USER MOD reduce.3.24.130724 H: found=0, std=0, add=591, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 593 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 175 TYR OH : rot 180:sc= 0 USER MOD Single : A 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 191 GLN : amide:sc= -0.114 X(o=-0.11,f=-0.31) USER MOD Single : A 194 TYR OH : rot 180:sc= 0 USER MOD Single : A 196 THR OG1 : rot 180:sc= 0.0047 USER MOD Single : A 209 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0191) USER MOD Single : A 213 MET CE :methyl 173:sc= -0.0197 (180deg=-0.112) USER MOD Single : A 214 THR OG1 : rot -42:sc= 0.16 USER MOD Single : A 227 THR OG1 : rot 114:sc= 0.203 USER MOD Single : A 228 GLN : amide:sc= -0.71 K(o=-0.71,f=-5.9!) USER MOD Single : A 232 LYS NZ :NH3+ -168:sc=-0.00927 (180deg=-0.152) USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 238 LYS NZ :NH3+ 132:sc= 1.25 (180deg=0.406) USER MOD Single : A 250 TYR OH : rot 180:sc= -1.94! USER MOD Single : A 256 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 169 -6.672 13.455 0.405 1.00 5.33 N ATOM 33 CA ASP A 169 -5.224 13.578 0.138 1.00 12.15 C ATOM 34 C ASP A 169 -4.759 12.457 -0.804 1.00 1.32 C ATOM 35 O ASP A 169 -4.334 12.723 -1.935 1.00 21.10 O ATOM 36 CB ASP A 169 -4.442 13.540 1.479 1.00 1.41 C ATOM 37 CG ASP A 169 -2.910 13.660 1.314 1.00 54.24 C ATOM 38 OD1 ASP A 169 -2.445 14.695 0.788 1.00 31.12 O ATOM 39 OD2 ASP A 169 -2.164 12.742 1.736 1.00 53.04 O ATOM 0 HA ASP A 169 -5.026 14.531 -0.353 1.00 12.15 H new ATOM 0 HB2 ASP A 169 -4.794 14.351 2.116 1.00 1.41 H new ATOM 0 HB3 ASP A 169 -4.670 12.607 1.995 1.00 1.41 H new ATOM 44 N VAL A 170 -4.863 11.203 -0.332 1.00 4.52 N ATOM 45 CA VAL A 170 -4.436 10.007 -1.091 1.00 24.25 C ATOM 46 C VAL A 170 -5.624 9.368 -1.828 1.00 73.11 C ATOM 47 O VAL A 170 -6.764 9.816 -1.686 1.00 41.44 O ATOM 48 CB VAL A 170 -3.793 8.927 -0.138 1.00 44.44 C ATOM 49 CG1 VAL A 170 -2.658 9.531 0.702 1.00 31.11 C ATOM 50 CG2 VAL A 170 -4.848 8.243 0.761 1.00 23.50 C ATOM 0 H VAL A 170 -5.246 10.986 0.588 1.00 4.52 H new ATOM 0 HA VAL A 170 -3.693 10.339 -1.816 1.00 24.25 H new ATOM 0 HB VAL A 170 -3.366 8.154 -0.776 1.00 44.44 H new ATOM 0 HG11 VAL A 170 -2.235 8.762 1.349 1.00 31.11 H new ATOM 0 HG12 VAL A 170 -1.882 9.917 0.041 1.00 31.11 H new ATOM 0 HG13 VAL A 170 -3.051 10.344 1.313 1.00 31.11 H new ATOM 0 HG21 VAL A 170 -4.360 7.507 1.400 1.00 23.50 H new ATOM 0 HG22 VAL A 170 -5.339 8.993 1.381 1.00 23.50 H new ATOM 0 HG23 VAL A 170 -5.590 7.746 0.137 1.00 23.50 H new ATOM 60 N ILE A 171 -5.348 8.313 -2.615 1.00 35.33 N ATOM 61 CA ILE A 171 -6.397 7.382 -3.069 1.00 14.41 C ATOM 62 C ILE A 171 -6.397 6.175 -2.109 1.00 2.32 C ATOM 63 O ILE A 171 -5.329 5.712 -1.679 1.00 22.03 O ATOM 64 CB ILE A 171 -6.236 6.931 -4.573 1.00 72.24 C ATOM 65 CG1 ILE A 171 -7.446 6.043 -5.025 1.00 71.15 C ATOM 66 CG2 ILE A 171 -4.895 6.219 -4.812 1.00 2.40 C ATOM 67 CD1 ILE A 171 -7.470 5.681 -6.502 1.00 1.35 C ATOM 0 H ILE A 171 -4.412 8.084 -2.949 1.00 35.33 H new ATOM 0 HA ILE A 171 -7.357 7.897 -3.043 1.00 14.41 H new ATOM 0 HB ILE A 171 -6.234 7.831 -5.188 1.00 72.24 H new ATOM 0 HG12 ILE A 171 -7.437 5.122 -4.442 1.00 71.15 H new ATOM 0 HG13 ILE A 171 -8.371 6.566 -4.781 1.00 71.15 H new ATOM 0 HG21 ILE A 171 -4.821 5.924 -5.859 1.00 2.40 H new ATOM 0 HG22 ILE A 171 -4.076 6.895 -4.567 1.00 2.40 H new ATOM 0 HG23 ILE A 171 -4.836 5.333 -4.180 1.00 2.40 H new ATOM 0 HD11 ILE A 171 -8.345 5.066 -6.712 1.00 1.35 H new ATOM 0 HD12 ILE A 171 -7.515 6.592 -7.099 1.00 1.35 H new ATOM 0 HD13 ILE A 171 -6.567 5.125 -6.755 1.00 1.35 H new ATOM 79 N ASP A 172 -7.602 5.719 -1.747 1.00 33.22 N ATOM 80 CA ASP A 172 -7.809 4.663 -0.744 1.00 14.33 C ATOM 81 C ASP A 172 -7.383 3.285 -1.287 1.00 64.35 C ATOM 82 O ASP A 172 -7.539 2.995 -2.483 1.00 40.52 O ATOM 83 CB ASP A 172 -9.295 4.647 -0.297 1.00 71.34 C ATOM 84 CG ASP A 172 -9.646 3.511 0.684 1.00 10.24 C ATOM 85 OD1 ASP A 172 -9.141 3.526 1.824 1.00 53.44 O ATOM 86 OD2 ASP A 172 -10.444 2.609 0.330 1.00 3.03 O ATOM 0 H ASP A 172 -8.471 6.075 -2.145 1.00 33.22 H new ATOM 0 HA ASP A 172 -7.182 4.879 0.121 1.00 14.33 H new ATOM 0 HB2 ASP A 172 -9.533 5.602 0.171 1.00 71.34 H new ATOM 0 HB3 ASP A 172 -9.928 4.558 -1.180 1.00 71.34 H new ATOM 91 N ALA A 173 -6.851 2.455 -0.380 1.00 34.15 N ATOM 92 CA ALA A 173 -6.380 1.094 -0.670 1.00 41.53 C ATOM 93 C ALA A 173 -6.414 0.244 0.620 1.00 10.31 C ATOM 94 O ALA A 173 -6.755 0.752 1.697 1.00 73.42 O ATOM 95 CB ALA A 173 -4.964 1.146 -1.271 1.00 1.42 C ATOM 0 H ALA A 173 -6.733 2.717 0.599 1.00 34.15 H new ATOM 0 HA ALA A 173 -7.039 0.626 -1.402 1.00 41.53 H new ATOM 0 HB1 ALA A 173 -4.621 0.133 -1.483 1.00 1.42 H new ATOM 0 HB2 ALA A 173 -4.982 1.724 -2.195 1.00 1.42 H new ATOM 0 HB3 ALA A 173 -4.284 1.617 -0.561 1.00 1.42 H new ATOM 101 N ASP A 174 -6.045 -1.042 0.502 1.00 34.03 N ATOM 102 CA ASP A 174 -5.995 -1.994 1.641 1.00 12.20 C ATOM 103 C ASP A 174 -5.015 -3.142 1.325 1.00 32.20 C ATOM 104 O ASP A 174 -4.813 -3.461 0.156 1.00 2.21 O ATOM 105 CB ASP A 174 -7.417 -2.547 1.943 1.00 2.04 C ATOM 106 CG ASP A 174 -7.438 -3.596 3.067 1.00 22.34 C ATOM 107 OD1 ASP A 174 -6.902 -3.311 4.160 1.00 23.44 O ATOM 108 OD2 ASP A 174 -7.972 -4.712 2.865 1.00 1.55 O ATOM 0 H ASP A 174 -5.770 -1.459 -0.387 1.00 34.03 H new ATOM 0 HA ASP A 174 -5.639 -1.470 2.528 1.00 12.20 H new ATOM 0 HB2 ASP A 174 -8.070 -1.719 2.217 1.00 2.04 H new ATOM 0 HB3 ASP A 174 -7.827 -2.990 1.035 1.00 2.04 H new ATOM 113 N TYR A 175 -4.404 -3.752 2.366 1.00 31.44 N ATOM 114 CA TYR A 175 -3.530 -4.930 2.203 1.00 72.42 C ATOM 115 C TYR A 175 -3.943 -6.046 3.150 1.00 32.41 C ATOM 116 O TYR A 175 -4.716 -5.831 4.097 1.00 42.30 O ATOM 117 CB TYR A 175 -2.036 -4.578 2.430 1.00 71.35 C ATOM 118 CG TYR A 175 -1.607 -4.330 3.888 1.00 50.25 C ATOM 119 CD1 TYR A 175 -1.689 -3.080 4.452 1.00 14.13 C ATOM 120 CD2 TYR A 175 -1.095 -5.361 4.683 1.00 21.51 C ATOM 121 CE1 TYR A 175 -1.273 -2.851 5.734 1.00 52.43 C ATOM 122 CE2 TYR A 175 -0.683 -5.135 5.979 1.00 41.45 C ATOM 123 CZ TYR A 175 -0.773 -3.873 6.498 1.00 5.02 C ATOM 124 OH TYR A 175 -0.351 -3.617 7.786 1.00 70.15 O ATOM 0 H TYR A 175 -4.503 -3.443 3.333 1.00 31.44 H new ATOM 0 HA TYR A 175 -3.646 -5.271 1.174 1.00 72.42 H new ATOM 0 HB2 TYR A 175 -1.429 -5.389 2.028 1.00 71.35 H new ATOM 0 HB3 TYR A 175 -1.802 -3.686 1.848 1.00 71.35 H new ATOM 0 HD1 TYR A 175 -2.090 -2.262 3.871 1.00 14.13 H new ATOM 0 HD2 TYR A 175 -1.021 -6.357 4.272 1.00 21.51 H new ATOM 0 HE1 TYR A 175 -1.339 -1.856 6.148 1.00 52.43 H new ATOM 0 HE2 TYR A 175 -0.294 -5.945 6.578 1.00 41.45 H new ATOM 0 HH TYR A 175 -0.025 -4.446 8.194 1.00 70.15 H new ATOM 134 N LYS A 176 -3.371 -7.236 2.897 1.00 50.41 N ATOM 135 CA LYS A 176 -3.561 -8.436 3.718 1.00 61.13 C ATOM 136 C LYS A 176 -2.245 -9.251 3.735 1.00 32.24 C ATOM 137 O LYS A 176 -1.472 -9.175 2.775 1.00 75.31 O ATOM 138 CB LYS A 176 -4.752 -9.301 3.198 1.00 32.22 C ATOM 139 CG LYS A 176 -6.122 -8.597 3.304 1.00 71.51 C ATOM 140 CD LYS A 176 -7.328 -9.539 3.157 1.00 41.13 C ATOM 141 CE LYS A 176 -8.662 -8.775 3.252 1.00 71.12 C ATOM 142 NZ LYS A 176 -9.834 -9.685 3.203 1.00 54.33 N ATOM 0 H LYS A 176 -2.753 -7.389 2.100 1.00 50.41 H new ATOM 0 HA LYS A 176 -3.811 -8.134 4.735 1.00 61.13 H new ATOM 0 HB2 LYS A 176 -4.569 -9.567 2.157 1.00 32.22 H new ATOM 0 HB3 LYS A 176 -4.787 -10.232 3.763 1.00 32.22 H new ATOM 0 HG2 LYS A 176 -6.185 -8.092 4.268 1.00 71.51 H new ATOM 0 HG3 LYS A 176 -6.182 -7.826 2.536 1.00 71.51 H new ATOM 0 HD2 LYS A 176 -7.272 -10.055 2.199 1.00 41.13 H new ATOM 0 HD3 LYS A 176 -7.290 -10.303 3.934 1.00 41.13 H new ATOM 0 HE2 LYS A 176 -8.686 -8.204 4.180 1.00 71.12 H new ATOM 0 HE3 LYS A 176 -8.727 -8.057 2.434 1.00 71.12 H new ATOM 0 HZ1 LYS A 176 -10.709 -9.128 3.270 1.00 54.33 H new ATOM 0 HZ2 LYS A 176 -9.827 -10.212 2.307 1.00 54.33 H new ATOM 0 HZ3 LYS A 176 -9.788 -10.354 3.998 1.00 54.33 H new ATOM 156 N PRO A 177 -1.960 -10.015 4.844 1.00 53.02 N ATOM 157 CA PRO A 177 -0.720 -10.833 4.987 1.00 44.33 C ATOM 158 C PRO A 177 -0.550 -11.881 3.847 1.00 71.02 C ATOM 159 O PRO A 177 -1.299 -12.860 3.776 1.00 24.01 O ATOM 160 CB PRO A 177 -0.904 -11.520 6.379 1.00 42.53 C ATOM 161 CG PRO A 177 -2.382 -11.428 6.666 1.00 4.20 C ATOM 162 CD PRO A 177 -2.815 -10.119 6.066 1.00 41.20 C ATOM 0 HA PRO A 177 0.183 -10.226 4.919 1.00 44.33 H new ATOM 0 HB2 PRO A 177 -0.570 -12.557 6.355 1.00 42.53 H new ATOM 0 HB3 PRO A 177 -0.320 -11.015 7.149 1.00 42.53 H new ATOM 0 HG2 PRO A 177 -2.923 -12.264 6.222 1.00 4.20 H new ATOM 0 HG3 PRO A 177 -2.578 -11.455 7.738 1.00 4.20 H new ATOM 0 HD2 PRO A 177 -3.876 -10.119 5.818 1.00 41.20 H new ATOM 0 HD3 PRO A 177 -2.647 -9.286 6.749 1.00 41.20 H new ATOM 170 N ALA A 178 0.455 -11.655 2.968 1.00 52.23 N ATOM 171 CA ALA A 178 0.745 -12.534 1.811 1.00 23.00 C ATOM 172 C ALA A 178 1.339 -13.874 2.266 1.00 4.13 C ATOM 173 O ALA A 178 1.232 -14.881 1.560 1.00 3.20 O ATOM 174 CB ALA A 178 1.692 -11.834 0.826 1.00 2.43 C ATOM 0 H ALA A 178 1.087 -10.858 3.041 1.00 52.23 H new ATOM 0 HA ALA A 178 -0.197 -12.739 1.303 1.00 23.00 H new ATOM 0 HB1 ALA A 178 1.893 -12.495 -0.017 1.00 2.43 H new ATOM 0 HB2 ALA A 178 1.228 -10.916 0.465 1.00 2.43 H new ATOM 0 HB3 ALA A 178 2.628 -11.593 1.330 1.00 2.43 H new ATOM 285 N GLN A 191 4.345 2.967 14.759 1.00 43.14 N ATOM 286 CA GLN A 191 2.929 2.665 14.507 1.00 44.54 C ATOM 287 C GLN A 191 2.651 2.858 13.013 1.00 51.51 C ATOM 288 O GLN A 191 2.126 1.964 12.344 1.00 2.03 O ATOM 289 CB GLN A 191 1.992 3.543 15.374 1.00 55.03 C ATOM 290 CG GLN A 191 2.103 3.276 16.893 1.00 13.04 C ATOM 291 CD GLN A 191 1.822 1.813 17.302 1.00 14.01 C ATOM 292 OE1 GLN A 191 1.034 1.103 16.673 1.00 54.41 O ATOM 293 NE2 GLN A 191 2.482 1.349 18.352 1.00 43.32 N ATOM 0 HA GLN A 191 2.725 1.632 14.788 1.00 44.54 H new ATOM 0 HB2 GLN A 191 2.216 4.593 15.183 1.00 55.03 H new ATOM 0 HB3 GLN A 191 0.962 3.375 15.061 1.00 55.03 H new ATOM 0 HG2 GLN A 191 3.105 3.548 17.226 1.00 13.04 H new ATOM 0 HG3 GLN A 191 1.404 3.928 17.417 1.00 13.04 H new ATOM 0 HE21 GLN A 191 3.129 1.955 18.857 1.00 43.32 H new ATOM 0 HE22 GLN A 191 2.344 0.385 18.656 1.00 43.32 H new ATOM 302 N ASP A 192 3.033 4.033 12.491 1.00 52.33 N ATOM 303 CA ASP A 192 2.950 4.328 11.048 1.00 74.34 C ATOM 304 C ASP A 192 4.290 4.002 10.365 1.00 61.11 C ATOM 305 O ASP A 192 5.327 3.925 11.029 1.00 74.24 O ATOM 306 CB ASP A 192 2.548 5.812 10.817 1.00 11.33 C ATOM 307 CG ASP A 192 3.540 6.822 11.418 1.00 11.43 C ATOM 308 OD1 ASP A 192 3.411 7.161 12.616 1.00 41.03 O ATOM 309 OD2 ASP A 192 4.468 7.262 10.715 1.00 13.12 O ATOM 0 H ASP A 192 3.405 4.801 13.049 1.00 52.33 H new ATOM 0 HA ASP A 192 2.178 3.701 10.602 1.00 74.34 H new ATOM 0 HB2 ASP A 192 2.463 5.994 9.746 1.00 11.33 H new ATOM 0 HB3 ASP A 192 1.562 5.984 11.249 1.00 11.33 H new ATOM 314 N LEU A 193 4.253 3.791 9.038 1.00 32.42 N ATOM 315 CA LEU A 193 5.449 3.548 8.206 1.00 61.21 C ATOM 316 C LEU A 193 5.336 4.369 6.917 1.00 43.35 C ATOM 317 O LEU A 193 4.229 4.639 6.449 1.00 31.23 O ATOM 318 CB LEU A 193 5.602 2.032 7.858 1.00 24.14 C ATOM 319 CG LEU A 193 5.905 1.059 9.041 1.00 44.10 C ATOM 320 CD1 LEU A 193 5.944 -0.414 8.566 1.00 71.41 C ATOM 321 CD2 LEU A 193 7.222 1.446 9.743 1.00 52.11 C ATOM 0 H LEU A 193 3.383 3.784 8.505 1.00 32.42 H new ATOM 0 HA LEU A 193 6.332 3.851 8.769 1.00 61.21 H new ATOM 0 HB2 LEU A 193 4.683 1.701 7.375 1.00 24.14 H new ATOM 0 HB3 LEU A 193 6.402 1.932 7.124 1.00 24.14 H new ATOM 0 HG LEU A 193 5.093 1.151 9.763 1.00 44.10 H new ATOM 0 HD11 LEU A 193 6.157 -1.064 9.414 1.00 71.41 H new ATOM 0 HD12 LEU A 193 4.979 -0.683 8.136 1.00 71.41 H new ATOM 0 HD13 LEU A 193 6.723 -0.533 7.813 1.00 71.41 H new ATOM 0 HD21 LEU A 193 7.413 0.755 10.564 1.00 52.11 H new ATOM 0 HD22 LEU A 193 8.043 1.397 9.028 1.00 52.11 H new ATOM 0 HD23 LEU A 193 7.142 2.460 10.134 1.00 52.11 H new ATOM 333 N TYR A 194 6.485 4.777 6.362 1.00 43.10 N ATOM 334 CA TYR A 194 6.568 5.455 5.056 1.00 2.15 C ATOM 335 C TYR A 194 7.511 4.660 4.145 1.00 61.14 C ATOM 336 O TYR A 194 8.671 4.432 4.513 1.00 25.34 O ATOM 337 CB TYR A 194 7.094 6.910 5.215 1.00 73.33 C ATOM 338 CG TYR A 194 6.108 7.885 5.879 1.00 3.34 C ATOM 339 CD1 TYR A 194 5.915 7.900 7.262 1.00 43.43 C ATOM 340 CD2 TYR A 194 5.374 8.792 5.115 1.00 14.33 C ATOM 341 CE1 TYR A 194 5.030 8.780 7.852 1.00 5.11 C ATOM 342 CE2 TYR A 194 4.488 9.669 5.705 1.00 63.34 C ATOM 343 CZ TYR A 194 4.322 9.657 7.073 1.00 13.35 C ATOM 344 OH TYR A 194 3.446 10.537 7.663 1.00 43.14 O ATOM 0 H TYR A 194 7.393 4.646 6.809 1.00 43.10 H new ATOM 0 HA TYR A 194 5.571 5.503 4.618 1.00 2.15 H new ATOM 0 HB2 TYR A 194 8.011 6.887 5.803 1.00 73.33 H new ATOM 0 HB3 TYR A 194 7.356 7.296 4.230 1.00 73.33 H new ATOM 0 HD1 TYR A 194 6.469 7.210 7.882 1.00 43.43 H new ATOM 0 HD2 TYR A 194 5.502 8.808 4.043 1.00 14.33 H new ATOM 0 HE1 TYR A 194 4.896 8.777 8.924 1.00 5.11 H new ATOM 0 HE2 TYR A 194 3.926 10.363 5.097 1.00 63.34 H new ATOM 0 HH TYR A 194 3.024 11.091 6.973 1.00 43.14 H new ATOM 354 N ALA A 195 7.007 4.242 2.969 1.00 13.54 N ATOM 355 CA ALA A 195 7.791 3.485 1.980 1.00 3.15 C ATOM 356 C ALA A 195 7.181 3.633 0.576 1.00 13.02 C ATOM 357 O ALA A 195 6.095 4.197 0.412 1.00 41.15 O ATOM 358 CB ALA A 195 7.879 2.003 2.397 1.00 75.41 C ATOM 0 H ALA A 195 6.045 4.420 2.679 1.00 13.54 H new ATOM 0 HA ALA A 195 8.802 3.891 1.946 1.00 3.15 H new ATOM 0 HB1 ALA A 195 8.461 1.451 1.659 1.00 75.41 H new ATOM 0 HB2 ALA A 195 8.363 1.927 3.371 1.00 75.41 H new ATOM 0 HB3 ALA A 195 6.876 1.582 2.456 1.00 75.41 H new ATOM 364 N THR A 196 7.914 3.145 -0.430 1.00 34.15 N ATOM 365 CA THR A 196 7.452 3.091 -1.826 1.00 0.33 C ATOM 366 C THR A 196 6.875 1.698 -2.131 1.00 3.21 C ATOM 367 O THR A 196 7.269 0.703 -1.514 1.00 34.00 O ATOM 368 CB THR A 196 8.611 3.426 -2.817 1.00 74.11 C ATOM 369 OG1 THR A 196 9.780 2.667 -2.469 1.00 22.21 O ATOM 370 CG2 THR A 196 8.936 4.933 -2.822 1.00 53.34 C ATOM 0 H THR A 196 8.854 2.772 -0.300 1.00 34.15 H new ATOM 0 HA THR A 196 6.672 3.840 -1.959 1.00 0.33 H new ATOM 0 HB THR A 196 8.286 3.156 -3.822 1.00 74.11 H new ATOM 0 HG1 THR A 196 10.505 2.878 -3.094 1.00 22.21 H new ATOM 0 HG21 THR A 196 9.747 5.128 -3.523 1.00 53.34 H new ATOM 0 HG22 THR A 196 8.052 5.495 -3.124 1.00 53.34 H new ATOM 0 HG23 THR A 196 9.239 5.243 -1.822 1.00 53.34 H new ATOM 378 N LEU A 197 5.939 1.643 -3.086 1.00 72.14 N ATOM 379 CA LEU A 197 5.231 0.407 -3.456 1.00 1.34 C ATOM 380 C LEU A 197 5.549 0.036 -4.911 1.00 71.30 C ATOM 381 O LEU A 197 5.183 0.771 -5.831 1.00 75.42 O ATOM 382 CB LEU A 197 3.702 0.589 -3.260 1.00 5.54 C ATOM 383 CG LEU A 197 2.833 -0.685 -3.486 1.00 61.22 C ATOM 384 CD1 LEU A 197 3.306 -1.834 -2.585 1.00 50.03 C ATOM 385 CD2 LEU A 197 1.339 -0.384 -3.269 1.00 33.13 C ATOM 0 H LEU A 197 5.649 2.457 -3.628 1.00 72.14 H new ATOM 0 HA LEU A 197 5.567 -0.404 -2.810 1.00 1.34 H new ATOM 0 HB2 LEU A 197 3.525 0.952 -2.247 1.00 5.54 H new ATOM 0 HB3 LEU A 197 3.357 1.367 -3.942 1.00 5.54 H new ATOM 0 HG LEU A 197 2.957 -0.999 -4.522 1.00 61.22 H new ATOM 0 HD11 LEU A 197 2.685 -2.713 -2.760 1.00 50.03 H new ATOM 0 HD12 LEU A 197 4.345 -2.072 -2.814 1.00 50.03 H new ATOM 0 HD13 LEU A 197 3.225 -1.534 -1.540 1.00 50.03 H new ATOM 0 HD21 LEU A 197 0.757 -1.291 -3.434 1.00 33.13 H new ATOM 0 HD22 LEU A 197 1.183 -0.033 -2.249 1.00 33.13 H new ATOM 0 HD23 LEU A 197 1.017 0.386 -3.971 1.00 33.13 H new ATOM 397 N ASP A 198 6.238 -1.101 -5.108 1.00 45.32 N ATOM 398 CA ASP A 198 6.563 -1.626 -6.446 1.00 55.31 C ATOM 399 C ASP A 198 5.303 -2.239 -7.072 1.00 73.54 C ATOM 400 O ASP A 198 4.903 -3.354 -6.710 1.00 1.41 O ATOM 401 CB ASP A 198 7.680 -2.698 -6.369 1.00 63.23 C ATOM 402 CG ASP A 198 8.973 -2.171 -5.739 1.00 2.14 C ATOM 403 OD1 ASP A 198 9.068 -2.149 -4.494 1.00 32.34 O ATOM 404 OD2 ASP A 198 9.893 -1.769 -6.480 1.00 30.33 O ATOM 0 H ASP A 198 6.585 -1.682 -4.345 1.00 45.32 H new ATOM 0 HA ASP A 198 6.923 -0.802 -7.062 1.00 55.31 H new ATOM 0 HB2 ASP A 198 7.320 -3.548 -5.790 1.00 63.23 H new ATOM 0 HB3 ASP A 198 7.894 -3.064 -7.373 1.00 63.23 H new ATOM 409 N VAL A 199 4.662 -1.487 -7.971 1.00 52.21 N ATOM 410 CA VAL A 199 3.476 -1.953 -8.709 1.00 45.15 C ATOM 411 C VAL A 199 3.856 -2.150 -10.182 1.00 50.20 C ATOM 412 O VAL A 199 4.139 -1.159 -10.854 1.00 2.25 O ATOM 413 CB VAL A 199 2.277 -0.938 -8.605 1.00 35.21 C ATOM 414 CG1 VAL A 199 1.023 -1.475 -9.347 1.00 11.22 C ATOM 415 CG2 VAL A 199 1.959 -0.625 -7.131 1.00 62.42 C ATOM 0 H VAL A 199 4.948 -0.538 -8.210 1.00 52.21 H new ATOM 0 HA VAL A 199 3.147 -2.893 -8.265 1.00 45.15 H new ATOM 0 HB VAL A 199 2.575 -0.010 -9.092 1.00 35.21 H new ATOM 0 HG11 VAL A 199 0.211 -0.753 -9.258 1.00 11.22 H new ATOM 0 HG12 VAL A 199 1.260 -1.627 -10.400 1.00 11.22 H new ATOM 0 HG13 VAL A 199 0.716 -2.423 -8.904 1.00 11.22 H new ATOM 0 HG21 VAL A 199 1.128 0.078 -7.080 1.00 62.42 H new ATOM 0 HG22 VAL A 199 1.688 -1.545 -6.614 1.00 62.42 H new ATOM 0 HG23 VAL A 199 2.836 -0.186 -6.655 1.00 62.42 H new ATOM 425 N PRO A 200 3.914 -3.427 -10.698 1.00 52.13 N ATOM 426 CA PRO A 200 4.127 -3.700 -12.137 1.00 33.34 C ATOM 427 C PRO A 200 3.110 -2.947 -13.014 1.00 65.55 C ATOM 428 O PRO A 200 1.925 -2.860 -12.655 1.00 61.21 O ATOM 429 CB PRO A 200 3.959 -5.239 -12.248 1.00 14.32 C ATOM 430 CG PRO A 200 4.337 -5.741 -10.883 1.00 74.14 C ATOM 431 CD PRO A 200 3.806 -4.695 -9.926 1.00 23.02 C ATOM 0 HA PRO A 200 5.101 -3.361 -12.490 1.00 33.34 H new ATOM 0 HB2 PRO A 200 2.936 -5.512 -12.505 1.00 14.32 H new ATOM 0 HB3 PRO A 200 4.604 -5.657 -13.021 1.00 14.32 H new ATOM 0 HG2 PRO A 200 3.897 -6.718 -10.685 1.00 74.14 H new ATOM 0 HG3 PRO A 200 5.417 -5.853 -10.788 1.00 74.14 H new ATOM 0 HD2 PRO A 200 2.776 -4.902 -9.637 1.00 23.02 H new ATOM 0 HD3 PRO A 200 4.393 -4.657 -9.008 1.00 23.02 H new ATOM 439 N ALA A 201 3.608 -2.388 -14.137 1.00 50.02 N ATOM 440 CA ALA A 201 2.809 -1.585 -15.097 1.00 14.22 C ATOM 441 C ALA A 201 1.431 -2.234 -15.472 1.00 60.41 C ATOM 442 O ALA A 201 0.407 -1.524 -15.401 1.00 61.41 O ATOM 443 CB ALA A 201 3.650 -1.255 -16.352 1.00 23.43 C ATOM 0 H ALA A 201 4.587 -2.480 -14.409 1.00 50.02 H new ATOM 0 HA ALA A 201 2.554 -0.655 -14.590 1.00 14.22 H new ATOM 0 HB1 ALA A 201 3.051 -0.666 -17.047 1.00 23.43 H new ATOM 0 HB2 ALA A 201 4.532 -0.685 -16.059 1.00 23.43 H new ATOM 0 HB3 ALA A 201 3.961 -2.181 -16.836 1.00 23.43 H new ATOM 449 N PRO A 202 1.362 -3.583 -15.839 1.00 32.20 N ATOM 450 CA PRO A 202 0.064 -4.286 -16.090 1.00 12.11 C ATOM 451 C PRO A 202 -0.916 -4.163 -14.902 1.00 34.43 C ATOM 452 O PRO A 202 -2.081 -3.818 -15.096 1.00 70.12 O ATOM 453 CB PRO A 202 0.488 -5.772 -16.336 1.00 13.51 C ATOM 454 CG PRO A 202 1.898 -5.869 -15.823 1.00 55.32 C ATOM 455 CD PRO A 202 2.510 -4.517 -16.076 1.00 20.40 C ATOM 0 HA PRO A 202 -0.479 -3.854 -16.931 1.00 12.11 H new ATOM 0 HB2 PRO A 202 -0.171 -6.462 -15.809 1.00 13.51 H new ATOM 0 HB3 PRO A 202 0.436 -6.027 -17.395 1.00 13.51 H new ATOM 0 HG2 PRO A 202 1.914 -6.115 -14.761 1.00 55.32 H new ATOM 0 HG3 PRO A 202 2.451 -6.653 -16.340 1.00 55.32 H new ATOM 0 HD2 PRO A 202 3.341 -4.316 -15.400 1.00 20.40 H new ATOM 0 HD3 PRO A 202 2.898 -4.432 -17.091 1.00 20.40 H new ATOM 463 N ILE A 203 -0.395 -4.393 -13.680 1.00 51.42 N ATOM 464 CA ILE A 203 -1.185 -4.407 -12.430 1.00 61.45 C ATOM 465 C ILE A 203 -1.693 -2.988 -12.077 1.00 25.51 C ATOM 466 O ILE A 203 -2.761 -2.835 -11.481 1.00 3.03 O ATOM 467 CB ILE A 203 -0.339 -5.022 -11.244 1.00 44.33 C ATOM 468 CG1 ILE A 203 0.081 -6.492 -11.580 1.00 42.44 C ATOM 469 CG2 ILE A 203 -1.102 -4.951 -9.902 1.00 1.43 C ATOM 470 CD1 ILE A 203 0.842 -7.220 -10.482 1.00 73.05 C ATOM 0 H ILE A 203 0.597 -4.576 -13.530 1.00 51.42 H new ATOM 0 HA ILE A 203 -2.058 -5.040 -12.586 1.00 61.45 H new ATOM 0 HB ILE A 203 0.564 -4.423 -11.130 1.00 44.33 H new ATOM 0 HG12 ILE A 203 -0.817 -7.063 -11.817 1.00 42.44 H new ATOM 0 HG13 ILE A 203 0.697 -6.479 -12.479 1.00 42.44 H new ATOM 0 HG21 ILE A 203 -0.489 -5.383 -9.111 1.00 1.43 H new ATOM 0 HG22 ILE A 203 -1.322 -3.910 -9.663 1.00 1.43 H new ATOM 0 HG23 ILE A 203 -2.035 -5.509 -9.984 1.00 1.43 H new ATOM 0 HD11 ILE A 203 1.085 -8.229 -10.815 1.00 73.05 H new ATOM 0 HD12 ILE A 203 1.762 -6.680 -10.258 1.00 73.05 H new ATOM 0 HD13 ILE A 203 0.225 -7.273 -9.585 1.00 73.05 H new ATOM 482 N ALA A 204 -0.924 -1.962 -12.472 1.00 4.02 N ATOM 483 CA ALA A 204 -1.300 -0.549 -12.263 1.00 61.15 C ATOM 484 C ALA A 204 -2.509 -0.159 -13.136 1.00 3.14 C ATOM 485 O ALA A 204 -3.401 0.582 -12.693 1.00 54.52 O ATOM 486 CB ALA A 204 -0.099 0.355 -12.556 1.00 64.34 C ATOM 0 H ALA A 204 -0.028 -2.084 -12.943 1.00 4.02 H new ATOM 0 HA ALA A 204 -1.595 -0.418 -11.222 1.00 61.15 H new ATOM 0 HB1 ALA A 204 -0.381 1.396 -12.401 1.00 64.34 H new ATOM 0 HB2 ALA A 204 0.722 0.098 -11.887 1.00 64.34 H new ATOM 0 HB3 ALA A 204 0.218 0.215 -13.590 1.00 64.34 H new ATOM 492 N VAL A 205 -2.516 -0.662 -14.385 1.00 73.52 N ATOM 493 CA VAL A 205 -3.598 -0.413 -15.357 1.00 13.30 C ATOM 494 C VAL A 205 -4.889 -1.162 -14.956 1.00 30.43 C ATOM 495 O VAL A 205 -5.965 -0.557 -14.837 1.00 33.34 O ATOM 496 CB VAL A 205 -3.145 -0.837 -16.807 1.00 32.30 C ATOM 497 CG1 VAL A 205 -4.263 -0.618 -17.855 1.00 4.13 C ATOM 498 CG2 VAL A 205 -1.851 -0.099 -17.221 1.00 74.33 C ATOM 0 H VAL A 205 -1.770 -1.254 -14.749 1.00 73.52 H new ATOM 0 HA VAL A 205 -3.813 0.656 -15.356 1.00 13.30 H new ATOM 0 HB VAL A 205 -2.937 -1.907 -16.776 1.00 32.30 H new ATOM 0 HG11 VAL A 205 -3.905 -0.924 -18.838 1.00 4.13 H new ATOM 0 HG12 VAL A 205 -5.136 -1.213 -17.585 1.00 4.13 H new ATOM 0 HG13 VAL A 205 -4.536 0.437 -17.880 1.00 4.13 H new ATOM 0 HG21 VAL A 205 -1.560 -0.409 -18.225 1.00 74.33 H new ATOM 0 HG22 VAL A 205 -2.026 0.977 -17.210 1.00 74.33 H new ATOM 0 HG23 VAL A 205 -1.053 -0.343 -16.520 1.00 74.33 H new ATOM 508 N VAL A 206 -4.759 -2.477 -14.723 1.00 60.25 N ATOM 509 CA VAL A 206 -5.915 -3.372 -14.489 1.00 60.23 C ATOM 510 C VAL A 206 -6.445 -3.282 -13.040 1.00 10.53 C ATOM 511 O VAL A 206 -7.643 -3.479 -12.804 1.00 2.54 O ATOM 512 CB VAL A 206 -5.575 -4.867 -14.842 1.00 50.01 C ATOM 513 CG1 VAL A 206 -5.069 -4.989 -16.295 1.00 53.42 C ATOM 514 CG2 VAL A 206 -4.565 -5.486 -13.850 1.00 54.51 C ATOM 0 H VAL A 206 -3.857 -2.953 -14.690 1.00 60.25 H new ATOM 0 HA VAL A 206 -6.703 -3.026 -15.158 1.00 60.23 H new ATOM 0 HB VAL A 206 -6.500 -5.436 -14.751 1.00 50.01 H new ATOM 0 HG11 VAL A 206 -4.841 -6.032 -16.514 1.00 53.42 H new ATOM 0 HG12 VAL A 206 -5.839 -4.634 -16.980 1.00 53.42 H new ATOM 0 HG13 VAL A 206 -4.169 -4.387 -16.419 1.00 53.42 H new ATOM 0 HG21 VAL A 206 -4.361 -6.518 -14.135 1.00 54.51 H new ATOM 0 HG22 VAL A 206 -3.637 -4.914 -13.871 1.00 54.51 H new ATOM 0 HG23 VAL A 206 -4.983 -5.463 -12.843 1.00 54.51 H new ATOM 524 N GLY A 207 -5.541 -2.975 -12.092 1.00 64.10 N ATOM 525 CA GLY A 207 -5.873 -2.916 -10.668 1.00 14.43 C ATOM 526 C GLY A 207 -5.825 -4.280 -9.995 1.00 70.12 C ATOM 527 O GLY A 207 -6.747 -5.085 -10.161 1.00 50.14 O ATOM 0 H GLY A 207 -4.565 -2.762 -12.297 1.00 64.10 H new ATOM 0 HA2 GLY A 207 -5.178 -2.243 -10.165 1.00 14.43 H new ATOM 0 HA3 GLY A 207 -6.870 -2.492 -10.549 1.00 14.43 H new ATOM 531 N GLY A 208 -4.755 -4.532 -9.225 1.00 1.32 N ATOM 532 CA GLY A 208 -4.561 -5.811 -8.536 1.00 41.14 C ATOM 533 C GLY A 208 -3.604 -5.690 -7.359 1.00 64.30 C ATOM 534 O GLY A 208 -3.049 -4.621 -7.125 1.00 22.21 O ATOM 0 H GLY A 208 -4.006 -3.858 -9.065 1.00 1.32 H new ATOM 0 HA2 GLY A 208 -5.523 -6.181 -8.183 1.00 41.14 H new ATOM 0 HA3 GLY A 208 -4.176 -6.547 -9.241 1.00 41.14 H new ATOM 538 N LYS A 209 -3.383 -6.802 -6.639 1.00 31.23 N ATOM 539 CA LYS A 209 -2.505 -6.828 -5.451 1.00 32.12 C ATOM 540 C LYS A 209 -1.026 -6.978 -5.850 1.00 33.33 C ATOM 541 O LYS A 209 -0.707 -7.610 -6.865 1.00 32.13 O ATOM 542 CB LYS A 209 -2.911 -7.976 -4.484 1.00 41.52 C ATOM 543 CG LYS A 209 -4.184 -7.702 -3.649 1.00 33.32 C ATOM 544 CD LYS A 209 -4.432 -8.752 -2.546 1.00 34.21 C ATOM 545 CE LYS A 209 -4.590 -10.179 -3.098 1.00 21.20 C ATOM 546 NZ LYS A 209 -5.727 -10.293 -4.048 1.00 41.42 N ATOM 0 H LYS A 209 -3.804 -7.705 -6.860 1.00 31.23 H new ATOM 0 HA LYS A 209 -2.628 -5.875 -4.937 1.00 32.12 H new ATOM 0 HB2 LYS A 209 -3.064 -8.885 -5.066 1.00 41.52 H new ATOM 0 HB3 LYS A 209 -2.082 -8.169 -3.803 1.00 41.52 H new ATOM 0 HG2 LYS A 209 -4.103 -6.716 -3.190 1.00 33.32 H new ATOM 0 HG3 LYS A 209 -5.047 -7.674 -4.314 1.00 33.32 H new ATOM 0 HD2 LYS A 209 -3.602 -8.732 -1.840 1.00 34.21 H new ATOM 0 HD3 LYS A 209 -5.330 -8.482 -1.990 1.00 34.21 H new ATOM 0 HE2 LYS A 209 -3.669 -10.476 -3.600 1.00 21.20 H new ATOM 0 HE3 LYS A 209 -4.740 -10.872 -2.270 1.00 21.20 H new ATOM 0 HZ1 LYS A 209 -5.847 -11.287 -4.328 1.00 41.42 H new ATOM 0 HZ2 LYS A 209 -6.597 -9.955 -3.590 1.00 41.42 H new ATOM 0 HZ3 LYS A 209 -5.533 -9.717 -4.892 1.00 41.42 H new ATOM 560 N VAL A 210 -0.130 -6.385 -5.033 1.00 5.40 N ATOM 561 CA VAL A 210 1.344 -6.484 -5.206 1.00 24.02 C ATOM 562 C VAL A 210 2.024 -6.727 -3.843 1.00 4.43 C ATOM 563 O VAL A 210 1.553 -6.233 -2.814 1.00 44.31 O ATOM 564 CB VAL A 210 1.952 -5.186 -5.865 1.00 11.14 C ATOM 565 CG1 VAL A 210 1.405 -4.964 -7.282 1.00 52.44 C ATOM 566 CG2 VAL A 210 1.713 -3.938 -4.995 1.00 0.02 C ATOM 0 H VAL A 210 -0.405 -5.820 -4.229 1.00 5.40 H new ATOM 0 HA VAL A 210 1.533 -7.324 -5.874 1.00 24.02 H new ATOM 0 HB VAL A 210 3.028 -5.345 -5.936 1.00 11.14 H new ATOM 0 HG11 VAL A 210 1.846 -4.061 -7.705 1.00 52.44 H new ATOM 0 HG12 VAL A 210 1.659 -5.819 -7.908 1.00 52.44 H new ATOM 0 HG13 VAL A 210 0.321 -4.854 -7.241 1.00 52.44 H new ATOM 0 HG21 VAL A 210 2.147 -3.065 -5.484 1.00 0.02 H new ATOM 0 HG22 VAL A 210 0.642 -3.786 -4.864 1.00 0.02 H new ATOM 0 HG23 VAL A 210 2.181 -4.079 -4.021 1.00 0.02 H new ATOM 576 N ARG A 211 3.145 -7.464 -3.843 1.00 62.20 N ATOM 577 CA ARG A 211 3.877 -7.801 -2.607 1.00 1.11 C ATOM 578 C ARG A 211 4.800 -6.648 -2.164 1.00 23.53 C ATOM 579 O ARG A 211 5.780 -6.319 -2.837 1.00 45.02 O ATOM 580 CB ARG A 211 4.657 -9.135 -2.780 1.00 63.54 C ATOM 581 CG ARG A 211 3.795 -10.394 -2.535 1.00 75.11 C ATOM 582 CD ARG A 211 4.446 -11.684 -3.046 1.00 50.21 C ATOM 583 NE ARG A 211 4.634 -11.667 -4.513 1.00 15.31 N ATOM 584 CZ ARG A 211 4.203 -12.615 -5.370 1.00 23.31 C ATOM 585 NH1 ARG A 211 3.531 -13.683 -4.930 1.00 55.35 N ATOM 586 NH2 ARG A 211 4.463 -12.490 -6.663 1.00 42.12 N ATOM 0 H ARG A 211 3.569 -7.842 -4.690 1.00 62.20 H new ATOM 0 HA ARG A 211 3.148 -7.944 -1.809 1.00 1.11 H new ATOM 0 HB2 ARG A 211 5.068 -9.177 -3.789 1.00 63.54 H new ATOM 0 HB3 ARG A 211 5.502 -9.144 -2.091 1.00 63.54 H new ATOM 0 HG2 ARG A 211 3.602 -10.491 -1.467 1.00 75.11 H new ATOM 0 HG3 ARG A 211 2.829 -10.265 -3.023 1.00 75.11 H new ATOM 0 HD2 ARG A 211 5.411 -11.821 -2.558 1.00 50.21 H new ATOM 0 HD3 ARG A 211 3.826 -12.537 -2.770 1.00 50.21 H new ATOM 0 HE ARG A 211 5.132 -10.870 -4.910 1.00 15.31 H new ATOM 0 HH11 ARG A 211 3.338 -13.789 -3.934 1.00 55.35 H new ATOM 0 HH12 ARG A 211 3.211 -14.392 -5.590 1.00 55.35 H new ATOM 0 HH21 ARG A 211 4.985 -11.682 -7.002 1.00 42.12 H new ATOM 0 HH22 ARG A 211 4.141 -13.202 -7.319 1.00 42.12 H new ATOM 600 N ALA A 212 4.429 -6.032 -1.037 1.00 64.12 N ATOM 601 CA ALA A 212 5.234 -5.040 -0.316 1.00 25.30 C ATOM 602 C ALA A 212 5.887 -5.709 0.900 1.00 15.31 C ATOM 603 O ALA A 212 5.269 -6.572 1.538 1.00 21.53 O ATOM 604 CB ALA A 212 4.334 -3.888 0.151 1.00 13.55 C ATOM 0 H ALA A 212 3.532 -6.216 -0.587 1.00 64.12 H new ATOM 0 HA ALA A 212 6.007 -4.646 -0.976 1.00 25.30 H new ATOM 0 HB1 ALA A 212 4.934 -3.152 0.686 1.00 13.55 H new ATOM 0 HB2 ALA A 212 3.868 -3.416 -0.714 1.00 13.55 H new ATOM 0 HB3 ALA A 212 3.560 -4.276 0.813 1.00 13.55 H new ATOM 610 N MET A 213 7.131 -5.326 1.213 1.00 52.00 N ATOM 611 CA MET A 213 7.844 -5.828 2.397 1.00 1.44 C ATOM 612 C MET A 213 7.790 -4.784 3.519 1.00 41.40 C ATOM 613 O MET A 213 8.307 -3.671 3.370 1.00 53.35 O ATOM 614 CB MET A 213 9.303 -6.189 2.037 1.00 22.31 C ATOM 615 CG MET A 213 10.137 -6.755 3.203 1.00 75.55 C ATOM 616 SD MET A 213 9.335 -8.141 4.054 1.00 60.24 S ATOM 617 CE MET A 213 9.020 -9.294 2.713 1.00 65.44 C ATOM 0 H MET A 213 7.670 -4.663 0.657 1.00 52.00 H new ATOM 0 HA MET A 213 7.356 -6.736 2.750 1.00 1.44 H new ATOM 0 HB2 MET A 213 9.292 -6.920 1.228 1.00 22.31 H new ATOM 0 HB3 MET A 213 9.799 -5.297 1.654 1.00 22.31 H new ATOM 0 HG2 MET A 213 11.105 -7.082 2.823 1.00 75.55 H new ATOM 0 HG3 MET A 213 10.330 -5.959 3.922 1.00 75.55 H new ATOM 0 HE1 MET A 213 8.646 -10.233 3.121 1.00 65.44 H new ATOM 0 HE2 MET A 213 8.278 -8.871 2.036 1.00 65.44 H new ATOM 0 HE3 MET A 213 9.945 -9.479 2.167 1.00 65.44 H new ATOM 627 N THR A 214 7.135 -5.155 4.624 1.00 33.11 N ATOM 628 CA THR A 214 7.017 -4.325 5.828 1.00 41.23 C ATOM 629 C THR A 214 7.834 -4.949 6.957 1.00 42.14 C ATOM 630 O THR A 214 8.477 -6.001 6.773 1.00 31.34 O ATOM 631 CB THR A 214 5.521 -4.191 6.265 1.00 21.01 C ATOM 632 OG1 THR A 214 4.980 -5.487 6.578 1.00 12.40 O ATOM 633 CG2 THR A 214 4.665 -3.527 5.180 1.00 2.03 C ATOM 0 H THR A 214 6.664 -6.056 4.709 1.00 33.11 H new ATOM 0 HA THR A 214 7.399 -3.329 5.606 1.00 41.23 H new ATOM 0 HB THR A 214 5.496 -3.555 7.150 1.00 21.01 H new ATOM 0 HG1 THR A 214 5.283 -6.138 5.911 1.00 12.40 H new ATOM 0 HG21 THR A 214 3.633 -3.454 5.525 1.00 2.03 H new ATOM 0 HG22 THR A 214 5.050 -2.529 4.973 1.00 2.03 H new ATOM 0 HG23 THR A 214 4.702 -4.126 4.270 1.00 2.03 H new ATOM 641 N LEU A 215 7.799 -4.314 8.136 1.00 15.30 N ATOM 642 CA LEU A 215 8.566 -4.761 9.307 1.00 60.12 C ATOM 643 C LEU A 215 7.884 -5.972 9.972 1.00 40.32 C ATOM 644 O LEU A 215 8.425 -6.565 10.911 1.00 24.24 O ATOM 645 CB LEU A 215 8.737 -3.588 10.309 1.00 20.45 C ATOM 646 CG LEU A 215 9.244 -2.229 9.711 1.00 12.34 C ATOM 647 CD1 LEU A 215 9.656 -1.241 10.814 1.00 13.21 C ATOM 648 CD2 LEU A 215 10.379 -2.419 8.687 1.00 42.33 C ATOM 0 H LEU A 215 7.240 -3.478 8.305 1.00 15.30 H new ATOM 0 HA LEU A 215 9.557 -5.079 8.982 1.00 60.12 H new ATOM 0 HB2 LEU A 215 7.777 -3.411 10.795 1.00 20.45 H new ATOM 0 HB3 LEU A 215 9.435 -3.901 11.086 1.00 20.45 H new ATOM 0 HG LEU A 215 8.399 -1.799 9.173 1.00 12.34 H new ATOM 0 HD11 LEU A 215 10.001 -0.312 10.360 1.00 13.21 H new ATOM 0 HD12 LEU A 215 8.800 -1.035 11.456 1.00 13.21 H new ATOM 0 HD13 LEU A 215 10.460 -1.675 11.409 1.00 13.21 H new ATOM 0 HD21 LEU A 215 10.691 -1.447 8.305 1.00 42.33 H new ATOM 0 HD22 LEU A 215 11.225 -2.909 9.169 1.00 42.33 H new ATOM 0 HD23 LEU A 215 10.025 -3.036 7.861 1.00 42.33 H new ATOM 660 N GLU A 216 6.687 -6.325 9.460 1.00 74.13 N ATOM 661 CA GLU A 216 5.901 -7.474 9.914 1.00 14.41 C ATOM 662 C GLU A 216 6.039 -8.657 8.922 1.00 30.02 C ATOM 663 O GLU A 216 5.755 -9.799 9.290 1.00 20.21 O ATOM 664 CB GLU A 216 4.399 -7.073 10.070 1.00 13.11 C ATOM 665 CG GLU A 216 4.127 -5.737 10.827 1.00 73.55 C ATOM 666 CD GLU A 216 4.233 -4.482 9.919 1.00 1.01 C ATOM 667 OE1 GLU A 216 3.325 -4.281 9.074 1.00 41.23 O ATOM 668 OE2 GLU A 216 5.220 -3.714 10.027 1.00 14.35 O ATOM 0 H GLU A 216 6.238 -5.805 8.706 1.00 74.13 H new ATOM 0 HA GLU A 216 6.284 -7.791 10.884 1.00 14.41 H new ATOM 0 HB2 GLU A 216 3.957 -7.002 9.076 1.00 13.11 H new ATOM 0 HB3 GLU A 216 3.881 -7.877 10.593 1.00 13.11 H new ATOM 0 HG2 GLU A 216 3.131 -5.774 11.268 1.00 73.55 H new ATOM 0 HG3 GLU A 216 4.837 -5.643 11.649 1.00 73.55 H new ATOM 675 N GLY A 217 6.472 -8.370 7.669 1.00 23.41 N ATOM 676 CA GLY A 217 6.721 -9.412 6.655 1.00 72.33 C ATOM 677 C GLY A 217 6.109 -9.086 5.287 1.00 24.24 C ATOM 678 O GLY A 217 5.815 -7.917 5.004 1.00 44.43 O ATOM 0 H GLY A 217 6.655 -7.422 7.341 1.00 23.41 H new ATOM 0 HA2 GLY A 217 7.796 -9.549 6.541 1.00 72.33 H new ATOM 0 HA3 GLY A 217 6.315 -10.359 7.010 1.00 72.33 H new ATOM 682 N PRO A 218 5.912 -10.121 4.402 1.00 34.45 N ATOM 683 CA PRO A 218 5.340 -9.933 3.052 1.00 64.14 C ATOM 684 C PRO A 218 3.809 -9.768 3.098 1.00 54.45 C ATOM 685 O PRO A 218 3.088 -10.587 3.689 1.00 71.41 O ATOM 686 CB PRO A 218 5.771 -11.223 2.312 1.00 22.11 C ATOM 687 CG PRO A 218 5.840 -12.277 3.382 1.00 61.02 C ATOM 688 CD PRO A 218 6.218 -11.559 4.672 1.00 4.53 C ATOM 0 HA PRO A 218 5.689 -9.026 2.558 1.00 64.14 H new ATOM 0 HB2 PRO A 218 5.053 -11.493 1.537 1.00 22.11 H new ATOM 0 HB3 PRO A 218 6.736 -11.094 1.822 1.00 22.11 H new ATOM 0 HG2 PRO A 218 4.882 -12.786 3.488 1.00 61.02 H new ATOM 0 HG3 PRO A 218 6.579 -13.038 3.130 1.00 61.02 H new ATOM 0 HD2 PRO A 218 5.644 -11.935 5.519 1.00 4.53 H new ATOM 0 HD3 PRO A 218 7.271 -11.703 4.912 1.00 4.53 H new ATOM 696 N VAL A 219 3.323 -8.681 2.488 1.00 24.54 N ATOM 697 CA VAL A 219 1.896 -8.329 2.443 1.00 50.21 C ATOM 698 C VAL A 219 1.505 -7.961 1.007 1.00 50.43 C ATOM 699 O VAL A 219 2.306 -7.383 0.280 1.00 23.00 O ATOM 700 CB VAL A 219 1.565 -7.145 3.425 1.00 73.15 C ATOM 701 CG1 VAL A 219 1.940 -7.499 4.883 1.00 10.24 C ATOM 702 CG2 VAL A 219 2.225 -5.812 2.991 1.00 4.52 C ATOM 0 H VAL A 219 3.918 -8.009 2.003 1.00 24.54 H new ATOM 0 HA VAL A 219 1.316 -9.193 2.767 1.00 50.21 H new ATOM 0 HB VAL A 219 0.486 -6.996 3.378 1.00 73.15 H new ATOM 0 HG11 VAL A 219 1.698 -6.660 5.535 1.00 10.24 H new ATOM 0 HG12 VAL A 219 1.379 -8.378 5.200 1.00 10.24 H new ATOM 0 HG13 VAL A 219 3.008 -7.709 4.943 1.00 10.24 H new ATOM 0 HG21 VAL A 219 1.965 -5.028 3.703 1.00 4.52 H new ATOM 0 HG22 VAL A 219 3.308 -5.934 2.965 1.00 4.52 H new ATOM 0 HG23 VAL A 219 1.867 -5.535 1.999 1.00 4.52 H new ATOM 712 N GLU A 220 0.289 -8.326 0.583 1.00 75.30 N ATOM 713 CA GLU A 220 -0.239 -7.962 -0.745 1.00 55.13 C ATOM 714 C GLU A 220 -1.222 -6.794 -0.629 1.00 1.54 C ATOM 715 O GLU A 220 -2.290 -6.929 -0.021 1.00 51.35 O ATOM 716 CB GLU A 220 -0.896 -9.181 -1.436 1.00 50.34 C ATOM 717 CG GLU A 220 0.116 -10.154 -2.068 1.00 2.20 C ATOM 718 CD GLU A 220 -0.539 -11.314 -2.826 1.00 2.14 C ATOM 719 OE1 GLU A 220 -1.176 -11.064 -3.872 1.00 60.12 O ATOM 720 OE2 GLU A 220 -0.409 -12.481 -2.396 1.00 71.30 O ATOM 0 H GLU A 220 -0.357 -8.880 1.145 1.00 75.30 H new ATOM 0 HA GLU A 220 0.596 -7.642 -1.369 1.00 55.13 H new ATOM 0 HB2 GLU A 220 -1.498 -9.721 -0.705 1.00 50.34 H new ATOM 0 HB3 GLU A 220 -1.577 -8.826 -2.210 1.00 50.34 H new ATOM 0 HG2 GLU A 220 0.760 -9.601 -2.752 1.00 2.20 H new ATOM 0 HG3 GLU A 220 0.756 -10.559 -1.284 1.00 2.20 H new ATOM 727 N VAL A 221 -0.841 -5.659 -1.243 1.00 13.24 N ATOM 728 CA VAL A 221 -1.601 -4.410 -1.221 1.00 51.35 C ATOM 729 C VAL A 221 -2.466 -4.326 -2.483 1.00 10.31 C ATOM 730 O VAL A 221 -1.927 -4.304 -3.595 1.00 25.21 O ATOM 731 CB VAL A 221 -0.640 -3.159 -1.167 1.00 31.01 C ATOM 732 CG1 VAL A 221 -1.437 -1.843 -0.967 1.00 12.20 C ATOM 733 CG2 VAL A 221 0.443 -3.338 -0.079 1.00 65.52 C ATOM 0 H VAL A 221 0.024 -5.590 -1.779 1.00 13.24 H new ATOM 0 HA VAL A 221 -2.227 -4.402 -0.329 1.00 51.35 H new ATOM 0 HB VAL A 221 -0.132 -3.087 -2.129 1.00 31.01 H new ATOM 0 HG11 VAL A 221 -0.746 -1.001 -0.934 1.00 12.20 H new ATOM 0 HG12 VAL A 221 -2.133 -1.710 -1.795 1.00 12.20 H new ATOM 0 HG13 VAL A 221 -1.993 -1.893 -0.031 1.00 12.20 H new ATOM 0 HG21 VAL A 221 1.091 -2.462 -0.063 1.00 65.52 H new ATOM 0 HG22 VAL A 221 -0.034 -3.454 0.894 1.00 65.52 H new ATOM 0 HG23 VAL A 221 1.037 -4.225 -0.299 1.00 65.52 H new ATOM 743 N ALA A 222 -3.794 -4.317 -2.289 1.00 0.21 N ATOM 744 CA ALA A 222 -4.775 -4.126 -3.360 1.00 72.41 C ATOM 745 C ALA A 222 -4.631 -2.723 -3.963 1.00 42.15 C ATOM 746 O ALA A 222 -5.058 -1.725 -3.365 1.00 11.40 O ATOM 747 CB ALA A 222 -6.194 -4.359 -2.810 1.00 62.54 C ATOM 0 H ALA A 222 -4.219 -4.444 -1.370 1.00 0.21 H new ATOM 0 HA ALA A 222 -4.594 -4.850 -4.155 1.00 72.41 H new ATOM 0 HB1 ALA A 222 -6.922 -4.216 -3.609 1.00 62.54 H new ATOM 0 HB2 ALA A 222 -6.273 -5.376 -2.425 1.00 62.54 H new ATOM 0 HB3 ALA A 222 -6.394 -3.650 -2.006 1.00 62.54 H new ATOM 753 N VAL A 223 -3.964 -2.673 -5.122 1.00 51.11 N ATOM 754 CA VAL A 223 -3.763 -1.440 -5.896 1.00 54.23 C ATOM 755 C VAL A 223 -5.017 -1.183 -6.745 1.00 74.51 C ATOM 756 O VAL A 223 -5.469 -2.102 -7.442 1.00 20.33 O ATOM 757 CB VAL A 223 -2.501 -1.535 -6.841 1.00 4.44 C ATOM 758 CG1 VAL A 223 -2.164 -0.174 -7.501 1.00 72.11 C ATOM 759 CG2 VAL A 223 -1.290 -2.109 -6.079 1.00 54.21 C ATOM 0 H VAL A 223 -3.544 -3.496 -5.554 1.00 51.11 H new ATOM 0 HA VAL A 223 -3.591 -0.621 -5.197 1.00 54.23 H new ATOM 0 HB VAL A 223 -2.749 -2.222 -7.650 1.00 4.44 H new ATOM 0 HG11 VAL A 223 -1.290 -0.287 -8.142 1.00 72.11 H new ATOM 0 HG12 VAL A 223 -3.012 0.160 -8.099 1.00 72.11 H new ATOM 0 HG13 VAL A 223 -1.953 0.564 -6.727 1.00 72.11 H new ATOM 0 HG21 VAL A 223 -0.432 -2.166 -6.749 1.00 54.21 H new ATOM 0 HG22 VAL A 223 -1.050 -1.461 -5.236 1.00 54.21 H new ATOM 0 HG23 VAL A 223 -1.531 -3.107 -5.712 1.00 54.21 H new ATOM 769 N PRO A 224 -5.623 0.041 -6.672 1.00 41.14 N ATOM 770 CA PRO A 224 -6.746 0.424 -7.564 1.00 11.44 C ATOM 771 C PRO A 224 -6.338 0.420 -9.069 1.00 5.22 C ATOM 772 O PRO A 224 -5.147 0.511 -9.387 1.00 22.11 O ATOM 773 CB PRO A 224 -7.119 1.856 -7.071 1.00 0.32 C ATOM 774 CG PRO A 224 -5.903 2.351 -6.344 1.00 64.30 C ATOM 775 CD PRO A 224 -5.300 1.128 -5.699 1.00 44.23 C ATOM 0 HA PRO A 224 -7.578 -0.278 -7.513 1.00 11.44 H new ATOM 0 HB2 PRO A 224 -7.370 2.508 -7.908 1.00 0.32 H new ATOM 0 HB3 PRO A 224 -7.988 1.832 -6.414 1.00 0.32 H new ATOM 0 HG2 PRO A 224 -5.199 2.822 -7.030 1.00 64.30 H new ATOM 0 HG3 PRO A 224 -6.169 3.099 -5.597 1.00 64.30 H new ATOM 0 HD2 PRO A 224 -4.225 1.236 -5.556 1.00 44.23 H new ATOM 0 HD3 PRO A 224 -5.734 0.934 -4.718 1.00 44.23 H new ATOM 783 N PRO A 225 -7.316 0.273 -10.022 1.00 20.33 N ATOM 784 CA PRO A 225 -7.036 0.397 -11.474 1.00 1.34 C ATOM 785 C PRO A 225 -6.726 1.848 -11.883 1.00 41.12 C ATOM 786 O PRO A 225 -7.034 2.788 -11.138 1.00 71.24 O ATOM 787 CB PRO A 225 -8.343 -0.111 -12.142 1.00 32.15 C ATOM 788 CG PRO A 225 -9.414 0.124 -11.117 1.00 0.33 C ATOM 789 CD PRO A 225 -8.747 -0.070 -9.768 1.00 2.24 C ATOM 0 HA PRO A 225 -6.154 -0.169 -11.775 1.00 1.34 H new ATOM 0 HB2 PRO A 225 -8.552 0.431 -13.064 1.00 32.15 H new ATOM 0 HB3 PRO A 225 -8.270 -1.167 -12.402 1.00 32.15 H new ATOM 0 HG2 PRO A 225 -9.828 1.128 -11.207 1.00 0.33 H new ATOM 0 HG3 PRO A 225 -10.241 -0.574 -11.248 1.00 0.33 H new ATOM 0 HD2 PRO A 225 -9.185 0.579 -9.009 1.00 2.24 H new ATOM 0 HD3 PRO A 225 -8.855 -1.095 -9.413 1.00 2.24 H new ATOM 797 N ARG A 226 -6.093 1.997 -13.066 1.00 15.20 N ATOM 798 CA ARG A 226 -5.793 3.305 -13.696 1.00 22.20 C ATOM 799 C ARG A 226 -4.927 4.199 -12.778 1.00 64.11 C ATOM 800 O ARG A 226 -5.031 5.432 -12.803 1.00 24.44 O ATOM 801 CB ARG A 226 -7.105 4.025 -14.128 1.00 73.02 C ATOM 802 CG ARG A 226 -8.025 3.189 -15.049 1.00 60.15 C ATOM 803 CD ARG A 226 -9.236 3.988 -15.569 1.00 3.24 C ATOM 804 NE ARG A 226 -9.990 4.635 -14.478 1.00 63.24 N ATOM 805 CZ ARG A 226 -11.114 4.157 -13.913 1.00 73.54 C ATOM 806 NH1 ARG A 226 -11.647 2.998 -14.308 1.00 74.25 N ATOM 807 NH2 ARG A 226 -11.704 4.841 -12.945 1.00 43.03 N ATOM 0 H ARG A 226 -5.771 1.203 -13.619 1.00 15.20 H new ATOM 0 HA ARG A 226 -5.206 3.114 -14.594 1.00 22.20 H new ATOM 0 HB2 ARG A 226 -7.663 4.302 -13.234 1.00 73.02 H new ATOM 0 HB3 ARG A 226 -6.844 4.951 -14.641 1.00 73.02 H new ATOM 0 HG2 ARG A 226 -7.446 2.823 -15.897 1.00 60.15 H new ATOM 0 HG3 ARG A 226 -8.380 2.315 -14.503 1.00 60.15 H new ATOM 0 HD2 ARG A 226 -8.893 4.748 -16.271 1.00 3.24 H new ATOM 0 HD3 ARG A 226 -9.899 3.321 -16.120 1.00 3.24 H new ATOM 0 HE ARG A 226 -9.629 5.520 -14.122 1.00 63.24 H new ATOM 0 HH11 ARG A 226 -11.202 2.458 -15.050 1.00 74.25 H new ATOM 0 HH12 ARG A 226 -12.500 2.652 -13.867 1.00 74.25 H new ATOM 0 HH21 ARG A 226 -11.306 5.726 -12.631 1.00 43.03 H new ATOM 0 HH22 ARG A 226 -12.556 4.483 -12.514 1.00 43.03 H new ATOM 821 N THR A 227 -4.047 3.548 -12.009 1.00 60.21 N ATOM 822 CA THR A 227 -3.153 4.195 -11.043 1.00 3.24 C ATOM 823 C THR A 227 -1.798 4.513 -11.704 1.00 34.32 C ATOM 824 O THR A 227 -1.174 3.630 -12.298 1.00 2.13 O ATOM 825 CB THR A 227 -2.986 3.268 -9.789 1.00 2.20 C ATOM 826 OG1 THR A 227 -4.232 3.216 -9.086 1.00 53.13 O ATOM 827 CG2 THR A 227 -1.895 3.733 -8.818 1.00 75.42 C ATOM 0 H THR A 227 -3.934 2.535 -12.042 1.00 60.21 H new ATOM 0 HA THR A 227 -3.584 5.140 -10.713 1.00 3.24 H new ATOM 0 HB THR A 227 -2.684 2.289 -10.160 1.00 2.20 H new ATOM 0 HG1 THR A 227 -4.598 2.308 -9.136 1.00 53.13 H new ATOM 0 HG21 THR A 227 -1.839 3.043 -7.976 1.00 75.42 H new ATOM 0 HG22 THR A 227 -0.935 3.756 -9.333 1.00 75.42 H new ATOM 0 HG23 THR A 227 -2.135 4.732 -8.453 1.00 75.42 H new ATOM 835 N GLN A 228 -1.370 5.789 -11.615 1.00 33.33 N ATOM 836 CA GLN A 228 -0.111 6.269 -12.225 1.00 32.12 C ATOM 837 C GLN A 228 1.051 6.216 -11.216 1.00 5.13 C ATOM 838 O GLN A 228 0.834 6.130 -9.999 1.00 32.41 O ATOM 839 CB GLN A 228 -0.263 7.724 -12.764 1.00 22.11 C ATOM 840 CG GLN A 228 -1.350 7.910 -13.854 1.00 3.53 C ATOM 841 CD GLN A 228 -2.781 7.952 -13.315 1.00 63.14 C ATOM 842 OE1 GLN A 228 -3.023 8.358 -12.189 1.00 63.53 O ATOM 843 NE2 GLN A 228 -3.744 7.542 -14.117 1.00 12.14 N ATOM 0 H GLN A 228 -1.886 6.516 -11.119 1.00 33.33 H new ATOM 0 HA GLN A 228 0.113 5.605 -13.060 1.00 32.12 H new ATOM 0 HB2 GLN A 228 -0.493 8.383 -11.927 1.00 22.11 H new ATOM 0 HB3 GLN A 228 0.696 8.047 -13.170 1.00 22.11 H new ATOM 0 HG2 GLN A 228 -1.151 8.835 -14.395 1.00 3.53 H new ATOM 0 HG3 GLN A 228 -1.269 7.096 -14.574 1.00 3.53 H new ATOM 0 HE21 GLN A 228 -3.519 7.207 -15.054 1.00 12.14 H new ATOM 0 HE22 GLN A 228 -4.714 7.560 -13.801 1.00 12.14 H new ATOM 852 N ALA A 229 2.286 6.268 -11.759 1.00 64.12 N ATOM 853 CA ALA A 229 3.521 6.357 -10.969 1.00 11.44 C ATOM 854 C ALA A 229 3.630 7.757 -10.354 1.00 24.32 C ATOM 855 O ALA A 229 3.682 8.754 -11.080 1.00 30.54 O ATOM 856 CB ALA A 229 4.742 6.061 -11.855 1.00 43.20 C ATOM 0 H ALA A 229 2.449 6.249 -12.766 1.00 64.12 H new ATOM 0 HA ALA A 229 3.494 5.617 -10.169 1.00 11.44 H new ATOM 0 HB1 ALA A 229 5.651 6.130 -11.257 1.00 43.20 H new ATOM 0 HB2 ALA A 229 4.656 5.056 -12.269 1.00 43.20 H new ATOM 0 HB3 ALA A 229 4.786 6.786 -12.668 1.00 43.20 H new ATOM 862 N GLY A 230 3.661 7.814 -9.023 1.00 13.43 N ATOM 863 CA GLY A 230 3.645 9.073 -8.285 1.00 50.12 C ATOM 864 C GLY A 230 2.389 9.240 -7.455 1.00 45.44 C ATOM 865 O GLY A 230 2.257 10.242 -6.746 1.00 32.35 O ATOM 0 H GLY A 230 3.698 6.987 -8.427 1.00 13.43 H new ATOM 0 HA2 GLY A 230 4.517 9.120 -7.633 1.00 50.12 H new ATOM 0 HA3 GLY A 230 3.727 9.903 -8.986 1.00 50.12 H new ATOM 869 N ARG A 231 1.449 8.268 -7.542 1.00 21.41 N ATOM 870 CA ARG A 231 0.290 8.215 -6.633 1.00 54.35 C ATOM 871 C ARG A 231 0.725 7.723 -5.249 1.00 73.22 C ATOM 872 O ARG A 231 1.787 7.126 -5.092 1.00 50.13 O ATOM 873 CB ARG A 231 -0.865 7.334 -7.189 1.00 64.53 C ATOM 874 CG ARG A 231 -1.693 7.989 -8.318 1.00 34.25 C ATOM 875 CD ARG A 231 -2.993 7.220 -8.590 1.00 52.32 C ATOM 876 NE ARG A 231 -3.856 7.866 -9.585 1.00 72.31 N ATOM 877 CZ ARG A 231 -5.089 7.447 -9.920 1.00 10.33 C ATOM 878 NH1 ARG A 231 -5.623 6.368 -9.343 1.00 32.41 N ATOM 879 NH2 ARG A 231 -5.772 8.100 -10.849 1.00 5.22 N ATOM 0 H ARG A 231 1.475 7.516 -8.231 1.00 21.41 H new ATOM 0 HA ARG A 231 -0.100 9.229 -6.549 1.00 54.35 H new ATOM 0 HB2 ARG A 231 -0.444 6.400 -7.561 1.00 64.53 H new ATOM 0 HB3 ARG A 231 -1.535 7.077 -6.368 1.00 64.53 H new ATOM 0 HG2 ARG A 231 -1.929 9.018 -8.046 1.00 34.25 H new ATOM 0 HG3 ARG A 231 -1.097 8.029 -9.230 1.00 34.25 H new ATOM 0 HD2 ARG A 231 -2.747 6.215 -8.932 1.00 52.32 H new ATOM 0 HD3 ARG A 231 -3.545 7.113 -7.656 1.00 52.32 H new ATOM 0 HE ARG A 231 -3.494 8.694 -10.058 1.00 72.31 H new ATOM 0 HH11 ARG A 231 -5.095 5.852 -8.640 1.00 32.41 H new ATOM 0 HH12 ARG A 231 -6.559 6.060 -9.606 1.00 32.41 H new ATOM 0 HH21 ARG A 231 -5.362 8.915 -11.305 1.00 5.22 H new ATOM 0 HH22 ARG A 231 -6.708 7.788 -11.108 1.00 5.22 H new ATOM 893 N LYS A 232 -0.116 7.996 -4.251 1.00 2.13 N ATOM 894 CA LYS A 232 0.149 7.667 -2.843 1.00 11.11 C ATOM 895 C LYS A 232 -1.053 6.912 -2.250 1.00 11.23 C ATOM 896 O LYS A 232 -2.209 7.284 -2.493 1.00 74.12 O ATOM 897 CB LYS A 232 0.463 8.980 -2.060 1.00 21.52 C ATOM 898 CG LYS A 232 -0.554 10.120 -2.309 1.00 15.45 C ATOM 899 CD LYS A 232 -0.150 11.453 -1.647 1.00 72.24 C ATOM 900 CE LYS A 232 -1.122 12.590 -1.959 1.00 32.41 C ATOM 901 NZ LYS A 232 -1.206 12.880 -3.415 1.00 74.54 N ATOM 0 H LYS A 232 -1.014 8.458 -4.396 1.00 2.13 H new ATOM 0 HA LYS A 232 1.016 7.012 -2.762 1.00 11.11 H new ATOM 0 HB2 LYS A 232 0.490 8.757 -0.993 1.00 21.52 H new ATOM 0 HB3 LYS A 232 1.458 9.328 -2.338 1.00 21.52 H new ATOM 0 HG2 LYS A 232 -0.662 10.273 -3.383 1.00 15.45 H new ATOM 0 HG3 LYS A 232 -1.530 9.816 -1.931 1.00 15.45 H new ATOM 0 HD2 LYS A 232 -0.095 11.315 -0.567 1.00 72.24 H new ATOM 0 HD3 LYS A 232 0.848 11.732 -1.984 1.00 72.24 H new ATOM 0 HE2 LYS A 232 -2.112 12.331 -1.585 1.00 32.41 H new ATOM 0 HE3 LYS A 232 -0.807 13.489 -1.430 1.00 32.41 H new ATOM 0 HZ1 LYS A 232 -1.711 13.777 -3.562 1.00 74.54 H new ATOM 0 HZ2 LYS A 232 -0.247 12.954 -3.810 1.00 74.54 H new ATOM 0 HZ3 LYS A 232 -1.719 12.112 -3.893 1.00 74.54 H new ATOM 915 N LEU A 233 -0.764 5.824 -1.520 1.00 25.23 N ATOM 916 CA LEU A 233 -1.772 5.040 -0.791 1.00 2.13 C ATOM 917 C LEU A 233 -1.534 5.237 0.706 1.00 23.13 C ATOM 918 O LEU A 233 -0.410 5.059 1.181 1.00 55.11 O ATOM 919 CB LEU A 233 -1.667 3.523 -1.141 1.00 43.42 C ATOM 920 CG LEU A 233 -1.761 3.146 -2.650 1.00 14.13 C ATOM 921 CD1 LEU A 233 -1.606 1.629 -2.857 1.00 33.23 C ATOM 922 CD2 LEU A 233 -3.067 3.648 -3.284 1.00 74.50 C ATOM 0 H LEU A 233 0.184 5.461 -1.418 1.00 25.23 H new ATOM 0 HA LEU A 233 -2.768 5.380 -1.075 1.00 2.13 H new ATOM 0 HB2 LEU A 233 -0.718 3.149 -0.755 1.00 43.42 H new ATOM 0 HB3 LEU A 233 -2.458 2.995 -0.608 1.00 43.42 H new ATOM 0 HG LEU A 233 -0.935 3.646 -3.155 1.00 14.13 H new ATOM 0 HD11 LEU A 233 -1.676 1.398 -3.920 1.00 33.23 H new ATOM 0 HD12 LEU A 233 -0.636 1.307 -2.479 1.00 33.23 H new ATOM 0 HD13 LEU A 233 -2.396 1.106 -2.319 1.00 33.23 H new ATOM 0 HD21 LEU A 233 -3.093 3.365 -4.336 1.00 74.50 H new ATOM 0 HD22 LEU A 233 -3.917 3.203 -2.767 1.00 74.50 H new ATOM 0 HD23 LEU A 233 -3.119 4.733 -3.199 1.00 74.50 H new ATOM 934 N ARG A 234 -2.575 5.635 1.437 1.00 54.14 N ATOM 935 CA ARG A 234 -2.550 5.666 2.904 1.00 32.14 C ATOM 936 C ARG A 234 -3.444 4.535 3.397 1.00 40.15 C ATOM 937 O ARG A 234 -4.677 4.621 3.309 1.00 30.14 O ATOM 938 CB ARG A 234 -3.022 7.032 3.446 1.00 13.05 C ATOM 939 CG ARG A 234 -2.850 7.248 4.960 1.00 72.44 C ATOM 940 CD ARG A 234 -3.295 8.657 5.384 1.00 13.22 C ATOM 941 NE ARG A 234 -2.654 9.724 4.583 1.00 33.43 N ATOM 942 CZ ARG A 234 -1.498 10.339 4.889 1.00 43.12 C ATOM 943 NH1 ARG A 234 -0.819 10.025 5.990 1.00 13.45 N ATOM 944 NH2 ARG A 234 -1.026 11.278 4.087 1.00 33.23 N ATOM 0 H ARG A 234 -3.459 5.945 1.033 1.00 54.14 H new ATOM 0 HA ARG A 234 -1.532 5.530 3.268 1.00 32.14 H new ATOM 0 HB2 ARG A 234 -2.477 7.817 2.922 1.00 13.05 H new ATOM 0 HB3 ARG A 234 -4.076 7.155 3.198 1.00 13.05 H new ATOM 0 HG2 ARG A 234 -3.432 6.503 5.503 1.00 72.44 H new ATOM 0 HG3 ARG A 234 -1.806 7.098 5.233 1.00 72.44 H new ATOM 0 HD2 ARG A 234 -4.378 8.736 5.287 1.00 13.22 H new ATOM 0 HD3 ARG A 234 -3.058 8.807 6.437 1.00 13.22 H new ATOM 0 HE ARG A 234 -3.128 10.017 3.729 1.00 33.43 H new ATOM 0 HH11 ARG A 234 -1.174 9.306 6.620 1.00 13.45 H new ATOM 0 HH12 ARG A 234 0.056 10.504 6.203 1.00 13.45 H new ATOM 0 HH21 ARG A 234 -1.538 11.532 3.242 1.00 33.23 H new ATOM 0 HH22 ARG A 234 -0.150 11.749 4.313 1.00 33.23 H new ATOM 958 N LEU A 235 -2.811 3.452 3.836 1.00 24.22 N ATOM 959 CA LEU A 235 -3.494 2.268 4.359 1.00 71.32 C ATOM 960 C LEU A 235 -3.919 2.562 5.804 1.00 12.33 C ATOM 961 O LEU A 235 -3.132 2.401 6.755 1.00 41.33 O ATOM 962 CB LEU A 235 -2.542 1.058 4.235 1.00 23.42 C ATOM 963 CG LEU A 235 -2.002 0.820 2.783 1.00 40.51 C ATOM 964 CD1 LEU A 235 -0.777 -0.084 2.776 1.00 74.02 C ATOM 965 CD2 LEU A 235 -3.095 0.274 1.863 1.00 24.24 C ATOM 0 H LEU A 235 -1.794 3.368 3.840 1.00 24.22 H new ATOM 0 HA LEU A 235 -4.395 2.025 3.796 1.00 71.32 H new ATOM 0 HB2 LEU A 235 -1.696 1.203 4.907 1.00 23.42 H new ATOM 0 HB3 LEU A 235 -3.064 0.162 4.569 1.00 23.42 H new ATOM 0 HG LEU A 235 -1.693 1.790 2.394 1.00 40.51 H new ATOM 0 HD11 LEU A 235 -0.434 -0.224 1.751 1.00 74.02 H new ATOM 0 HD12 LEU A 235 0.017 0.375 3.365 1.00 74.02 H new ATOM 0 HD13 LEU A 235 -1.036 -1.051 3.207 1.00 74.02 H new ATOM 0 HD21 LEU A 235 -2.687 0.120 0.864 1.00 24.24 H new ATOM 0 HD22 LEU A 235 -3.460 -0.675 2.255 1.00 24.24 H new ATOM 0 HD23 LEU A 235 -3.918 0.987 1.813 1.00 24.24 H new ATOM 977 N LYS A 236 -5.156 3.087 5.909 1.00 13.11 N ATOM 978 CA LYS A 236 -5.723 3.648 7.135 1.00 51.24 C ATOM 979 C LYS A 236 -6.079 2.562 8.141 1.00 12.32 C ATOM 980 O LYS A 236 -6.870 1.654 7.831 1.00 50.13 O ATOM 981 CB LYS A 236 -6.968 4.498 6.803 1.00 72.42 C ATOM 982 CG LYS A 236 -6.715 5.606 5.765 1.00 1.32 C ATOM 983 CD LYS A 236 -7.930 6.535 5.597 1.00 13.34 C ATOM 984 CE LYS A 236 -7.734 7.558 4.472 1.00 62.30 C ATOM 985 NZ LYS A 236 -8.919 8.447 4.323 1.00 14.33 N ATOM 0 H LYS A 236 -5.799 3.130 5.118 1.00 13.11 H new ATOM 0 HA LYS A 236 -4.964 4.283 7.592 1.00 51.24 H new ATOM 0 HB2 LYS A 236 -7.755 3.841 6.432 1.00 72.42 H new ATOM 0 HB3 LYS A 236 -7.339 4.953 7.721 1.00 72.42 H new ATOM 0 HG2 LYS A 236 -5.849 6.195 6.068 1.00 1.32 H new ATOM 0 HG3 LYS A 236 -6.471 5.152 4.804 1.00 1.32 H new ATOM 0 HD2 LYS A 236 -8.816 5.935 5.388 1.00 13.34 H new ATOM 0 HD3 LYS A 236 -8.114 7.061 6.534 1.00 13.34 H new ATOM 0 HE2 LYS A 236 -6.850 8.161 4.679 1.00 62.30 H new ATOM 0 HE3 LYS A 236 -7.551 7.036 3.533 1.00 62.30 H new ATOM 0 HZ1 LYS A 236 -8.750 9.125 3.553 1.00 14.33 H new ATOM 0 HZ2 LYS A 236 -9.758 7.873 4.101 1.00 14.33 H new ATOM 0 HZ3 LYS A 236 -9.079 8.964 5.211 1.00 14.33 H new ATOM 999 N GLY A 237 -5.498 2.670 9.350 1.00 40.11 N ATOM 1000 CA GLY A 237 -5.677 1.662 10.384 1.00 51.14 C ATOM 1001 C GLY A 237 -5.074 0.330 9.978 1.00 71.03 C ATOM 1002 O GLY A 237 -5.534 -0.735 10.403 1.00 72.51 O ATOM 0 H GLY A 237 -4.902 3.451 9.625 1.00 40.11 H new ATOM 0 HA2 GLY A 237 -5.214 2.004 11.310 1.00 51.14 H new ATOM 0 HA3 GLY A 237 -6.740 1.534 10.587 1.00 51.14 H new ATOM 1006 N LYS A 238 -4.046 0.413 9.115 1.00 50.15 N ATOM 1007 CA LYS A 238 -3.368 -0.732 8.511 1.00 32.24 C ATOM 1008 C LYS A 238 -1.864 -0.425 8.464 1.00 52.11 C ATOM 1009 O LYS A 238 -1.285 -0.281 7.400 1.00 71.11 O ATOM 1010 CB LYS A 238 -3.928 -1.019 7.075 1.00 43.13 C ATOM 1011 CG LYS A 238 -5.420 -1.398 7.018 1.00 10.44 C ATOM 1012 CD LYS A 238 -5.718 -2.774 7.653 1.00 23.31 C ATOM 1013 CE LYS A 238 -7.222 -3.001 7.890 1.00 41.44 C ATOM 1014 NZ LYS A 238 -8.026 -2.908 6.641 1.00 11.04 N ATOM 0 H LYS A 238 -3.658 1.307 8.814 1.00 50.15 H new ATOM 0 HA LYS A 238 -3.545 -1.627 9.107 1.00 32.24 H new ATOM 0 HB2 LYS A 238 -3.770 -0.135 6.457 1.00 43.13 H new ATOM 0 HB3 LYS A 238 -3.347 -1.827 6.630 1.00 43.13 H new ATOM 0 HG2 LYS A 238 -6.003 -0.633 7.531 1.00 10.44 H new ATOM 0 HG3 LYS A 238 -5.748 -1.405 5.979 1.00 10.44 H new ATOM 0 HD2 LYS A 238 -5.333 -3.561 7.004 1.00 23.31 H new ATOM 0 HD3 LYS A 238 -5.188 -2.855 8.602 1.00 23.31 H new ATOM 0 HE2 LYS A 238 -7.370 -3.983 8.339 1.00 41.44 H new ATOM 0 HE3 LYS A 238 -7.587 -2.265 8.607 1.00 41.44 H new ATOM 0 HZ1 LYS A 238 -8.669 -3.723 6.581 1.00 11.04 H new ATOM 0 HZ2 LYS A 238 -8.581 -2.029 6.650 1.00 11.04 H new ATOM 0 HZ3 LYS A 238 -7.390 -2.907 5.818 1.00 11.04 H new ATOM 1028 N GLY A 239 -1.282 -0.189 9.638 1.00 12.23 N ATOM 1029 CA GLY A 239 0.173 -0.179 9.824 1.00 0.03 C ATOM 1030 C GLY A 239 0.571 -1.230 10.844 1.00 11.10 C ATOM 1031 O GLY A 239 0.108 -2.372 10.753 1.00 42.33 O ATOM 0 H GLY A 239 -1.806 0.002 10.492 1.00 12.23 H new ATOM 0 HA2 GLY A 239 0.671 -0.375 8.874 1.00 0.03 H new ATOM 0 HA3 GLY A 239 0.499 0.806 10.158 1.00 0.03 H new ATOM 1035 N PHE A 240 1.408 -0.838 11.828 1.00 74.02 N ATOM 1036 CA PHE A 240 1.782 -1.702 12.975 1.00 4.02 C ATOM 1037 C PHE A 240 0.541 -2.115 13.804 1.00 3.43 C ATOM 1038 O PHE A 240 -0.396 -1.321 13.930 1.00 21.33 O ATOM 1039 CB PHE A 240 2.818 -0.991 13.903 1.00 22.25 C ATOM 1040 CG PHE A 240 4.266 -1.358 13.632 1.00 32.52 C ATOM 1041 CD1 PHE A 240 4.938 -0.847 12.530 1.00 62.34 C ATOM 1042 CD2 PHE A 240 4.949 -2.225 14.483 1.00 45.50 C ATOM 1043 CE1 PHE A 240 6.251 -1.189 12.295 1.00 34.24 C ATOM 1044 CE2 PHE A 240 6.253 -2.563 14.244 1.00 21.20 C ATOM 1045 CZ PHE A 240 6.908 -2.047 13.152 1.00 23.11 C ATOM 0 H PHE A 240 1.844 0.084 11.853 1.00 74.02 H new ATOM 0 HA PHE A 240 2.237 -2.601 12.559 1.00 4.02 H new ATOM 0 HB2 PHE A 240 2.704 0.087 13.794 1.00 22.25 H new ATOM 0 HB3 PHE A 240 2.584 -1.233 14.940 1.00 22.25 H new ATOM 0 HD1 PHE A 240 4.428 -0.177 11.853 1.00 62.34 H new ATOM 0 HD2 PHE A 240 4.442 -2.636 15.343 1.00 45.50 H new ATOM 0 HE1 PHE A 240 6.768 -0.784 11.437 1.00 34.24 H new ATOM 0 HE2 PHE A 240 6.768 -3.236 14.914 1.00 21.20 H new ATOM 0 HZ PHE A 240 7.938 -2.313 12.965 1.00 23.11 H new ATOM 1055 N PRO A 241 0.536 -3.365 14.392 1.00 72.22 N ATOM 1056 CA PRO A 241 -0.587 -3.867 15.220 1.00 21.20 C ATOM 1057 C PRO A 241 -0.801 -3.022 16.501 1.00 61.34 C ATOM 1058 O PRO A 241 0.152 -2.708 17.214 1.00 63.20 O ATOM 1059 CB PRO A 241 -0.176 -5.331 15.546 1.00 61.02 C ATOM 1060 CG PRO A 241 1.314 -5.351 15.397 1.00 71.12 C ATOM 1061 CD PRO A 241 1.614 -4.394 14.269 1.00 54.32 C ATOM 0 HA PRO A 241 -1.544 -3.805 14.702 1.00 21.20 H new ATOM 0 HB2 PRO A 241 -0.477 -5.611 16.556 1.00 61.02 H new ATOM 0 HB3 PRO A 241 -0.651 -6.037 14.865 1.00 61.02 H new ATOM 0 HG2 PRO A 241 1.806 -5.039 16.319 1.00 71.12 H new ATOM 0 HG3 PRO A 241 1.673 -6.354 15.168 1.00 71.12 H new ATOM 0 HD2 PRO A 241 2.605 -3.952 14.370 1.00 54.32 H new ATOM 0 HD3 PRO A 241 1.585 -4.893 13.300 1.00 54.32 H new ATOM 1069 N GLY A 242 -2.063 -2.646 16.755 1.00 54.04 N ATOM 1070 CA GLY A 242 -2.431 -1.855 17.932 1.00 74.51 C ATOM 1071 C GLY A 242 -3.775 -2.324 18.495 1.00 10.31 C ATOM 1072 O GLY A 242 -4.691 -2.564 17.702 1.00 4.03 O ATOM 0 H GLY A 242 -2.851 -2.882 16.152 1.00 54.04 H new ATOM 0 HA2 GLY A 242 -1.658 -1.947 18.695 1.00 74.51 H new ATOM 0 HA3 GLY A 242 -2.490 -0.800 17.664 1.00 74.51 H new ATOM 1076 N PRO A 243 -3.925 -2.479 19.856 1.00 71.15 N ATOM 1077 CA PRO A 243 -5.169 -3.001 20.493 1.00 30.11 C ATOM 1078 C PRO A 243 -6.440 -2.182 20.146 1.00 42.13 C ATOM 1079 O PRO A 243 -7.437 -2.736 19.659 1.00 72.31 O ATOM 1080 CB PRO A 243 -4.847 -2.955 22.020 1.00 34.42 C ATOM 1081 CG PRO A 243 -3.658 -2.040 22.153 1.00 32.24 C ATOM 1082 CD PRO A 243 -2.873 -2.198 20.872 1.00 1.04 C ATOM 0 HA PRO A 243 -5.412 -4.000 20.132 1.00 30.11 H new ATOM 0 HB2 PRO A 243 -5.697 -2.579 22.589 1.00 34.42 H new ATOM 0 HB3 PRO A 243 -4.621 -3.950 22.404 1.00 34.42 H new ATOM 0 HG2 PRO A 243 -3.974 -1.006 22.293 1.00 32.24 H new ATOM 0 HG3 PRO A 243 -3.052 -2.309 23.019 1.00 32.24 H new ATOM 0 HD2 PRO A 243 -2.312 -1.295 20.631 1.00 1.04 H new ATOM 0 HD3 PRO A 243 -2.152 -3.013 20.940 1.00 1.04 H new ATOM 1090 N ALA A 244 -6.382 -0.864 20.383 1.00 22.32 N ATOM 1091 CA ALA A 244 -7.519 0.050 20.133 1.00 64.13 C ATOM 1092 C ALA A 244 -7.594 0.459 18.652 1.00 34.34 C ATOM 1093 O ALA A 244 -8.677 0.764 18.138 1.00 62.20 O ATOM 1094 CB ALA A 244 -7.409 1.288 21.037 1.00 60.11 C ATOM 0 H ALA A 244 -5.553 -0.398 20.751 1.00 22.32 H new ATOM 0 HA ALA A 244 -8.441 -0.479 20.373 1.00 64.13 H new ATOM 0 HB1 ALA A 244 -8.250 1.954 20.845 1.00 60.11 H new ATOM 0 HB2 ALA A 244 -7.422 0.978 22.082 1.00 60.11 H new ATOM 0 HB3 ALA A 244 -6.476 1.811 20.826 1.00 60.11 H new ATOM 1100 N GLY A 245 -6.436 0.433 17.977 1.00 41.33 N ATOM 1101 CA GLY A 245 -6.330 0.834 16.578 1.00 2.40 C ATOM 1102 C GLY A 245 -4.915 0.649 16.055 1.00 44.13 C ATOM 1103 O GLY A 245 -3.953 0.922 16.776 1.00 15.13 O ATOM 0 H GLY A 245 -5.552 0.133 18.389 1.00 41.33 H new ATOM 0 HA2 GLY A 245 -7.022 0.246 15.976 1.00 2.40 H new ATOM 0 HA3 GLY A 245 -6.625 1.878 16.474 1.00 2.40 H new ATOM 1107 N ARG A 246 -4.791 0.183 14.807 1.00 73.14 N ATOM 1108 CA ARG A 246 -3.488 -0.008 14.141 1.00 14.33 C ATOM 1109 C ARG A 246 -2.942 1.338 13.625 1.00 41.12 C ATOM 1110 O ARG A 246 -3.650 2.352 13.626 1.00 74.34 O ATOM 1111 CB ARG A 246 -3.640 -1.047 12.984 1.00 31.25 C ATOM 1112 CG ARG A 246 -3.417 -2.509 13.415 1.00 35.21 C ATOM 1113 CD ARG A 246 -3.579 -3.518 12.269 1.00 61.15 C ATOM 1114 NE ARG A 246 -4.994 -3.732 11.906 1.00 41.22 N ATOM 1115 CZ ARG A 246 -5.425 -4.592 10.967 1.00 63.10 C ATOM 1116 NH1 ARG A 246 -4.567 -5.334 10.269 1.00 2.04 N ATOM 1117 NH2 ARG A 246 -6.720 -4.733 10.744 1.00 51.04 N ATOM 0 H ARG A 246 -5.589 -0.074 14.226 1.00 73.14 H new ATOM 0 HA ARG A 246 -2.767 -0.397 14.860 1.00 14.33 H new ATOM 0 HB2 ARG A 246 -4.638 -0.954 12.556 1.00 31.25 H new ATOM 0 HB3 ARG A 246 -2.931 -0.801 12.194 1.00 31.25 H new ATOM 0 HG2 ARG A 246 -2.416 -2.607 13.835 1.00 35.21 H new ATOM 0 HG3 ARG A 246 -4.122 -2.757 14.209 1.00 35.21 H new ATOM 0 HD2 ARG A 246 -3.032 -3.163 11.396 1.00 61.15 H new ATOM 0 HD3 ARG A 246 -3.133 -4.469 12.560 1.00 61.15 H new ATOM 0 HE ARG A 246 -5.697 -3.187 12.405 1.00 41.22 H new ATOM 0 HH11 ARG A 246 -3.565 -5.255 10.443 1.00 2.04 H new ATOM 0 HH12 ARG A 246 -4.912 -5.981 9.560 1.00 2.04 H new ATOM 0 HH21 ARG A 246 -7.393 -4.189 11.284 1.00 51.04 H new ATOM 0 HH22 ARG A 246 -7.047 -5.386 10.031 1.00 51.04 H new ATOM 1131 N GLY A 247 -1.673 1.335 13.198 1.00 60.24 N ATOM 1132 CA GLY A 247 -1.055 2.517 12.594 1.00 33.40 C ATOM 1133 C GLY A 247 -1.471 2.708 11.140 1.00 14.32 C ATOM 1134 O GLY A 247 -2.488 2.154 10.703 1.00 14.41 O ATOM 0 H GLY A 247 -1.056 0.525 13.261 1.00 60.24 H new ATOM 0 HA2 GLY A 247 -1.331 3.402 13.168 1.00 33.40 H new ATOM 0 HA3 GLY A 247 0.030 2.426 12.650 1.00 33.40 H new ATOM 1138 N ASP A 248 -0.682 3.470 10.380 1.00 74.05 N ATOM 1139 CA ASP A 248 -0.948 3.716 8.947 1.00 71.54 C ATOM 1140 C ASP A 248 0.279 3.345 8.122 1.00 70.44 C ATOM 1141 O ASP A 248 1.374 3.827 8.400 1.00 12.41 O ATOM 1142 CB ASP A 248 -1.308 5.203 8.695 1.00 20.22 C ATOM 1143 CG ASP A 248 -2.594 5.641 9.408 1.00 22.12 C ATOM 1144 OD1 ASP A 248 -2.527 6.335 10.436 1.00 73.43 O ATOM 1145 OD2 ASP A 248 -3.677 5.294 8.943 1.00 0.15 O ATOM 0 H ASP A 248 0.156 3.935 10.730 1.00 74.05 H new ATOM 0 HA ASP A 248 -1.795 3.098 8.648 1.00 71.54 H new ATOM 0 HB2 ASP A 248 -0.483 5.832 9.029 1.00 20.22 H new ATOM 0 HB3 ASP A 248 -1.420 5.367 7.623 1.00 20.22 H new ATOM 1150 N LEU A 249 0.095 2.509 7.098 1.00 14.12 N ATOM 1151 CA LEU A 249 1.185 2.125 6.188 1.00 40.13 C ATOM 1152 C LEU A 249 1.050 2.950 4.908 1.00 4.50 C ATOM 1153 O LEU A 249 0.105 2.789 4.141 1.00 40.41 O ATOM 1154 CB LEU A 249 1.157 0.610 5.904 1.00 22.21 C ATOM 1155 CG LEU A 249 2.196 0.047 4.883 1.00 15.33 C ATOM 1156 CD1 LEU A 249 3.645 0.321 5.319 1.00 1.11 C ATOM 1157 CD2 LEU A 249 1.947 -1.455 4.650 1.00 13.32 C ATOM 0 H LEU A 249 -0.803 2.081 6.874 1.00 14.12 H new ATOM 0 HA LEU A 249 2.151 2.333 6.647 1.00 40.13 H new ATOM 0 HB2 LEU A 249 1.299 0.088 6.850 1.00 22.21 H new ATOM 0 HB3 LEU A 249 0.160 0.354 5.545 1.00 22.21 H new ATOM 0 HG LEU A 249 2.057 0.572 3.938 1.00 15.33 H new ATOM 0 HD11 LEU A 249 4.332 -0.089 4.578 1.00 1.11 H new ATOM 0 HD12 LEU A 249 3.802 1.396 5.404 1.00 1.11 H new ATOM 0 HD13 LEU A 249 3.830 -0.150 6.284 1.00 1.11 H new ATOM 0 HD21 LEU A 249 2.676 -1.838 3.937 1.00 13.32 H new ATOM 0 HD22 LEU A 249 2.046 -1.991 5.594 1.00 13.32 H new ATOM 0 HD23 LEU A 249 0.942 -1.600 4.254 1.00 13.32 H new ATOM 1169 N TYR A 250 1.979 3.876 4.726 1.00 24.11 N ATOM 1170 CA TYR A 250 1.950 4.836 3.630 1.00 21.25 C ATOM 1171 C TYR A 250 2.862 4.337 2.502 1.00 12.11 C ATOM 1172 O TYR A 250 4.083 4.330 2.648 1.00 50.33 O ATOM 1173 CB TYR A 250 2.405 6.209 4.172 1.00 61.20 C ATOM 1174 CG TYR A 250 2.092 7.393 3.262 1.00 1.13 C ATOM 1175 CD1 TYR A 250 0.780 7.839 3.114 1.00 74.13 C ATOM 1176 CD2 TYR A 250 3.101 8.088 2.586 1.00 14.35 C ATOM 1177 CE1 TYR A 250 0.486 8.928 2.332 1.00 53.42 C ATOM 1178 CE2 TYR A 250 2.805 9.174 1.797 1.00 25.32 C ATOM 1179 CZ TYR A 250 1.502 9.590 1.679 1.00 71.13 C ATOM 1180 OH TYR A 250 1.218 10.697 0.932 1.00 73.43 O ATOM 0 H TYR A 250 2.785 3.984 5.342 1.00 24.11 H new ATOM 0 HA TYR A 250 0.944 4.941 3.223 1.00 21.25 H new ATOM 0 HB2 TYR A 250 1.931 6.377 5.139 1.00 61.20 H new ATOM 0 HB3 TYR A 250 3.481 6.177 4.346 1.00 61.20 H new ATOM 0 HD1 TYR A 250 -0.018 7.319 3.623 1.00 74.13 H new ATOM 0 HD2 TYR A 250 4.127 7.766 2.686 1.00 14.35 H new ATOM 0 HE1 TYR A 250 -0.535 9.264 2.229 1.00 53.42 H new ATOM 0 HE2 TYR A 250 3.592 9.696 1.274 1.00 25.32 H new ATOM 0 HH TYR A 250 2.044 11.047 0.538 1.00 73.43 H new ATOM 1190 N LEU A 251 2.246 3.893 1.394 1.00 42.23 N ATOM 1191 CA LEU A 251 2.947 3.276 0.259 1.00 60.41 C ATOM 1192 C LEU A 251 2.684 4.072 -1.027 1.00 60.41 C ATOM 1193 O LEU A 251 1.584 4.035 -1.588 1.00 10.30 O ATOM 1194 CB LEU A 251 2.495 1.801 0.109 1.00 14.25 C ATOM 1195 CG LEU A 251 3.030 0.829 1.203 1.00 30.00 C ATOM 1196 CD1 LEU A 251 2.457 -0.576 1.017 1.00 21.45 C ATOM 1197 CD2 LEU A 251 4.570 0.793 1.226 1.00 43.32 C ATOM 0 H LEU A 251 1.237 3.954 1.261 1.00 42.23 H new ATOM 0 HA LEU A 251 4.021 3.291 0.444 1.00 60.41 H new ATOM 0 HB2 LEU A 251 1.406 1.769 0.118 1.00 14.25 H new ATOM 0 HB3 LEU A 251 2.816 1.437 -0.867 1.00 14.25 H new ATOM 0 HG LEU A 251 2.694 1.209 2.168 1.00 30.00 H new ATOM 0 HD11 LEU A 251 2.847 -1.234 1.794 1.00 21.45 H new ATOM 0 HD12 LEU A 251 1.370 -0.538 1.086 1.00 21.45 H new ATOM 0 HD13 LEU A 251 2.745 -0.960 0.038 1.00 21.45 H new ATOM 0 HD21 LEU A 251 4.906 0.105 2.001 1.00 43.32 H new ATOM 0 HD22 LEU A 251 4.941 0.458 0.257 1.00 43.32 H new ATOM 0 HD23 LEU A 251 4.954 1.791 1.436 1.00 43.32 H new ATOM 1209 N GLU A 252 3.717 4.803 -1.466 1.00 3.00 N ATOM 1210 CA GLU A 252 3.682 5.608 -2.693 1.00 21.13 C ATOM 1211 C GLU A 252 3.912 4.717 -3.924 1.00 2.15 C ATOM 1212 O GLU A 252 5.021 4.198 -4.123 1.00 63.32 O ATOM 1213 CB GLU A 252 4.747 6.729 -2.619 1.00 51.21 C ATOM 1214 CG GLU A 252 4.494 7.770 -1.505 1.00 61.52 C ATOM 1215 CD GLU A 252 5.574 8.858 -1.425 1.00 23.44 C ATOM 1216 OE1 GLU A 252 5.887 9.473 -2.470 1.00 32.24 O ATOM 1217 OE2 GLU A 252 6.087 9.138 -0.317 1.00 51.12 O ATOM 0 H GLU A 252 4.609 4.852 -0.974 1.00 3.00 H new ATOM 0 HA GLU A 252 2.699 6.069 -2.787 1.00 21.13 H new ATOM 0 HB2 GLU A 252 5.726 6.275 -2.462 1.00 51.21 H new ATOM 0 HB3 GLU A 252 4.785 7.243 -3.579 1.00 51.21 H new ATOM 0 HG2 GLU A 252 3.526 8.242 -1.673 1.00 61.52 H new ATOM 0 HG3 GLU A 252 4.436 7.256 -0.545 1.00 61.52 H new ATOM 1224 N VAL A 253 2.848 4.553 -4.731 1.00 32.23 N ATOM 1225 CA VAL A 253 2.861 3.738 -5.956 1.00 21.03 C ATOM 1226 C VAL A 253 3.941 4.222 -6.940 1.00 53.43 C ATOM 1227 O VAL A 253 3.879 5.344 -7.449 1.00 24.51 O ATOM 1228 CB VAL A 253 1.463 3.741 -6.687 1.00 13.15 C ATOM 1229 CG1 VAL A 253 1.525 2.960 -8.030 1.00 22.32 C ATOM 1230 CG2 VAL A 253 0.363 3.174 -5.766 1.00 32.04 C ATOM 0 H VAL A 253 1.944 4.989 -4.547 1.00 32.23 H new ATOM 0 HA VAL A 253 3.087 2.720 -5.640 1.00 21.03 H new ATOM 0 HB VAL A 253 1.210 4.775 -6.920 1.00 13.15 H new ATOM 0 HG11 VAL A 253 0.546 2.981 -8.509 1.00 22.32 H new ATOM 0 HG12 VAL A 253 2.260 3.424 -8.687 1.00 22.32 H new ATOM 0 HG13 VAL A 253 1.812 1.926 -7.837 1.00 22.32 H new ATOM 0 HG21 VAL A 253 -0.592 3.186 -6.291 1.00 32.04 H new ATOM 0 HG22 VAL A 253 0.613 2.150 -5.489 1.00 32.04 H new ATOM 0 HG23 VAL A 253 0.291 3.786 -4.867 1.00 32.04 H new ATOM 1240 N ARG A 254 4.945 3.374 -7.154 1.00 70.40 N ATOM 1241 CA ARG A 254 5.948 3.544 -8.201 1.00 4.23 C ATOM 1242 C ARG A 254 5.746 2.410 -9.212 1.00 15.20 C ATOM 1243 O ARG A 254 5.872 1.232 -8.853 1.00 41.35 O ATOM 1244 CB ARG A 254 7.377 3.504 -7.598 1.00 13.43 C ATOM 1245 CG ARG A 254 7.624 4.488 -6.435 1.00 13.03 C ATOM 1246 CD ARG A 254 7.319 5.948 -6.797 1.00 51.04 C ATOM 1247 NE ARG A 254 8.077 6.387 -7.979 1.00 61.20 N ATOM 1248 CZ ARG A 254 7.901 7.545 -8.637 1.00 22.40 C ATOM 1249 NH1 ARG A 254 6.977 8.429 -8.249 1.00 55.14 N ATOM 1250 NH2 ARG A 254 8.650 7.802 -9.704 1.00 53.20 N ATOM 0 H ARG A 254 5.086 2.534 -6.593 1.00 70.40 H new ATOM 0 HA ARG A 254 5.836 4.512 -8.690 1.00 4.23 H new ATOM 0 HB2 ARG A 254 7.578 2.492 -7.246 1.00 13.43 H new ATOM 0 HB3 ARG A 254 8.095 3.715 -8.390 1.00 13.43 H new ATOM 0 HG2 ARG A 254 7.008 4.196 -5.585 1.00 13.03 H new ATOM 0 HG3 ARG A 254 8.664 4.410 -6.117 1.00 13.03 H new ATOM 0 HD2 ARG A 254 6.252 6.060 -6.987 1.00 51.04 H new ATOM 0 HD3 ARG A 254 7.561 6.591 -5.951 1.00 51.04 H new ATOM 0 HE ARG A 254 8.799 5.757 -8.329 1.00 61.20 H new ATOM 0 HH11 ARG A 254 6.389 8.230 -7.439 1.00 55.14 H new ATOM 0 HH12 ARG A 254 6.859 9.302 -8.762 1.00 55.14 H new ATOM 0 HH21 ARG A 254 9.347 7.124 -10.013 1.00 53.20 H new ATOM 0 HH22 ARG A 254 8.528 8.677 -10.214 1.00 53.20 H new ATOM 1264 N ILE A 255 5.384 2.771 -10.454 1.00 0.34 N ATOM 1265 CA ILE A 255 5.141 1.801 -11.530 1.00 74.32 C ATOM 1266 C ILE A 255 6.479 1.275 -12.067 1.00 74.13 C ATOM 1267 O ILE A 255 7.325 2.059 -12.513 1.00 25.54 O ATOM 1268 CB ILE A 255 4.300 2.422 -12.710 1.00 71.33 C ATOM 1269 CG1 ILE A 255 2.846 2.735 -12.248 1.00 35.03 C ATOM 1270 CG2 ILE A 255 4.297 1.512 -13.966 1.00 22.50 C ATOM 1271 CD1 ILE A 255 1.955 3.328 -13.328 1.00 43.30 C ATOM 0 H ILE A 255 5.252 3.742 -10.738 1.00 0.34 H new ATOM 0 HA ILE A 255 4.560 0.981 -11.108 1.00 74.32 H new ATOM 0 HB ILE A 255 4.783 3.358 -12.992 1.00 71.33 H new ATOM 0 HG12 ILE A 255 2.389 1.816 -11.882 1.00 35.03 H new ATOM 0 HG13 ILE A 255 2.887 3.428 -11.407 1.00 35.03 H new ATOM 0 HG21 ILE A 255 3.706 1.980 -14.753 1.00 22.50 H new ATOM 0 HG22 ILE A 255 5.320 1.371 -14.316 1.00 22.50 H new ATOM 0 HG23 ILE A 255 3.864 0.544 -13.713 1.00 22.50 H new ATOM 0 HD11 ILE A 255 0.962 3.514 -12.919 1.00 43.30 H new ATOM 0 HD12 ILE A 255 2.384 4.266 -13.679 1.00 43.30 H new ATOM 0 HD13 ILE A 255 1.879 2.629 -14.161 1.00 43.30 H new ATOM 1283 N THR A 256 6.639 -0.054 -12.022 1.00 74.54 N ATOM 1284 CA THR A 256 7.791 -0.761 -12.577 1.00 74.14 C ATOM 1285 C THR A 256 7.325 -1.485 -13.877 1.00 75.13 C ATOM 1286 O THR A 256 6.793 -2.607 -13.814 1.00 21.13 O ATOM 1287 CB THR A 256 8.457 -1.726 -11.509 1.00 1.52 C ATOM 1288 OG1 THR A 256 9.362 -2.635 -12.147 1.00 52.00 O ATOM 1289 CG2 THR A 256 7.435 -2.516 -10.672 1.00 4.23 C ATOM 1290 OXT THR A 256 7.431 -0.885 -14.962 1.00 37.54 O ATOM 0 H THR A 256 5.956 -0.676 -11.590 1.00 74.54 H new ATOM 0 HA THR A 256 8.585 -0.061 -12.838 1.00 74.14 H new ATOM 0 HB THR A 256 8.999 -1.079 -10.819 1.00 1.52 H new ATOM 0 HG1 THR A 256 9.765 -3.222 -11.474 1.00 52.00 H new ATOM 0 HG21 THR A 256 7.962 -3.155 -9.963 1.00 4.23 H new ATOM 0 HG22 THR A 256 6.795 -1.821 -10.128 1.00 4.23 H new ATOM 0 HG23 THR A 256 6.824 -3.132 -11.331 1.00 4.23 H new