -10.960 1.199 1.00 0.00 H new ATOM 0 HB3 ALA A 199 -4.884 -10.843 0.669 1.00 0.00 H new ATOM 444 N PHE A 200 -4.284 -7.559 2.435 1.00 0.00 N ATOM 445 CA PHE A 200 -2.992 -6.849 2.653 1.00 0.00 C ATOM 446 C PHE A 200 -1.852 -7.863 2.594 1.00 0.00 C ATOM 447 O PHE A 200 -0.799 -7.605 2.043 1.00 0.00 O ATOM 448 CB PHE A 200 -2.991 -6.196 4.033 1.00 0.00 C ATOM 449 CG PHE A 200 -1.677 -5.487 4.249 1.00 0.00 C ATOM 450 CD1 PHE A 200 -1.361 -4.364 3.481 1.00 0.00 C ATOM 451 CD2 PHE A 200 -0.770 -5.951 5.214 1.00 0.00 C ATOM 452 CE1 PHE A 200 -0.149 -3.703 3.673 1.00 0.00 C ATOM 453 CE2 PHE A 200 0.450 -5.286 5.406 1.00 0.00 C ATOM 454 CZ PHE A 200 0.758 -4.161 4.633 1.00 0.00 C ATOM 0 H PHE A 200 -4.957 -7.493 3.198 1.00 0.00 H new ATOM 0 HA PHE A 200 -2.864 -6.087 1.884 1.00 0.00 H new ATOM 0 HB2 PHE A 200 -3.816 -5.489 4.114 1.00 0.00 H new ATOM 0 HB3 PHE A 200 -3.141 -6.951 4.805 1.00 0.00 H new ATOM 0 HD1 PHE A 200 -2.057 -4.007 2.737 1.00 0.00 H new ATOM 0 HD2 PHE A 200 -1.011 -6.820 5.809 1.00 0.00 H new ATOM 0 HE1 PHE A 200 0.090 -2.834 3.078 1.00 0.00 H new ATOM 0 HE2 PHE A 200 1.150 -5.641 6.148 1.00 0.00 H new ATOM 0 HZ PHE A 200 1.696 -3.647 4.778 1.00 0.00 H new ATOM 464 N ARG A 201 -2.052 -9.014 3.178 1.00 0.00 N ATOM 465 CA ARG A 201 -0.980 -10.044 3.177 1.00 0.00 C ATOM 466 C ARG A 201 -0.754 -10.557 1.748 1.00 0.00 C ATOM 467 O ARG A 201 0.364 -10.771 1.325 1.00 0.00 O ATOM 468 CB ARG A 201 -1.392 -11.204 4.092 1.00 0.00 C ATOM 469 CG ARG A 201 -1.499 -10.698 5.539 1.00 0.00 C ATOM 470 CD ARG A 201 -1.887 -11.850 6.479 1.00 0.00 C ATOM 471 NE ARG A 201 -0.751 -12.812 6.613 1.00 0.00 N ATOM 472 CZ ARG A 201 -0.709 -13.649 7.620 1.00 0.00 C ATOM 473 NH1 ARG A 201 -1.660 -13.654 8.514 1.00 0.00 N ATOM 474 NH2 ARG A 201 0.292 -14.481 7.736 1.00 0.00 N ATOM 0 H ARG A 201 -2.912 -9.283 3.655 1.00 0.00 H new ATOM 0 HA ARG A 201 -0.052 -9.606 3.545 1.00 0.00 H new ATOM 0 HB2 ARG A 201 -2.347 -11.616 3.767 1.00 0.00 H new ATOM 0 HB3 ARG A 201 -0.660 -12.009 4.030 1.00 0.00 H new ATOM 0 HG2 ARG A 201 -0.548 -10.268 5.853 1.00 0.00 H new ATOM 0 HG3 ARG A 201 -2.243 -9.904 5.600 1.00 0.00 H new ATOM 0 HD2 ARG A 201 -2.156 -11.455 7.459 1.00 0.00 H new ATOM 0 HD3 ARG A 201 -2.766 -12.365 6.091 1.00 0.00 H new ATOM 0 HE ARG A 201 -0.005 -12.817 5.917 1.00 0.00 H new ATOM 0 HH11 ARG A 201 -2.442 -13.004 8.431 1.00 0.00 H new ATOM 0 HH12 ARG A 201 -1.622 -14.308 9.296 1.00 0.00 H new ATOM 0 HH21 ARG A 201 1.040 -14.479 7.043 1.00 0.00 H new ATOM 0 HH22 ARG A 201 0.325 -15.133 8.520 1.00 0.00 H new ATOM 488 N LYS A 202 -1.810 -10.746 0.997 1.00 0.00 N ATOM 489 CA LYS A 202 -1.664 -11.239 -0.410 1.00 0.00 C ATOM 490 C LYS A 202 -1.087 -10.128 -1.291 1.00 0.00 C ATOM 491 O LYS A 202 -0.259 -10.367 -2.146 1.00 0.00 O ATOM 492 CB LYS A 202 -3.044 -11.632 -0.946 1.00 0.00 C ATOM 493 CG LYS A 202 -2.911 -12.346 -2.295 1.00 0.00 C ATOM 494 CD LYS A 202 -4.310 -12.708 -2.792 1.00 0.00 C ATOM 495 CE LYS A 202 -4.238 -13.264 -4.217 1.00 0.00 C ATOM 496 NZ LYS A 202 -3.587 -14.600 -4.193 1.00 0.00 N ATOM 0 H LYS A 202 -2.771 -10.580 1.297 1.00 0.00 H new ATOM 0 HA LYS A 202 -0.994 -12.099 -0.425 1.00 0.00 H new ATOM 0 HB2 LYS A 202 -3.547 -12.283 -0.231 1.00 0.00 H new ATOM 0 HB3 LYS A 202 -3.664 -10.743 -1.058 1.00 0.00 H new ATOM 0 HG2 LYS A 202 -2.408 -11.702 -3.016 1.00 0.00 H new ATOM 0 HG3 LYS A 202 -2.302 -13.244 -2.190 1.00 0.00 H new ATOM 0 HD2 LYS A 202 -4.760 -13.446 -2.128 1.00 0.00 H new ATOM 0 HD3 LYS A 202 -4.951 -11.827 -2.770 1.00 0.00 H new ATOM 0 HE2 LYS A 202 -5.240 -13.343 -4.640 1.00 0.00 H new ATOM 0 HE3 LYS A 202 -3.675 -12.584 -4.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 202 -3.658 -15.038 -5.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 202 -2.585 -14.493 -3.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 202 -4.062 -15.205 -3.493 1.00 0.00 H new ATOM 510 N CYS A 203 -1.521 -8.911 -1.091 1.00 0.00 N ATOM 511 CA CYS A 203 -0.995 -7.790 -1.924 1.00 0.00 C ATOM 512 C CYS A 203 0.511 -7.635 -1.694 1.00 0.00 C ATOM 513 O CYS A 203 1.272 -7.448 -2.620 1.00 0.00 O ATOM 514 CB CYS A 203 -1.709 -6.488 -1.552 1.00 0.00 C ATOM 515 SG CYS A 203 -0.997 -5.784 -0.043 1.00 0.00 S ATOM 0 H CYS A 203 -2.213 -8.646 -0.391 1.00 0.00 H new ATOM 0 HA CYS A 203 -1.177 -8.012 -2.976 1.00 0.00 H new ATOM 0 HB2 CYS A 203 -1.623 -5.773 -2.370 1.00 0.00 H new ATOM 0 HB3 CYS A 203 -2.772 -6.678 -1.405 1.00 0.00 H new ATOM 0 HG CYS A 203 -0.824 -6.726 0.836 1.00 0.00 H new ATOM 521 N TYR A 204 0.947 -7.698 -0.465 1.00 0.00 N ATOM 522 CA TYR A 204 2.406 -7.543 -0.190 1.00 0.00 C ATOM 523 C TYR A 204 3.177 -8.641 -0.920 1.00 0.00 C ATOM 524 O TYR A 204 4.211 -8.395 -1.510 1.00 0.00 O ATOM 525 CB TYR A 204 2.667 -7.659 1.308 1.00 0.00 C ATOM 526 CG TYR A 204 4.119 -7.354 1.608 1.00 0.00 C ATOM 527 CD1 TYR A 204 5.088 -8.359 1.469 1.00 0.00 C ATOM 528 CD2 TYR A 204 4.492 -6.076 2.049 1.00 0.00 C ATOM 529 CE1 TYR A 204 6.426 -8.086 1.770 1.00 0.00 C ATOM 530 CE2 TYR A 204 5.832 -5.808 2.355 1.00 0.00 C ATOM 531 CZ TYR A 204 6.796 -6.813 2.216 1.00 0.00 C ATOM 532 OH TYR A 204 8.112 -6.551 2.529 1.00 0.00 O ATOM 0 H TYR A 204 0.361 -7.849 0.356 1.00 0.00 H new ATOM 0 HA TYR A 204 2.734 -6.564 -0.539 1.00 0.00 H new ATOM 0 HB2 TYR A 204 2.022 -6.969 1.852 1.00 0.00 H new ATOM 0 HB3 TYR A 204 2.420 -8.664 1.651 1.00 0.00 H new ATOM 0 HD1 TYR A 204 4.801 -9.343 1.130 1.00 0.00 H new ATOM 0 HD2 TYR A 204 3.748 -5.300 2.152 1.00 0.00 H new ATOM 0 HE1 TYR A 204 7.173 -8.858 1.658 1.00 0.00 H new ATOM 0 HE2 TYR A 204 6.122 -4.826 2.698 1.00 0.00 H new ATOM 0 HH TYR A 204 8.154 -5.827 3.188 1.00 0.00 H new ATOM 542 N GLU A 205 2.689 -9.853 -0.892 1.00 0.00 N ATOM 543 CA GLU A 205 3.405 -10.947 -1.599 1.00 0.00 C ATOM 544 C GLU A 205 3.489 -10.596 -3.079 1.00 0.00 C ATOM 545 O GLU A 205 4.511 -10.758 -3.713 1.00 0.00 O ATOM 546 CB GLU A 205 2.631 -12.252 -1.438 1.00 0.00 C ATOM 547 CG GLU A 205 2.723 -12.735 0.009 1.00 0.00 C ATOM 548 CD GLU A 205 1.836 -13.970 0.176 1.00 0.00 C ATOM 549 OE1 GLU A 205 0.739 -13.960 -0.359 1.00 0.00 O ATOM 550 OE2 GLU A 205 2.266 -14.905 0.831 1.00 0.00 O ATOM 0 H GLU A 205 1.832 -10.128 -0.413 1.00 0.00 H new ATOM 0 HA GLU A 205 4.405 -11.066 -1.181 1.00 0.00 H new ATOM 0 HB2 GLU A 205 1.587 -12.103 -1.715 1.00 0.00 H new ATOM 0 HB3 GLU A 205 3.034 -13.010 -2.110 1.00 0.00 H new ATOM 0 HG2 GLU A 205 3.756 -12.976 0.261 1.00 0.00 H new ATOM 0 HG3 GLU A 205 2.404 -11.947 0.691 1.00 0.00 H new ATOM 557 N ARG A 206 2.419 -10.102 -3.635 1.00 0.00 N ATOM 558 CA ARG A 206 2.446 -9.730 -5.068 1.00 0.00 C ATOM 559 C ARG A 206 3.469 -8.608 -5.255 1.00 0.00 C ATOM 560 O ARG A 206 4.217 -8.577 -6.212 1.00 0.00 O ATOM 561 CB ARG A 206 1.060 -9.235 -5.473 1.00 0.00 C ATOM 562 CG ARG A 206 0.073 -10.416 -5.483 1.00 0.00 C ATOM 563 CD ARG A 206 -1.329 -9.910 -5.825 1.00 0.00 C ATOM 564 NE ARG A 206 -1.322 -9.351 -7.210 1.00 0.00 N ATOM 565 CZ ARG A 206 -2.451 -9.101 -7.826 1.00 0.00 C ATOM 566 NH1 ARG A 206 -3.594 -9.324 -7.221 1.00 0.00 N ATOM 567 NH2 ARG A 206 -2.437 -8.638 -9.052 1.00 0.00 N ATOM 0 H ARG A 206 1.532 -9.942 -3.158 1.00 0.00 H new ATOM 0 HA ARG A 206 2.719 -10.587 -5.684 1.00 0.00 H new ATOM 0 HB2 ARG A 206 0.719 -8.469 -4.777 1.00 0.00 H new ATOM 0 HB3 ARG A 206 1.101 -8.774 -6.460 1.00 0.00 H new ATOM 0 HG2 ARG A 206 0.390 -11.161 -6.213 1.00 0.00 H new ATOM 0 HG3 ARG A 206 0.066 -10.906 -4.509 1.00 0.00 H new ATOM 0 HD2 ARG A 206 -2.051 -10.723 -5.751 1.00 0.00 H new ATOM 0 HD3 ARG A 206 -1.637 -9.145 -5.112 1.00 0.00 H new ATOM 0 HE ARG A 206 -0.435 -9.163 -7.678 1.00 0.00 H new ATOM 0 HH11 ARG A 206 -3.604 -9.692 -6.270 1.00 0.00 H new ATOM 0 HH12 ARG A 206 -4.472 -9.129 -7.702 1.00 0.00 H new ATOM 0 HH21 ARG A 206 -1.548 -8.473 -9.525 1.00 0.00 H new ATOM 0 HH22 ARG A 206 -3.315 -8.443 -9.533 1.00 0.00 H new ATOM 581 N LEU A 207 3.505 -7.688 -4.333 1.00 0.00 N ATOM 582 CA LEU A 207 4.468 -6.559 -4.433 1.00 0.00 C ATOM 583 C LEU A 207 5.891 -7.104 -4.450 1.00 0.00 C ATOM 584 O LEU A 207 6.749 -6.620 -5.164 1.00 0.00 O ATOM 585 CB LEU A 207 4.295 -5.648 -3.219 1.00 0.00 C ATOM 586 CG LEU A 207 5.191 -4.399 -3.345 1.00 0.00 C ATOM 587 CD1 LEU A 207 4.516 -3.362 -4.246 1.00 0.00 C ATOM 588 CD2 LEU A 207 5.413 -3.783 -1.966 1.00 0.00 C ATOM 0 H LEU A 207 2.904 -7.670 -3.509 1.00 0.00 H new ATOM 0 HA LEU A 207 4.282 -5.999 -5.349 1.00 0.00 H new ATOM 0 HB2 LEU A 207 3.251 -5.346 -3.130 1.00 0.00 H new ATOM 0 HB3 LEU A 207 4.548 -6.193 -2.310 1.00 0.00 H new ATOM 0 HG LEU A 207 6.147 -4.695 -3.777 1.00 0.00 H new ATOM 0 HD11 LEU A 207 5.155 -2.483 -4.330 1.00 0.00 H new ATOM 0 HD12 LEU A 207 4.355 -3.790 -5.236 1.00 0.00 H new ATOM 0 HD13 LEU A 207 3.557 -3.074 -3.815 1.00 0.00 H new ATOM 0 HD21 LEU A 207 6.046 -2.901 -2.059 1.00 0.00 H new ATOM 0 HD22 LEU A 207 4.453 -3.497 -1.537 1.00 0.00 H new ATOM 0 HD23 LEU A 207 5.898 -4.511 -1.316 1.00 0.00 H new ATOM 600 N GLU A 208 6.160 -8.097 -3.657 1.00 0.00 N ATOM 601 CA GLU A 208 7.535 -8.643 -3.626 1.00 0.00 C ATOM 602 C GLU A 208 7.916 -9.098 -5.029 1.00 0.00 C ATOM 603 O GLU A 208 9.022 -8.873 -5.475 1.00 0.00 O ATOM 604 CB GLU A 208 7.578 -9.841 -2.681 1.00 0.00 C ATOM 605 CG GLU A 208 7.471 -9.359 -1.232 1.00 0.00 C ATOM 606 CD GLU A 208 7.507 -10.560 -0.287 1.00 0.00 C ATOM 607 OE1 GLU A 208 8.592 -11.051 -0.023 1.00 0.00 O ATOM 608 OE2 GLU A 208 6.446 -10.962 0.163 1.00 0.00 O ATOM 0 H GLU A 208 5.492 -8.550 -3.034 1.00 0.00 H new ATOM 0 HA GLU A 208 8.231 -7.879 -3.281 1.00 0.00 H new ATOM 0 HB2 GLU A 208 6.760 -10.525 -2.908 1.00 0.00 H new ATOM 0 HB3 GLU A 208 8.506 -10.395 -2.823 1.00 0.00 H new ATOM 0 HG2 GLU A 208 8.291 -8.679 -1.003 1.00 0.00 H new ATOM 0 HG3 GLU A 208 6.545 -8.801 -1.091 1.00 0.00 H new ATOM 615 N LEU A 209 7.015 -9.704 -5.751 1.00 0.00 N ATOM 616 CA LEU A 209 7.373 -10.115 -7.130 1.00 0.00 C ATOM 617 C LEU A 209 7.731 -8.846 -7.909 1.00 0.00 C ATOM 618 O LEU A 209 8.686 -8.804 -8.658 1.00 0.00 O ATOM 619 CB LEU A 209 6.182 -10.810 -7.792 1.00 0.00 C ATOM 620 CG LEU A 209 5.903 -12.157 -7.099 1.00 0.00 C ATOM 621 CD1 LEU A 209 4.576 -12.724 -7.609 1.00 0.00 C ATOM 622 CD2 LEU A 209 7.042 -13.161 -7.376 1.00 0.00 C ATOM 0 H LEU A 209 6.066 -9.927 -5.451 1.00 0.00 H new ATOM 0 HA LEU A 209 8.212 -10.810 -7.118 1.00 0.00 H new ATOM 0 HB2 LEU A 209 5.300 -10.172 -7.733 1.00 0.00 H new ATOM 0 HB3 LEU A 209 6.388 -10.972 -8.850 1.00 0.00 H new ATOM 0 HG LEU A 209 5.845 -11.993 -6.023 1.00 0.00 H new ATOM 0 HD11 LEU A 209 4.376 -13.677 -7.120 1.00 0.00 H new ATOM 0 HD12 LEU A 209 3.771 -12.025 -7.384 1.00 0.00 H new ATOM 0 HD13 LEU A 209 4.635 -12.874 -8.687 1.00 0.00 H new ATOM 0 HD21 LEU A 209 6.824 -14.105 -6.877 1.00 0.00 H new ATOM 0 HD22 LEU A 209 7.126 -13.329 -8.450 1.00 0.00 H new ATOM 0 HD23 LEU A 209 7.982 -12.759 -6.997 1.00 0.00 H new ATOM 634 N ALA A 210 6.977 -7.794 -7.705 1.00 0.00 N ATOM 635 CA ALA A 210 7.275 -6.507 -8.397 1.00 0.00 C ATOM 636 C ALA A 210 8.616 -5.971 -7.888 1.00 0.00 C ATOM 637 O ALA A 210 9.428 -5.459 -8.634 1.00 0.00 O ATOM 638 CB ALA A 210 6.171 -5.499 -8.095 1.00 0.00 C ATOM 0 H ALA A 210 6.166 -7.774 -7.087 1.00 0.00 H new ATOM 0 HA ALA A 210 7.327 -6.667 -9.474 1.00 0.00 H new ATOM 0 HB1 ALA A 210 6.389 -4.558 -8.601 1.00 0.00 H new ATOM 0 HB2 ALA A 210 5.216 -5.888 -8.448 1.00 0.00 H new ATOM 0 HB3 ALA A 210 6.118 -5.329 -7.020 1.00 0.00 H new ATOM 644 N ALA A 211 8.854 -6.098 -6.615 1.00 0.00 N ATOM 645 CA ALA A 211 10.135 -5.621 -6.031 1.00 0.00 C ATOM 646 C ALA A 211 11.306 -6.329 -6.717 1.00 0.00 C ATOM 647 O ALA A 211 12.333 -5.737 -6.974 1.00 0.00 O ATOM 648 CB ALA A 211 10.152 -5.943 -4.538 1.00 0.00 C ATOM 0 H ALA A 211 8.208 -6.517 -5.946 1.00 0.00 H new ATOM 0 HA ALA A 211 10.228 -4.545 -6.179 1.00 0.00 H new ATOM 0 HB1 ALA A 211 11.089 -5.596 -4.102 1.00 0.00 H new ATOM 0 HB2 ALA A 211 9.316 -5.443 -4.048 1.00 0.00 H new ATOM 0 HB3 ALA A 211 10.063 -7.020 -4.397 1.00 0.00 H new ATOM 654 N ARG A 212 11.174 -7.594 -7.007 1.00 0.00 N ATOM 655 CA ARG A 212 12.302 -8.311 -7.663 1.00 0.00 C ATOM 656 C ARG A 212 12.560 -7.687 -9.040 1.00 0.00 C ATOM 657 O ARG A 212 13.686 -7.513 -9.456 1.00 0.00 O ATOM 658 CB ARG A 212 11.935 -9.795 -7.807 1.00 0.00 C ATOM 659 CG ARG A 212 13.134 -10.594 -8.361 1.00 0.00 C ATOM 660 CD ARG A 212 13.230 -10.472 -9.902 1.00 0.00 C ATOM 661 NE ARG A 212 13.497 -11.824 -10.508 1.00 0.00 N ATOM 662 CZ ARG A 212 14.415 -12.627 -10.017 1.00 0.00 C ATOM 663 NH1 ARG A 212 15.189 -12.232 -9.051 1.00 0.00 N ATOM 664 NH2 ARG A 212 14.580 -13.821 -10.521 1.00 0.00 N ATOM 0 H ARG A 212 10.344 -8.156 -6.821 1.00 0.00 H new ATOM 0 HA ARG A 212 13.207 -8.226 -7.061 1.00 0.00 H new ATOM 0 HB2 ARG A 212 11.637 -10.198 -6.839 1.00 0.00 H new ATOM 0 HB3 ARG A 212 11.079 -9.902 -8.474 1.00 0.00 H new ATOM 0 HG2 ARG A 212 14.056 -10.231 -7.907 1.00 0.00 H new ATOM 0 HG3 ARG A 212 13.034 -11.643 -8.083 1.00 0.00 H new ATOM 0 HD2 ARG A 212 12.303 -10.062 -10.301 1.00 0.00 H new ATOM 0 HD3 ARG A 212 14.027 -9.779 -10.172 1.00 0.00 H new ATOM 0 HE ARG A 212 12.954 -12.124 -11.318 1.00 0.00 H new ATOM 0 HH11 ARG A 212 15.087 -11.292 -8.668 1.00 0.00 H new ATOM 0 HH12 ARG A 212 15.899 -12.862 -8.676 1.00 0.00 H new ATOM 0 HH21 ARG A 212 13.996 -14.132 -11.297 1.00 0.00 H new ATOM 0 HH22 ARG A 212 15.293 -14.442 -10.138 1.00 0.00 H new ATOM 678 N GLU A 213 11.523 -7.350 -9.751 1.00 0.00 N ATOM 679 CA GLU A 213 11.709 -6.738 -11.103 1.00 0.00 C ATOM 680 C GLU A 213 12.482 -5.413 -11.001 1.00 0.00 C ATOM 681 O GLU A 213 13.423 -5.172 -11.732 1.00 0.00 O ATOM 682 CB GLU A 213 10.334 -6.480 -11.727 1.00 0.00 C ATOM 683 CG GLU A 213 10.498 -5.860 -13.123 1.00 0.00 C ATOM 684 CD GLU A 213 9.122 -5.617 -13.747 1.00 0.00 C ATOM 685 OE1 GLU A 213 8.143 -6.049 -13.164 1.00 0.00 O ATOM 686 OE2 GLU A 213 9.074 -5.005 -14.802 1.00 0.00 O ATOM 0 H GLU A 213 10.553 -7.470 -9.459 1.00 0.00 H new ATOM 0 HA GLU A 213 12.283 -7.425 -11.725 1.00 0.00 H new ATOM 0 HB2 GLU A 213 9.777 -7.414 -11.798 1.00 0.00 H new ATOM 0 HB3 GLU A 213 9.756 -5.812 -11.089 1.00 0.00 H new ATOM 0 HG2 GLU A 213 11.046 -4.921 -13.052 1.00 0.00 H new ATOM 0 HG3 GLU A 213 11.084 -6.523 -13.759 1.00 0.00 H new ATOM 693 N HIS A 214 12.069 -4.543 -10.118 1.00 0.00 N ATOM 694 CA HIS A 214 12.750 -3.221 -9.976 1.00 0.00 C ATOM 695 C HIS A 214 13.850 -3.294 -8.914 1.00 0.00 C ATOM 696 O HIS A 214 14.650 -2.390 -8.774 1.00 0.00 O ATOM 697 CB HIS A 214 11.714 -2.170 -9.564 1.00 0.00 C ATOM 698 CG HIS A 214 10.790 -1.895 -10.720 1.00 0.00 C ATOM 699 ND1 HIS A 214 11.119 -1.020 -11.747 1.00 0.00 N ATOM 700 CD2 HIS A 214 9.547 -2.384 -11.031 1.00 0.00 C ATOM 701 CE1 HIS A 214 10.092 -1.016 -12.622 1.00 0.00 C ATOM 702 NE2 HIS A 214 9.109 -1.830 -12.231 1.00 0.00 N ATOM 0 H HIS A 214 11.284 -4.692 -9.484 1.00 0.00 H new ATOM 0 HA HIS A 214 13.204 -2.950 -10.929 1.00 0.00 H new ATOM 0 HB2 HIS A 214 11.144 -2.523 -8.705 1.00 0.00 H new ATOM 0 HB3 HIS A 214 12.214 -1.251 -9.258 1.00 0.00 H new ATOM 0 HD2 HIS A 214 8.991 -3.092 -10.435 1.00 0.00 H new ATOM 0 HE1 HIS A 214 10.068 -0.427 -13.527 1.00 0.00 H new ATOM 0 HE2 HIS A 214 8.226 -2.008 -12.709 1.00 0.00 H new ATOM 710 N GLY A 215 13.897 -4.350 -8.154 1.00 0.00 N ATOM 711 CA GLY A 215 14.942 -4.452 -7.100 1.00 0.00 C ATOM 712 C GLY A 215 14.623 -3.458 -5.979 1.00 0.00 C ATOM 713 O GLY A 215 15.498 -3.001 -5.275 1.00 0.00 O ATOM 0 H GLY A 215 13.260 -5.144 -8.216 1.00 0.00 H new ATOM 0 HA2 GLY A 215 14.978 -5.467 -6.704 1.00 0.00 H new ATOM 0 HA3 GLY A 215 15.924 -4.240 -7.523 1.00 0.00 H new ATOM 717 N TRP A 216 13.373 -3.114 -5.816 1.00 0.00 N ATOM 718 CA TRP A 216 12.994 -2.145 -4.750 1.00 0.00 C ATOM 719 C TRP A 216 13.319 -2.707 -3.362 1.00 0.00 C ATOM 720 O TRP A 216 13.052 -3.853 -3.065 1.00 0.00 O ATOM 721 CB TRP A 216 11.477 -1.912 -4.788 1.00 0.00 C ATOM 722 CG TRP A 216 11.034 -1.157 -6.015 1.00 0.00 C ATOM 723 CD1 TRP A 216 11.714 -0.156 -6.633 1.00 0.00 C ATOM 724 CD2 TRP A 216 9.784 -1.309 -6.761 1.00 0.00 C ATOM 725 NE1 TRP A 216 10.959 0.313 -7.692 1.00 0.00 N ATOM 726 CE2 TRP A 216 9.772 -0.371 -7.819 1.00 0.00 C ATOM 727 CE3 TRP A 216 8.673 -2.165 -6.628 1.00 0.00 C ATOM 728 CZ2 TRP A 216 8.700 -0.279 -8.707 1.00 0.00 C ATOM 729 CZ3 TRP A 216 7.595 -2.073 -7.525 1.00 0.00 C ATOM 730 CH2 TRP A 216 7.609 -1.132 -8.561 1.00 0.00 C ATOM 0 H TRP A 216 12.597 -3.464 -6.378 1.00 0.00 H new ATOM 0 HA TRP A 216 13.549 -1.224 -4.926 1.00 0.00 H new ATOM 0 HB2 TRP A 216 10.965 -2.874 -4.754 1.00 0.00 H new ATOM 0 HB3 TRP A 216 11.176 -1.359 -3.898 1.00 0.00 H new ATOM 0 HD1 TRP A 216 12.687 0.213 -6.344 1.00 0.00 H new ATOM 0 HE1 TRP A 216 11.247 1.075 -8.306 1.00 0.00 H new ATOM 0 HE3 TRP A 216 8.650 -2.895 -5.833 1.00 0.00 H new ATOM 0 HZ2 TRP A 216 8.716 0.450 -9.504 1.00 0.00 H new ATOM 0 HZ3 TRP A 216 6.748 -2.734 -7.414 1.00 0.00 H new ATOM 0 HH2 TRP A 216 6.776 -1.068 -9.245 1.00 0.00 H new ATOM 741 N SER A 217 13.824 -1.877 -2.491 1.00 0.00 N ATOM 742 CA SER A 217 14.096 -2.317 -1.095 1.00 0.00 C ATOM 743 C SER A 217 12.819 -2.068 -0.299 1.00 0.00 C ATOM 744 O SER A 217 12.473 -0.938 -0.009 1.00 0.00 O ATOM 745 CB SER A 217 15.223 -1.472 -0.513 1.00 0.00 C ATOM 746 OG SER A 217 15.433 -1.835 0.844 1.00 0.00 O ATOM 0 H SER A 217 14.061 -0.905 -2.689 1.00 0.00 H new ATOM 0 HA SER A 217 14.387 -3.367 -1.060 1.00 0.00 H new ATOM 0 HB2 SER A 217 16.138 -1.621 -1.087 1.00 0.00 H new ATOM 0 HB3 SER A 217 14.972 -0.414 -0.583 1.00 0.00 H new ATOM 0 HG SER A 217 15.074 -1.136 1.429 1.00 0.00 H new ATOM 752 N ILE A 218 12.094 -3.101 0.030 1.00 0.00 N ATOM 753 CA ILE A 218 10.811 -2.907 0.778 1.00 0.00 C ATOM 754 C ILE A 218 11.048 -3.054 2.292 1.00 0.00 C ATOM 755 O ILE A 218 11.905 -3.804 2.718 1.00 0.00 O ATOM 756 CB ILE A 218 9.798 -3.955 0.295 1.00 0.00 C ATOM 757 CG1 ILE A 218 10.172 -5.345 0.847 1.00 0.00 C ATOM 758 CG2 ILE A 218 9.798 -3.982 -1.240 1.00 0.00 C ATOM 759 CD1 ILE A 218 9.296 -6.415 0.180 1.00 0.00 C ATOM 0 H ILE A 218 12.330 -4.070 -0.184 1.00 0.00 H new ATOM 0 HA ILE A 218 10.424 -1.905 0.591 1.00 0.00 H new ATOM 0 HB ILE A 218 8.803 -3.694 0.656 1.00 0.00 H new ATOM 0 HG12 ILE A 218 11.225 -5.552 0.657 1.00 0.00 H new ATOM 0 HG13 ILE A 218 10.033 -5.368 1.928 1.00 0.00 H new ATOM 0 HG21 ILE A 218 9.081 -4.724 -1.591 1.00 0.00 H new ATOM 0 HG22 ILE A 218 9.519 -3.000 -1.621 1.00 0.00 H new ATOM 0 HG23 ILE A 218 10.794 -4.242 -1.599 1.00 0.00 H new ATOM 0 HD11 ILE A 218 9.561 -7.397 0.571 1.00 0.00 H new ATOM 0 HD12 ILE A 218 8.247 -6.211 0.393 1.00 0.00 H new ATOM 0 HD13 ILE A 218 9.458 -6.398 -0.898 1.00 0.00 H new ATOM 771 N PRO A 219 10.284 -2.360 3.107 1.00 0.00 N ATOM 772 CA PRO A 219 10.422 -2.439 4.588 1.00 0.00 C ATOM 773 C PRO A 219 9.788 -3.717 5.138 1.00 0.00 C ATOM 774 O PRO A 219 9.218 -4.499 4.404 1.00 0.00 O ATOM 775 CB PRO A 219 9.654 -1.209 5.070 1.00 0.00 C ATOM 776 CG PRO A 219 8.569 -1.048 4.063 1.00 0.00 C ATOM 777 CD PRO A 219 9.204 -1.426 2.724 1.00 0.00 C ATOM 0 HA PRO A 219 11.461 -2.462 4.916 1.00 0.00 H new ATOM 0 HB2 PRO A 219 9.251 -1.357 6.072 1.00 0.00 H new ATOM 0 HB3 PRO A 219 10.295 -0.328 5.111 1.00 0.00 H new ATOM 0 HG2 PRO A 219 7.720 -1.693 4.292 1.00 0.00 H new ATOM 0 HG3 PRO A 219 8.196 -0.024 4.047 1.00 0.00 H new ATOM 0 HD2 PRO A 219 8.483 -1.898 2.057 1.00 0.00 H new ATOM 0 HD3 PRO A 219 9.595 -0.552 2.204 1.00 0.00 H new ATOM 785 N SER A 220 9.875 -3.938 6.418 1.00 0.00 N ATOM 786 CA SER A 220 9.261 -5.164 6.986 1.00 0.00 C ATOM 787 C SER A 220 7.740 -5.113 6.782 1.00 0.00 C ATOM 788 O SER A 220 7.133 -4.061 6.786 1.00 0.00 O ATOM 789 CB SER A 220 9.585 -5.265 8.478 1.00 0.00 C ATOM 790 OG SER A 220 8.969 -4.184 9.166 1.00 0.00 O ATOM 0 H SER A 220 10.341 -3.328 7.089 1.00 0.00 H new ATOM 0 HA SER A 220 9.664 -6.040 6.478 1.00 0.00 H new ATOM 0 HB2 SER A 220 9.228 -6.215 8.876 1.00 0.00 H new ATOM 0 HB3 SER A 220 10.664 -5.241 8.630 1.00 0.00 H new ATOM 0 HG SER A 220 9.468 -3.359 8.992 1.00 0.00 H new ATOM 796 N ARG A 221 7.126 -6.244 6.585 1.00 0.00 N ATOM 797 CA ARG A 221 5.653 -6.271 6.359 1.00 0.00 C ATOM 798 C ARG A 221 4.919 -5.623 7.545 1.00 0.00 C ATOM 799 O ARG A 221 3.958 -4.903 7.365 1.00 0.00 O ATOM 800 CB ARG A 221 5.200 -7.724 6.229 1.00 0.00 C ATOM 801 CG ARG A 221 5.722 -8.314 4.914 1.00 0.00 C ATOM 802 CD ARG A 221 5.434 -9.815 4.886 1.00 0.00 C ATOM 803 NE ARG A 221 5.841 -10.382 3.564 1.00 0.00 N ATOM 804 CZ ARG A 221 6.017 -11.669 3.428 1.00 0.00 C ATOM 805 NH1 ARG A 221 5.875 -12.461 4.456 1.00 0.00 N ATOM 806 NH2 ARG A 221 6.353 -12.160 2.264 1.00 0.00 N ATOM 0 H ARG A 221 7.582 -7.156 6.570 1.00 0.00 H new ATOM 0 HA ARG A 221 5.420 -5.716 5.450 1.00 0.00 H new ATOM 0 HB2 ARG A 221 5.570 -8.307 7.072 1.00 0.00 H new ATOM 0 HB3 ARG A 221 4.112 -7.779 6.257 1.00 0.00 H new ATOM 0 HG2 ARG A 221 5.243 -7.824 4.066 1.00 0.00 H new ATOM 0 HG3 ARG A 221 6.793 -8.136 4.822 1.00 0.00 H new ATOM 0 HD2 ARG A 221 5.976 -10.314 5.689 1.00 0.00 H new ATOM 0 HD3 ARG A 221 4.373 -9.995 5.058 1.00 0.00 H new ATOM 0 HE ARG A 221 5.982 -9.762 2.766 1.00 0.00 H new ATOM 0 HH11 ARG A 221 5.626 -12.075 5.367 1.00 0.00 H new ATOM 0 HH12 ARG A 221 6.013 -13.466 4.348 1.00 0.00 H new ATOM 0 HH21 ARG A 221 6.477 -11.538 1.465 1.00 0.00 H new ATOM 0 HH22 ARG A 221 6.491 -13.165 2.155 1.00 0.00 H new ATOM 820 N ALA A 222 5.357 -5.870 8.754 1.00 0.00 N ATOM 821 CA ALA A 222 4.674 -5.260 9.940 1.00 0.00 C ATOM 822 C ALA A 222 4.791 -3.741 9.874 1.00 0.00 C ATOM 823 O ALA A 222 3.875 -3.014 10.203 1.00 0.00 O ATOM 824 CB ALA A 222 5.332 -5.747 11.234 1.00 0.00 C ATOM 0 H ALA A 222 6.156 -6.466 8.973 1.00 0.00 H new ATOM 0 HA ALA A 222 3.625 -5.555 9.929 1.00 0.00 H new ATOM 0 HB1 ALA A 222 4.828 -5.298 12.090 1.00 0.00 H new ATOM 0 HB2 ALA A 222 5.254 -6.832 11.296 1.00 0.00 H new ATOM 0 HB3 ALA A 222 6.383 -5.458 11.239 1.00 0.00 H new ATOM 830 N THR A 223 5.926 -3.260 9.472 1.00 0.00 N ATOM 831 CA THR A 223 6.129 -1.793 9.399 1.00 0.00 C ATOM 832 C THR A 223 5.204 -1.183 8.360 1.00 0.00 C ATOM 833 O THR A 223 4.675 -0.108 8.549 1.00 0.00 O ATOM 834 CB THR A 223 7.576 -1.497 9.004 1.00 0.00 C ATOM 835 OG1 THR A 223 8.446 -1.992 10.005 1.00 0.00 O ATOM 836 CG2 THR A 223 7.775 0.010 8.837 1.00 0.00 C ATOM 0 H THR A 223 6.728 -3.823 9.189 1.00 0.00 H new ATOM 0 HA THR A 223 5.910 -1.362 10.376 1.00 0.00 H new ATOM 0 HB THR A 223 7.799 -1.987 8.056 1.00 0.00 H new ATOM 0 HG1 THR A 223 8.312 -2.958 10.106 1.00 0.00 H new ATOM 0 HG21 THR A 223 8.809 0.212 8.556 1.00 0.00 H new ATOM 0 HG22 THR A 223 7.108 0.381 8.059 1.00 0.00 H new ATOM 0 HG23 THR A 223 7.550 0.513 9.777 1.00 0.00 H new ATOM 844 N ALA A 224 5.027 -1.836 7.249 1.00 0.00 N ATOM 845 CA ALA A 224 4.162 -1.252 6.194 1.00 0.00 C ATOM 846 C ALA A 224 2.733 -1.047 6.715 1.00 0.00 C ATOM 847 O ALA A 224 2.174 0.020 6.582 1.00 0.00 O ATOM 848 CB ALA A 224 4.148 -2.182 4.983 1.00 0.00 C ATOM 0 H ALA A 224 5.441 -2.742 7.027 1.00 0.00 H new ATOM 0 HA ALA A 224 4.562 -0.280 5.906 1.00 0.00 H new ATOM 0 HB1 ALA A 224 3.514 -1.757 4.205 1.00 0.00 H new ATOM 0 HB2 ALA A 224 5.162 -2.297 4.601 1.00 0.00 H new ATOM 0 HB3 ALA A 224 3.758 -3.156 5.277 1.00 0.00 H new ATOM 854 N PHE A 225 2.138 -2.044 7.311 1.00 0.00 N ATOM 855 CA PHE A 225 0.738 -1.880 7.818 1.00 0.00 C ATOM 856 C PHE A 225 0.662 -0.746 8.853 1.00 0.00 C ATOM 857 O PHE A 225 -0.284 0.016 8.872 1.00 0.00 O ATOM 858 CB PHE A 225 0.242 -3.184 8.442 1.00 0.00 C ATOM 859 CG PHE A 225 -1.161 -2.964 8.954 1.00 0.00 C ATOM 860 CD1 PHE A 225 -2.200 -2.658 8.057 1.00 0.00 C ATOM 861 CD2 PHE A 225 -1.424 -3.047 10.325 1.00 0.00 C ATOM 862 CE1 PHE A 225 -3.491 -2.436 8.539 1.00 0.00 C ATOM 863 CE2 PHE A 225 -2.717 -2.826 10.802 1.00 0.00 C ATOM 864 CZ PHE A 225 -3.750 -2.519 9.911 1.00 0.00 C ATOM 0 H PHE A 225 2.554 -2.961 7.470 1.00 0.00 H new ATOM 0 HA PHE A 225 0.100 -1.624 6.972 1.00 0.00 H new ATOM 0 HB2 PHE A 225 0.255 -3.986 7.704 1.00 0.00 H new ATOM 0 HB3 PHE A 225 0.899 -3.489 9.256 1.00 0.00 H new ATOM 0 HD1 PHE A 225 -1.999 -2.595 6.998 1.00 0.00 H new ATOM 0 HD2 PHE A 225 -0.627 -3.282 11.015 1.00 0.00 H new ATOM 0 HE1 PHE A 225 -4.290 -2.200 7.852 1.00 0.00 H new ATOM 0 HE2 PHE A 225 -2.920 -2.892 11.861 1.00 0.00 H new ATOM 0 HZ PHE A 225 -4.749 -2.346 10.283 1.00 0.00 H new ATOM 874 N ARG A 226 1.637 -0.631 9.713 1.00 0.00 N ATOM 875 CA ARG A 226 1.604 0.453 10.746 1.00 0.00 C ATOM 876 C ARG A 226 1.528 1.812 10.038 1.00 0.00 C ATOM 877 O ARG A 226 0.810 2.703 10.451 1.00 0.00 O ATOM 878 CB ARG A 226 2.898 0.385 11.573 1.00 0.00 C ATOM 879 CG ARG A 226 2.944 -0.912 12.400 1.00 0.00 C ATOM 880 CD ARG A 226 2.104 -0.769 13.671 1.00 0.00 C ATOM 881 NE ARG A 226 2.309 -1.971 14.539 1.00 0.00 N ATOM 882 CZ ARG A 226 1.911 -1.950 15.786 1.00 0.00 C ATOM 883 NH1 ARG A 226 1.385 -0.863 16.273 1.00 0.00 N ATOM 884 NH2 ARG A 226 2.044 -3.008 16.550 1.00 0.00 N ATOM 0 H ARG A 226 2.456 -1.238 9.748 1.00 0.00 H new ATOM 0 HA ARG A 226 0.739 0.328 11.397 1.00 0.00 H new ATOM 0 HB2 ARG A 226 3.762 0.431 10.911 1.00 0.00 H new ATOM 0 HB3 ARG A 226 2.958 1.248 12.236 1.00 0.00 H new ATOM 0 HG2 ARG A 226 2.571 -1.744 11.803 1.00 0.00 H new ATOM 0 HG3 ARG A 226 3.976 -1.146 12.663 1.00 0.00 H new ATOM 0 HD2 ARG A 226 2.389 0.135 14.209 1.00 0.00 H new ATOM 0 HD3 ARG A 226 1.050 -0.668 13.414 1.00 0.00 H new ATOM 0 HE ARG A 226 2.758 -2.805 14.160 1.00 0.00 H new ATOM 0 HH11 ARG A 226 1.286 -0.036 15.684 1.00 0.00 H new ATOM 0 HH12 ARG A 226 1.072 -0.838 17.244 1.00 0.00 H new ATOM 0 HH21 ARG A 226 2.461 -3.859 16.174 1.00 0.00 H new ATOM 0 HH22 ARG A 226 1.730 -2.979 17.520 1.00 0.00 H new ATOM 898 N ARG A 227 2.241 1.973 8.965 1.00 0.00 N ATOM 899 CA ARG A 227 2.177 3.261 8.223 1.00 0.00 C ATOM 900 C ARG A 227 0.747 3.456 7.718 1.00 0.00 C ATOM 901 O ARG A 227 0.211 4.547 7.741 1.00 0.00 O ATOM 902 CB ARG A 227 3.142 3.226 7.043 1.00 0.00 C ATOM 903 CG ARG A 227 4.573 3.222 7.572 1.00 0.00 C ATOM 904 CD ARG A 227 5.544 3.140 6.397 1.00 0.00 C ATOM 905 NE ARG A 227 6.906 2.742 6.887 1.00 0.00 N ATOM 906 CZ ARG A 227 7.533 3.421 7.813 1.00 0.00 C ATOM 907 NH1 ARG A 227 7.072 4.568 8.227 1.00 0.00 N ATOM 908 NH2 ARG A 227 8.666 2.975 8.283 1.00 0.00 N ATOM 0 H ARG A 227 2.865 1.271 8.568 1.00 0.00 H new ATOM 0 HA ARG A 227 2.458 4.085 8.879 1.00 0.00 H new ATOM 0 HB2 ARG A 227 2.962 2.339 6.436 1.00 0.00 H new ATOM 0 HB3 ARG A 227 2.981 4.091 6.399 1.00 0.00 H new ATOM 0 HG2 ARG A 227 4.761 4.125 8.152 1.00 0.00 H new ATOM 0 HG3 ARG A 227 4.723 2.376 8.242 1.00 0.00 H new ATOM 0 HD2 ARG A 227 5.184 2.415 5.667 1.00 0.00 H new ATOM 0 HD3 ARG A 227 5.597 4.103 5.890 1.00 0.00 H new ATOM 0 HE ARG A 227 7.355 1.919 6.487 1.00 0.00 H new ATOM 0 HH11 ARG A 227 6.213 4.946 7.828 1.00 0.00 H new ATOM 0 HH12 ARG A 227 7.571 5.087 8.950 1.00 0.00 H new ATOM 0 HH21 ARG A 227 9.057 2.102 7.928 1.00 0.00 H new ATOM 0 HH22 ARG A 227 9.160 3.499 9.005 1.00 0.00 H new ATOM 922 N ILE A 228 0.120 2.405 7.256 1.00 0.00 N ATOM 923 CA ILE A 228 -1.272 2.541 6.753 1.00 0.00 C ATOM 924 C ILE A 228 -2.177 2.987 7.910 1.00 0.00 C ATOM 925 O ILE A 228 -3.061 3.797 7.746 1.00 0.00 O ATOM 926 CB ILE A 228 -1.784 1.185 6.265 1.00 0.00 C ATOM 927 CG1 ILE A 228 -0.818 0.542 5.248 1.00 0.00 C ATOM 928 CG2 ILE A 228 -3.166 1.366 5.631 1.00 0.00 C ATOM 929 CD1 ILE A 228 -0.863 1.243 3.879 1.00 0.00 C ATOM 0 H ILE A 228 0.512 1.465 7.207 1.00 0.00 H new ATOM 0 HA ILE A 228 -1.285 3.265 5.939 1.00 0.00 H new ATOM 0 HB ILE A 228 -1.850 0.516 7.123 1.00 0.00 H new ATOM 0 HG12 ILE A 228 0.198 0.580 5.641 1.00 0.00 H new ATOM 0 HG13 ILE A 228 -1.072 -0.511 5.124 1.00 0.00 H new ATOM 0 HG21 ILE A 228 -3.535 0.402 5.282 1.00 0.00 H new ATOM 0 HG22 ILE A 228 -3.856 1.772 6.371 1.00 0.00 H new ATOM 0 HG23 ILE A 228 -3.092 2.053 4.788 1.00 0.00 H new ATOM 0 HD11 ILE A 228 -0.166 0.755 3.197 1.00 0.00 H new ATOM 0 HD12 ILE A 228 -1.872 1.182 3.472 1.00 0.00 H new ATOM 0 HD13 ILE A 228 -0.582 2.290 3.997 1.00 0.00 H new ATOM 941 N GLN A 229 -1.958 2.441 9.081 1.00 0.00 N ATOM 942 CA GLN A 229 -2.806 2.798 10.260 1.00 0.00 C ATOM 943 C GLN A 229 -2.639 4.291 10.575 1.00 0.00 C ATOM 944 O GLN A 229 -3.520 4.922 11.129 1.00 0.00 O ATOM 945 CB GLN A 229 -2.378 1.979 11.486 1.00 0.00 C ATOM 946 CG GLN A 229 -2.673 0.484 11.274 1.00 0.00 C ATOM 947 CD GLN A 229 -2.242 -0.306 12.517 1.00 0.00 C ATOM 948 OE1 GLN A 229 -2.820 -0.158 13.575 1.00 0.00 O ATOM 949 NE2 GLN A 229 -1.242 -1.141 12.436 1.00 0.00 N ATOM 0 H GLN A 229 -1.224 1.759 9.271 1.00 0.00 H new ATOM 0 HA GLN A 229 -3.848 2.579 10.025 1.00 0.00 H new ATOM 0 HB2 GLN A 229 -1.313 2.122 11.671 1.00 0.00 H new ATOM 0 HB3 GLN A 229 -2.906 2.337 12.370 1.00 0.00 H new ATOM 0 HG2 GLN A 229 -3.737 0.336 11.087 1.00 0.00 H new ATOM 0 HG3 GLN A 229 -2.141 0.119 10.396 1.00 0.00 H new ATOM 0 HE21 GLN A 229 -0.754 -1.268 11.549 1.00 0.00 H new ATOM 0 HE22 GLN A 229 -0.948 -1.667 13.259 1.00 0.00 H new ATOM 958 N GLN A 230 -1.518 4.865 10.226 1.00 0.00 N ATOM 959 CA GLN A 230 -1.307 6.317 10.501 1.00 0.00 C ATOM 960 C GLN A 230 -2.194 7.123 9.555 1.00 0.00 C ATOM 961 O GLN A 230 -2.491 8.279 9.794 1.00 0.00 O ATOM 962 CB GLN A 230 0.164 6.693 10.281 1.00 0.00 C ATOM 963 CG GLN A 230 1.020 6.100 11.406 1.00 0.00 C ATOM 964 CD GLN A 230 2.488 6.469 11.190 1.00 0.00 C ATOM 965 OE1 GLN A 230 2.883 6.827 10.100 1.00 0.00 O ATOM 966 NE2 GLN A 230 3.322 6.387 12.192 1.00 0.00 N ATOM 0 H GLN A 230 -0.741 4.393 9.764 1.00 0.00 H new ATOM 0 HA GLN A 230 -1.566 6.535 11.537 1.00 0.00 H new ATOM 0 HB2 GLN A 230 0.505 6.319 9.315 1.00 0.00 H new ATOM 0 HB3 GLN A 230 0.273 7.777 10.260 1.00 0.00 H new ATOM 0 HG2 GLN A 230 0.679 6.476 12.371 1.00 0.00 H new ATOM 0 HG3 GLN A 230 0.908 5.016 11.428 1.00 0.00 H new ATOM 0 HE21 GLN A 230 2.990 6.086 13.108 1.00 0.00 H new ATOM 0 HE22 GLN A 230 4.305 6.624 12.058 1.00 0.00 H new ATOM 975 N LEU A 231 -2.623 6.507 8.483 1.00 0.00 N ATOM 976 CA LEU A 231 -3.504 7.210 7.503 1.00 0.00 C ATOM 977 C LEU A 231 -4.855 7.491 8.161 1.00 0.00 C ATOM 978 O LEU A 231 -5.470 8.509 7.911 1.00 0.00 O ATOM 979 CB LEU A 231 -3.717 6.334 6.267 1.00 0.00 C ATOM 980 CG LEU A 231 -2.371 6.024 5.594 1.00 0.00 C ATOM 981 CD1 LEU A 231 -2.611 5.123 4.373 1.00 0.00 C ATOM 982 CD2 LEU A 231 -1.691 7.329 5.140 1.00 0.00 C ATOM 0 H LEU A 231 -2.399 5.541 8.243 1.00 0.00 H new ATOM 0 HA LEU A 231 -3.033 8.145 7.200 1.00 0.00 H new ATOM 0 HB2 LEU A 231 -4.211 5.405 6.552 1.00 0.00 H new ATOM 0 HB3 LEU A 231 -4.375 6.842 5.562 1.00 0.00 H new ATOM 0 HG LEU A 231 -1.723 5.516 6.309 1.00 0.00 H new ATOM 0 HD11 LEU A 231 -1.658 4.900 3.892 1.00 0.00 H new ATOM 0 HD12 LEU A 231 -3.082 4.194 4.694 1.00 0.00 H new ATOM 0 HD13 LEU A 231 -3.264 5.635 3.666 1.00 0.00 H new ATOM 0 HD21 LEU A 231 -0.738 7.096 4.665 1.00 0.00 H new ATOM 0 HD22 LEU A 231 -2.335 7.846 4.429 1.00 0.00 H new ATOM 0 HD23 LEU A 231 -1.518 7.969 6.005 1.00 0.00 H new ATOM 994 N ASP A 232 -5.295 6.576 9.000 1.00 0.00 N ATOM 995 CA ASP A 232 -6.592 6.698 9.751 1.00 0.00 C ATOM 996 C ASP A 232 -7.675 5.814 9.126 1.00 0.00 C ATOM 997 O ASP A 232 -7.617 5.449 7.970 1.00 0.00 O ATOM 998 CB ASP A 232 -7.110 8.145 9.815 1.00 0.00 C ATOM 999 CG ASP A 232 -8.111 8.269 10.968 1.00 0.00 C ATOM 1000 OD1 ASP A 232 -8.418 7.253 11.566 1.00 0.00 O ATOM 1001 OD2 ASP A 232 -8.543 9.376 11.240 1.00 0.00 O ATOM 0 H ASP A 232 -4.786 5.715 9.202 1.00 0.00 H new ATOM 0 HA ASP A 232 -6.379 6.367 10.767 1.00 0.00 H new ATOM 0 HB2 ASP A 232 -6.280 8.835 9.962 1.00 0.00 H new ATOM 0 HB3 ASP A 232 -7.586 8.416 8.873 1.00 0.00 H new ATOM 1006 N GLU A 233 -8.671 5.488 9.908 1.00 0.00 N ATOM 1007 CA GLU A 233 -9.793 4.638 9.417 1.00 0.00 C ATOM 1008 C GLU A 233 -10.528 5.358 8.297 1.00 0.00 C ATOM 1009 O GLU A 233 -11.077 4.741 7.409 1.00 0.00 O ATOM 1010 CB GLU A 233 -10.752 4.350 10.574 1.00 0.00 C ATOM 1011 CG GLU A 233 -11.337 5.661 11.107 1.00 0.00 C ATOM 1012 CD GLU A 233 -12.117 5.374 12.388 1.00 0.00 C ATOM 1013 OE1 GLU A 233 -12.567 4.253 12.545 1.00 0.00 O ATOM 1014 OE2 GLU A 233 -12.243 6.280 13.194 1.00 0.00 O ATOM 0 H GLU A 233 -8.754 5.780 10.882 1.00 0.00 H new ATOM 0 HA GLU A 233 -9.400 3.697 9.033 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -11.555 3.694 10.237 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -10.226 3.826 11.372 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -10.539 6.376 11.305 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -11.991 6.112 10.361 1.00 0.00 H new ATOM 1021 N ALA A 234 -10.534 6.657 8.315 1.00 0.00 N ATOM 1022 CA ALA A 234 -11.227 7.392 7.227 1.00 0.00 C ATOM 1023 C ALA A 234 -10.565 7.008 5.902 1.00 0.00 C ATOM 1024 O ALA A 234 -11.187 6.991 4.858 1.00 0.00 O ATOM 1025 CB ALA A 234 -11.093 8.899 7.461 1.00 0.00 C ATOM 0 H ALA A 234 -10.094 7.238 9.029 1.00 0.00 H new ATOM 0 HA ALA A 234 -12.286 7.136 7.206 1.00 0.00 H new ATOM 0 HB1 ALA A 234 -11.602 9.438 6.662 1.00 0.00 H new ATOM 0 HB2 ALA A 234 -11.543 9.160 8.419 1.00 0.00 H new ATOM 0 HB3 ALA A 234 -10.038 9.174 7.469 1.00 0.00 H new ATOM 1031 N MET A 235 -9.305 6.680 5.946 1.00 0.00 N ATOM 1032 CA MET A 235 -8.595 6.269 4.706 1.00 0.00 C ATOM 1033 C MET A 235 -9.280 5.040 4.132 1.00 0.00 C ATOM 1034 O MET A 235 -9.420 4.897 2.940 1.00 0.00 O ATOM 1035 CB MET A 235 -7.139 5.946 5.025 1.00 0.00 C ATOM 1036 CG MET A 235 -6.389 5.584 3.728 1.00 0.00 C ATOM 1037 SD MET A 235 -6.788 3.894 3.198 1.00 0.00 S ATOM 1038 CE MET A 235 -6.089 3.002 4.611 1.00 0.00 C ATOM 0 H MET A 235 -8.735 6.679 6.792 1.00 0.00 H new ATOM 0 HA MET A 235 -8.624 7.081 3.980 1.00 0.00 H new ATOM 0 HB2 MET A 235 -6.664 6.802 5.504 1.00 0.00 H new ATOM 0 HB3 MET A 235 -7.087 5.116 5.730 1.00 0.00 H new ATOM 0 HG2 MET A 235 -6.656 6.289 2.940 1.00 0.00 H new ATOM 0 HG3 MET A 235 -5.315 5.675 3.887 1.00 0.00 H new ATOM 0 HE1 MET A 235 -5.441 2.203 4.252 1.00 0.00 H new ATOM 0 HE2 MET A 235 -5.509 3.691 5.226 1.00 0.00 H new ATOM 0 HE3 MET A 235 -6.896 2.575 5.207 1.00 0.00 H new ATOM 1048 N VAL A 236 -9.697 4.140 4.973 1.00 0.00 N ATOM 1049 CA VAL A 236 -10.369 2.914 4.465 1.00 0.00 C ATOM 1050 C VAL A 236 -11.628 3.331 3.688 1.00 0.00 C ATOM 1051 O VAL A 236 -11.941 2.789 2.648 1.00 0.00 O ATOM 1052 CB VAL A 236 -10.739 2.014 5.652 1.00 0.00 C ATOM 1053 CG1 VAL A 236 -11.641 0.881 5.175 1.00 0.00 C ATOM 1054 CG2 VAL A 236 -9.466 1.413 6.269 1.00 0.00 C ATOM 0 H VAL A 236 -9.603 4.199 5.987 1.00 0.00 H new ATOM 0 HA VAL A 236 -9.706 2.359 3.801 1.00 0.00 H new ATOM 0 HB VAL A 236 -11.260 2.612 6.399 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -11.902 0.244 6.020 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -12.550 1.298 4.740 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -11.117 0.291 4.423 1.00 0.00 H new ATOM 0 HG21 VAL A 236 -9.736 0.775 7.111 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -8.942 0.821 5.518 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -8.816 2.216 6.616 1.00 0.00 H new ATOM 1064 N VAL A 237 -12.338 4.303 4.180 1.00 0.00 N ATOM 1065 CA VAL A 237 -13.560 4.774 3.476 1.00 0.00 C ATOM 1066 C VAL A 237 -13.149 5.534 2.221 1.00 0.00 C ATOM 1067 O VAL A 237 -13.971 5.920 1.412 1.00 0.00 O ATOM 1068 CB VAL A 237 -14.337 5.697 4.404 1.00 0.00 C ATOM 1069 CG1 VAL A 237 -15.607 6.196 3.699 1.00 0.00 C ATOM 1070 CG2 VAL A 237 -14.712 4.920 5.669 1.00 0.00 C ATOM 0 H VAL A 237 -12.123 4.796 5.047 1.00 0.00 H new ATOM 0 HA VAL A 237 -14.185 3.926 3.197 1.00 0.00 H new ATOM 0 HB VAL A 237 -13.724 6.559 4.669 1.00 0.00 H new ATOM 0 HG11 VAL A 237 -16.159 6.856 4.368 1.00 0.00 H new ATOM 0 HG12 VAL A 237 -15.332 6.742 2.797 1.00 0.00 H new ATOM 0 HG13 VAL A 237 -16.233 5.345 3.431 1.00 0.00 H new ATOM 0 HG21 VAL A 237 -15.270 5.570 6.343 1.00 0.00 H new ATOM 0 HG22 VAL A 237 -15.328 4.062 5.400 1.00 0.00 H new ATOM 0 HG23 VAL A 237 -13.805 4.574 6.166 1.00 0.00 H new ATOM 1080 N ALA A 238 -11.881 5.778 2.069 1.00 0.00 N ATOM 1081 CA ALA A 238 -11.414 6.543 0.887 1.00 0.00 C ATOM 1082 C ALA A 238 -11.962 5.915 -0.406 1.00 0.00 C ATOM 1083 O ALA A 238 -13.022 6.277 -0.875 1.00 0.00 O ATOM 1084 CB ALA A 238 -9.882 6.534 0.860 1.00 0.00 C ATOM 0 H ALA A 238 -11.148 5.480 2.713 1.00 0.00 H new ATOM 0 HA ALA A 238 -11.777 7.569 0.955 1.00 0.00 H new ATOM 0 HB1 ALA A 238 -9.530 7.094 -0.006 1.00 0.00 H new ATOM 0 HB2 ALA A 238 -9.499 6.995 1.771 1.00 0.00 H new ATOM 0 HB3 ALA A 238 -9.525 5.506 0.796 1.00 0.00 H new ATOM 1090 N CYS A 239 -11.257 4.989 -0.997 1.00 0.00 N ATOM 1091 CA CYS A 239 -11.755 4.372 -2.263 1.00 0.00 C ATOM 1092 C CYS A 239 -12.883 3.374 -1.970 1.00 0.00 C ATOM 1093 O CYS A 239 -13.834 3.261 -2.716 1.00 0.00 O ATOM 1094 CB CYS A 239 -10.593 3.663 -2.963 1.00 0.00 C ATOM 1095 SG CYS A 239 -9.676 4.879 -3.952 1.00 0.00 S ATOM 0 H CYS A 239 -10.362 4.633 -0.661 1.00 0.00 H new ATOM 0 HA CYS A 239 -12.153 5.153 -2.911 1.00 0.00 H new ATOM 0 HB2 CYS A 239 -9.935 3.201 -2.227 1.00 0.00 H new ATOM 0 HB3 CYS A 239 -10.968 2.863 -3.601 1.00 0.00 H new ATOM 0 HG CYS A 239 -8.800 4.265 -4.691 1.00 0.00 H new ATOM 1101 N ARG A 240 -12.785 2.642 -0.902 1.00 0.00 N ATOM 1102 CA ARG A 240 -13.852 1.652 -0.593 1.00 0.00 C ATOM 1103 C ARG A 240 -15.081 2.388 -0.046 1.00 0.00 C ATOM 1104 O ARG A 240 -15.546 2.130 1.048 1.00 0.00 O ATOM 1105 CB ARG A 240 -13.336 0.648 0.446 1.00 0.00 C ATOM 1106 CG ARG A 240 -12.098 -0.086 -0.102 1.00 0.00 C ATOM 1107 CD ARG A 240 -10.871 0.850 -0.128 1.00 0.00 C ATOM 1108 NE ARG A 240 -9.602 0.059 0.004 1.00 0.00 N ATOM 1109 CZ ARG A 240 -9.344 -0.697 1.043 1.00 0.00 C ATOM 1110 NH1 ARG A 240 -10.165 -0.754 2.060 1.00 0.00 N ATOM 1111 NH2 ARG A 240 -8.233 -1.385 1.067 1.00 0.00 N ATOM 0 H ARG A 240 -12.018 2.684 -0.231 1.00 0.00 H new ATOM 0 HA ARG A 240 -14.128 1.113 -1.499 1.00 0.00 H new ATOM 0 HB2 ARG A 240 -13.082 1.167 1.370 1.00 0.00 H new ATOM 0 HB3 ARG A 240 -14.118 -0.071 0.689 1.00 0.00 H new ATOM 0 HG2 ARG A 240 -11.883 -0.957 0.517 1.00 0.00 H new ATOM 0 HG3 ARG A 240 -12.303 -0.452 -1.108 1.00 0.00 H new ATOM 0 HD2 ARG A 240 -10.858 1.416 -1.059 1.00 0.00 H new ATOM 0 HD3 ARG A 240 -10.941 1.574 0.684 1.00 0.00 H new ATOM 0 HE ARG A 240 -8.912 0.112 -0.746 1.00 0.00 H new ATOM 0 HH11 ARG A 240 -11.024 -0.204 2.054 1.00 0.00 H new ATOM 0 HH12 ARG A 240 -9.946 -1.349 2.859 1.00 0.00 H new ATOM 0 HH21 ARG A 240 -7.581 -1.329 0.284 1.00 0.00 H new ATOM 0 HH22 ARG A 240 -8.018 -1.978 1.868 1.00 0.00 H new ATOM 1125 N GLU A 241 -15.604 3.307 -0.812 1.00 0.00 N ATOM 1126 CA GLU A 241 -16.802 4.085 -0.367 1.00 0.00 C ATOM 1127 C GLU A 241 -17.878 3.140 0.184 1.00 0.00 C ATOM 1128 O GLU A 241 -18.717 3.536 0.966 1.00 0.00 O ATOM 1129 CB GLU A 241 -17.380 4.854 -1.558 1.00 0.00 C ATOM 1130 CG GLU A 241 -16.399 5.954 -1.967 1.00 0.00 C ATOM 1131 CD GLU A 241 -16.945 6.720 -3.170 1.00 0.00 C ATOM 1132 OE1 GLU A 241 -17.690 6.134 -3.937 1.00 0.00 O ATOM 1133 OE2 GLU A 241 -16.604 7.883 -3.307 1.00 0.00 O ATOM 0 H GLU A 241 -15.251 3.556 -1.736 1.00 0.00 H new ATOM 0 HA GLU A 241 -16.498 4.778 0.417 1.00 0.00 H new ATOM 0 HB2 GLU A 241 -17.555 4.177 -2.394 1.00 0.00 H new ATOM 0 HB3 GLU A 241 -18.344 5.289 -1.293 1.00 0.00 H new ATOM 0 HG2 GLU A 241 -16.238 6.637 -1.133 1.00 0.00 H new ATOM 0 HG3 GLU A 241 -15.431 5.517 -2.213 1.00 0.00 H new ATOM 1140 N GLY A 242 -17.865 1.898 -0.214 1.00 0.00 N ATOM 1141 CA GLY A 242 -18.893 0.944 0.297 1.00 0.00 C ATOM 1142 C GLY A 242 -18.959 1.031 1.823 1.00 0.00 C ATOM 1143 O GLY A 242 -17.985 1.339 2.481 1.00 0.00 O ATOM 0 H GLY A 242 -17.190 1.502 -0.869 1.00 0.00 H new ATOM 0 HA2 GLY A 242 -19.867 1.178 -0.133 1.00 0.00 H new ATOM 0 HA3 GLY A 242 -18.645 -0.072 -0.009 1.00 0.00 H new ATOM 1147 N GLU A 243 -20.101 0.764 2.390 1.00 0.00 N ATOM 1148 CA GLU A 243 -20.227 0.837 3.871 1.00 0.00 C ATOM 1149 C GLU A 243 -19.584 -0.386 4.515 1.00 0.00 C ATOM 1150 O GLU A 243 -19.672 -1.489 4.010 1.00 0.00 O ATOM 1151 CB GLU A 243 -21.703 0.882 4.264 1.00 0.00 C ATOM 1152 CG GLU A 243 -22.329 2.192 3.770 1.00 0.00 C ATOM 1153 CD GLU A 243 -22.583 2.108 2.264 1.00 0.00 C ATOM 1154 OE1 GLU A 243 -22.434 1.029 1.718 1.00 0.00 O ATOM 1155 OE2 GLU A 243 -22.931 3.124 1.685 1.00 0.00 O ATOM 0 H GLU A 243 -20.951 0.499 1.893 1.00 0.00 H new ATOM 0 HA GLU A 243 -19.723 1.739 4.217 1.00 0.00 H new ATOM 0 HB2 GLU A 243 -22.230 0.031 3.833 1.00 0.00 H new ATOM 0 HB3 GLU A 243 -21.804 0.805 5.347 1.00 0.00 H new ATOM 0 HG2 GLU A 243 -23.265 2.380 4.296 1.00 0.00 H new ATOM 0 HG3 GLU A 243 -21.666 3.029 3.990 1.00 0.00 H new ATOM 1162 N HIS A 244 -18.952 -0.190 5.644 1.00 0.00 N ATOM 1163 CA HIS A 244 -18.303 -1.323 6.371 1.00 0.00 C ATOM 1164 C HIS A 244 -18.972 -1.475 7.737 1.00 0.00 C ATOM 1165 O HIS A 244 -19.163 -0.522 8.468 1.00 0.00 O ATOM 1166 CB HIS A 244 -16.808 -1.041 6.557 1.00 0.00 C ATOM 1167 CG HIS A 244 -16.111 -1.099 5.219 1.00 0.00 C ATOM 1168 ND1 HIS A 244 -15.800 -2.300 4.591 1.00 0.00 N ATOM 1169 CD2 HIS A 244 -15.653 -0.111 4.379 1.00 0.00 C ATOM 1170 CE1 HIS A 244 -15.184 -2.003 3.430 1.00 0.00 C ATOM 1171 NE2 HIS A 244 -15.071 -0.682 3.254 1.00 0.00 N ATOM 0 H HIS A 244 -18.857 0.718 6.099 1.00 0.00 H new ATOM 0 HA HIS A 244 -18.416 -2.241 5.795 1.00 0.00 H new ATOM 0 HB2 HIS A 244 -16.666 -0.060 7.010 1.00 0.00 H new ATOM 0 HB3 HIS A 244 -16.372 -1.772 7.238 1.00 0.00 H new ATOM 0 HD1 HIS A 244 -16.001 -3.235 4.945 1.00 0.00 H new ATOM 0 HD2 HIS A 244 -15.734 0.950 4.566 1.00 0.00 H new ATOM 0 HE1 HIS A 244 -14.826 -2.741 2.728 1.00 0.00 H new ATOM 1179 N ALA A 245 -19.338 -2.678 8.071 1.00 0.00 N ATOM 1180 CA ALA A 245 -20.001 -2.932 9.372 1.00 0.00 C ATOM 1181 C ALA A 245 -18.962 -2.838 10.489 1.00 0.00 C ATOM 1182 O ALA A 245 -17.773 -2.818 10.241 1.00 0.00 O ATOM 1183 CB ALA A 245 -20.612 -4.333 9.359 1.00 0.00 C ATOM 0 H ALA A 245 -19.203 -3.505 7.489 1.00 0.00 H new ATOM 0 HA ALA A 245 -20.786 -2.194 9.540 1.00 0.00 H new ATOM 0 HB1 ALA A 245 -21.101 -4.525 10.314 1.00 0.00 H new ATOM 0 HB2 ALA A 245 -21.345 -4.403 8.555 1.00 0.00 H new ATOM 0 HB3 ALA A 245 -19.826 -5.071 9.199 1.00 0.00 H new ATOM 1189 N LEU A 246 -19.403 -2.778 11.717 1.00 0.00 N ATOM 1190 CA LEU A 246 -18.440 -2.674 12.852 1.00 0.00 C ATOM 1191 C LEU A 246 -17.872 -4.061 13.165 1.00 0.00 C ATOM 1192 O LEU A 246 -16.931 -4.209 13.926 1.00 0.00 O ATOM 1193 CB LEU A 246 -19.168 -2.125 14.090 1.00 0.00 C ATOM 1194 CG LEU A 246 -19.431 -0.623 13.919 1.00 0.00 C ATOM 1195 CD1 LEU A 246 -20.497 -0.377 12.838 1.00 0.00 C ATOM 1196 CD2 LEU A 246 -19.912 -0.045 15.258 1.00 0.00 C ATOM 0 H LEU A 246 -20.387 -2.796 11.983 1.00 0.00 H new ATOM 0 HA LEU A 246 -17.626 -2.001 12.581 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -20.110 -2.654 14.233 1.00 0.00 H new ATOM 0 HB3 LEU A 246 -18.567 -2.298 14.983 1.00 0.00 H new ATOM 0 HG LEU A 246 -18.508 -0.134 13.609 1.00 0.00 H new ATOM 0 HD11 LEU A 246 -20.668 0.694 12.733 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -20.152 -0.784 11.888 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -21.427 -0.866 13.126 1.00 0.00 H new ATOM 0 HD21 LEU A 246 -20.102 1.023 15.146 1.00 0.00 H new ATOM 0 HD22 LEU A 246 -20.831 -0.547 15.562 1.00 0.00 H new ATOM 0 HD23 LEU A 246 -19.146 -0.200 16.017 1.00 0.00 H new ATOM 1208 N MET A 247 -18.438 -5.075 12.573 1.00 0.00 N ATOM 1209 CA MET A 247 -17.949 -6.463 12.807 1.00 0.00 C ATOM 1210 C MET A 247 -17.905 -6.753 14.308 1.00 0.00 C ATOM 1211 O MET A 247 -16.825 -6.688 14.868 1.00 0.00 O ATOM 1212 CB MET A 247 -16.545 -6.620 12.221 1.00 0.00 C ATOM 1213 CG MET A 247 -16.141 -8.095 12.287 1.00 0.00 C ATOM 1214 SD MET A 247 -14.591 -8.353 11.387 1.00 0.00 S ATOM 1215 CE MET A 247 -13.459 -7.927 12.732 1.00 0.00 C ATOM 1216 OXT MET A 247 -18.950 -7.041 14.870 1.00 0.00 O ATOM 0 H MET A 247 -19.227 -5.001 11.930 1.00 0.00 H new ATOM 0 HA MET A 247 -18.628 -7.165 12.323 1.00 0.00 H new ATOM 0 HB2 MET A 247 -16.526 -6.270 11.189 1.00 0.00 H new ATOM 0 HB3 MET A 247 -15.834 -6.009 12.778 1.00 0.00 H new ATOM 0 HG2 MET A 247 -16.023 -8.402 13.326 1.00 0.00 H new ATOM 0 HG3 MET A 247 -16.928 -8.716 11.858 1.00 0.00 H new ATOM 0 HE1 MET A 247 -12.430 -8.021 12.385 1.00 0.00 H new ATOM 0 HE2 MET A 247 -13.642 -6.901 13.050 1.00 0.00 H new ATOM 0 HE3 MET A 247 -13.622 -8.602 13.572 1.00 0.00 H new TER 1226 MET A 247