USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 544 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 187 HIS : no HD1:sc= -1.33 X(o=-1.9,f=-1.5) USER MOD Set 1.2: A 190 CYS SG : rot 180:sc= -0.568 USER MOD Set 2.1: A 159 TYR OH : rot 180:sc= -2! USER MOD Set 2.2: A 181 ASN : amide:sc= -3.01! C(o=-5!,f=-3.1!) USER MOD Set 3.1: A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 175 THR OG1 : rot -160:sc= -1.2 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 170 LYS NZ :NH3+ -107:sc= -3.29! (180deg=-8.06!) USER MOD Single : A 176 THR OG1 : rot 180:sc= -0.431 USER MOD Single : A 177 TYR OH : rot 180:sc= 0 USER MOD Single : A 185 CYS SG : rot 180:sc= -0.338 USER MOD Single : A 188 HIS : no HE2:sc= -21.7! C(o=-22!,f=-23!) USER MOD Single : A 189 ASN : amide:sc= -0.0578 K(o=-0.058,f=-1.3) USER MOD Single : A 196 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 213 SER OG : rot 180:sc= 0 USER MOD Single : A 232 LYS NZ :NH3+ -153:sc= -2.06! (180deg=-2.81!) USER MOD Single : A 233 SER OG : rot 67:sc= 0.909 USER MOD Single : A 235 ASN : amide:sc= -0.0354 K(o=-0.035,f=-1.2) USER MOD Single : A 238 THR OG1 : rot 106:sc= 0.945 USER MOD Single : A 240 GLN : amide:sc= -0.441 X(o=-0.44,f=-0.28) USER MOD Single : A 243 LYS NZ :NH3+ -158:sc= 1.54 (180deg=0.281) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD Single : B 473 SER OG : rot -25:sc= 1.01 USER MOD Single : B 478 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 36 N TYR A 159 -5.089 -2.371 -3.646 1.00 30.55 N ATOM 37 CA TYR A 159 -5.286 -3.786 -3.910 1.00 54.51 C ATOM 38 C TYR A 159 -4.275 -4.297 -4.939 1.00 11.21 C ATOM 39 O TYR A 159 -3.979 -3.612 -5.917 1.00 51.42 O ATOM 40 CB TYR A 159 -6.696 -3.915 -4.491 1.00 61.44 C ATOM 41 CG TYR A 159 -6.873 -5.104 -5.438 1.00 50.54 C ATOM 42 CD1 TYR A 159 -6.443 -6.360 -5.056 1.00 14.11 C ATOM 43 CD2 TYR A 159 -7.462 -4.922 -6.672 1.00 14.30 C ATOM 44 CE1 TYR A 159 -6.609 -7.478 -5.948 1.00 45.12 C ATOM 45 CE2 TYR A 159 -7.628 -6.040 -7.564 1.00 45.23 C ATOM 46 CZ TYR A 159 -7.193 -7.264 -7.157 1.00 11.24 C ATOM 47 OH TYR A 159 -7.350 -8.320 -7.998 1.00 71.50 O ATOM 0 HA TYR A 159 -5.155 -4.368 -2.998 1.00 54.51 H new ATOM 0 HB2 TYR A 159 -7.408 -4.007 -3.671 1.00 61.44 H new ATOM 0 HB3 TYR A 159 -6.943 -2.998 -5.026 1.00 61.44 H new ATOM 0 HD1 TYR A 159 -5.983 -6.503 -4.089 1.00 14.11 H new ATOM 0 HD2 TYR A 159 -7.799 -3.940 -6.969 1.00 14.30 H new ATOM 0 HE1 TYR A 159 -6.277 -8.465 -5.663 1.00 45.12 H new ATOM 0 HE2 TYR A 159 -8.087 -5.911 -8.533 1.00 45.23 H new ATOM 0 HH TYR A 159 -7.782 -8.019 -8.824 1.00 71.50 H new ATOM 56 N ALA A 160 -3.773 -5.496 -4.684 1.00 30.25 N ATOM 57 CA ALA A 160 -2.802 -6.107 -5.576 1.00 53.30 C ATOM 58 C ALA A 160 -3.364 -7.425 -6.110 1.00 24.40 C ATOM 59 O ALA A 160 -4.123 -8.105 -5.421 1.00 45.43 O ATOM 60 CB ALA A 160 -1.477 -6.295 -4.835 1.00 53.34 C ATOM 0 H ALA A 160 -4.021 -6.061 -3.872 1.00 30.25 H new ATOM 0 HA ALA A 160 -2.608 -5.461 -6.433 1.00 53.30 H new ATOM 0 HB1 ALA A 160 -0.748 -6.753 -5.503 1.00 53.34 H new ATOM 0 HB2 ALA A 160 -1.105 -5.326 -4.503 1.00 53.34 H new ATOM 0 HB3 ALA A 160 -1.632 -6.940 -3.970 1.00 53.34 H new ATOM 66 N ILE A 161 -2.971 -7.747 -7.333 1.00 64.34 N ATOM 67 CA ILE A 161 -3.427 -8.973 -7.967 1.00 33.12 C ATOM 68 C ILE A 161 -2.217 -9.760 -8.474 1.00 63.13 C ATOM 69 O ILE A 161 -1.333 -9.199 -9.121 1.00 24.44 O ATOM 70 CB ILE A 161 -4.457 -8.662 -9.055 1.00 74.12 C ATOM 71 CG1 ILE A 161 -5.411 -9.840 -9.259 1.00 32.41 C ATOM 72 CG2 ILE A 161 -3.771 -8.248 -10.359 1.00 62.23 C ATOM 73 CD1 ILE A 161 -4.740 -10.957 -10.060 1.00 73.04 C ATOM 0 H ILE A 161 -2.342 -7.181 -7.902 1.00 64.34 H new ATOM 0 HA ILE A 161 -3.941 -9.607 -7.245 1.00 33.12 H new ATOM 0 HB ILE A 161 -5.057 -7.814 -8.724 1.00 74.12 H new ATOM 0 HG12 ILE A 161 -5.732 -10.224 -8.291 1.00 32.41 H new ATOM 0 HG13 ILE A 161 -6.306 -9.501 -9.780 1.00 32.41 H new ATOM 0 HG21 ILE A 161 -4.526 -8.033 -11.115 1.00 62.23 H new ATOM 0 HG22 ILE A 161 -3.167 -7.357 -10.186 1.00 62.23 H new ATOM 0 HG23 ILE A 161 -3.131 -9.059 -10.706 1.00 62.23 H new ATOM 0 HD11 ILE A 161 -5.440 -11.782 -10.191 1.00 73.04 H new ATOM 0 HD12 ILE A 161 -4.442 -10.576 -11.037 1.00 73.04 H new ATOM 0 HD13 ILE A 161 -3.859 -11.310 -9.524 1.00 73.04 H new ATOM 84 N VAL A 162 -2.215 -11.047 -8.159 1.00 35.10 N ATOM 85 CA VAL A 162 -1.127 -11.917 -8.575 1.00 64.30 C ATOM 86 C VAL A 162 -1.431 -12.479 -9.965 1.00 5.25 C ATOM 87 O VAL A 162 -2.546 -12.930 -10.226 1.00 5.54 O ATOM 88 CB VAL A 162 -0.900 -13.007 -7.526 1.00 24.12 C ATOM 89 CG1 VAL A 162 -0.205 -14.223 -8.141 1.00 63.04 C ATOM 90 CG2 VAL A 162 -0.107 -12.466 -6.335 1.00 65.14 C ATOM 0 H VAL A 162 -2.949 -11.508 -7.621 1.00 35.10 H new ATOM 0 HA VAL A 162 -0.196 -11.356 -8.649 1.00 64.30 H new ATOM 0 HB VAL A 162 -1.875 -13.328 -7.160 1.00 24.12 H new ATOM 0 HG11 VAL A 162 -0.055 -14.983 -7.374 1.00 63.04 H new ATOM 0 HG12 VAL A 162 -0.824 -14.631 -8.940 1.00 63.04 H new ATOM 0 HG13 VAL A 162 0.761 -13.923 -8.548 1.00 63.04 H new ATOM 0 HG21 VAL A 162 0.040 -13.261 -5.604 1.00 65.14 H new ATOM 0 HG22 VAL A 162 0.862 -12.104 -6.678 1.00 65.14 H new ATOM 0 HG23 VAL A 162 -0.658 -11.647 -5.873 1.00 65.14 H new ATOM 100 N LEU A 163 -0.422 -12.433 -10.821 1.00 73.13 N ATOM 101 CA LEU A 163 -0.567 -12.933 -12.178 1.00 5.43 C ATOM 102 C LEU A 163 0.404 -14.094 -12.397 1.00 65.43 C ATOM 103 O LEU A 163 0.417 -14.704 -13.464 1.00 60.55 O ATOM 104 CB LEU A 163 -0.401 -11.794 -13.188 1.00 23.32 C ATOM 105 CG LEU A 163 -0.599 -10.379 -12.642 1.00 5.23 C ATOM 106 CD1 LEU A 163 0.156 -9.354 -13.489 1.00 22.22 C ATOM 107 CD2 LEU A 163 -2.086 -10.040 -12.523 1.00 24.23 C ATOM 0 H LEU A 163 0.500 -12.057 -10.602 1.00 73.13 H new ATOM 0 HA LEU A 163 -1.572 -13.325 -12.334 1.00 5.43 H new ATOM 0 HB2 LEU A 163 0.598 -11.859 -13.618 1.00 23.32 H new ATOM 0 HB3 LEU A 163 -1.109 -11.950 -14.002 1.00 23.32 H new ATOM 0 HG LEU A 163 -0.178 -10.339 -11.637 1.00 5.23 H new ATOM 0 HD11 LEU A 163 -0.002 -8.356 -13.079 1.00 22.22 H new ATOM 0 HD12 LEU A 163 1.221 -9.587 -13.478 1.00 22.22 H new ATOM 0 HD13 LEU A 163 -0.212 -9.387 -14.514 1.00 22.22 H new ATOM 0 HD21 LEU A 163 -2.198 -9.029 -12.132 1.00 24.23 H new ATOM 0 HD22 LEU A 163 -2.553 -10.104 -13.506 1.00 24.23 H new ATOM 0 HD23 LEU A 163 -2.567 -10.746 -11.846 1.00 24.23 H new ATOM 118 N TYR A 164 1.192 -14.366 -11.367 1.00 31.30 N ATOM 119 CA TYR A 164 2.163 -15.445 -11.433 1.00 50.43 C ATOM 120 C TYR A 164 2.204 -16.227 -10.118 1.00 11.10 C ATOM 121 O TYR A 164 1.531 -15.865 -9.155 1.00 51.03 O ATOM 122 CB TYR A 164 3.521 -14.777 -11.657 1.00 11.43 C ATOM 123 CG TYR A 164 3.509 -13.686 -12.731 1.00 2.52 C ATOM 124 CD1 TYR A 164 3.758 -14.013 -14.048 1.00 1.24 C ATOM 125 CD2 TYR A 164 3.247 -12.376 -12.382 1.00 43.45 C ATOM 126 CE1 TYR A 164 3.745 -12.987 -15.058 1.00 53.54 C ATOM 127 CE2 TYR A 164 3.235 -11.350 -13.391 1.00 71.43 C ATOM 128 CZ TYR A 164 3.485 -11.706 -14.680 1.00 64.24 C ATOM 129 OH TYR A 164 3.474 -10.737 -15.635 1.00 64.53 O ATOM 0 H TYR A 164 1.178 -13.858 -10.483 1.00 31.30 H new ATOM 0 HA TYR A 164 1.905 -16.145 -12.227 1.00 50.43 H new ATOM 0 HB2 TYR A 164 3.860 -14.343 -10.717 1.00 11.43 H new ATOM 0 HB3 TYR A 164 4.248 -15.540 -11.937 1.00 11.43 H new ATOM 0 HD1 TYR A 164 3.962 -15.038 -14.321 1.00 1.24 H new ATOM 0 HD2 TYR A 164 3.051 -12.121 -11.351 1.00 43.45 H new ATOM 0 HE1 TYR A 164 3.937 -13.229 -16.093 1.00 53.54 H new ATOM 0 HE2 TYR A 164 3.032 -10.322 -13.131 1.00 71.43 H new ATOM 0 HH TYR A 164 3.273 -9.872 -15.221 1.00 64.53 H new ATOM 138 N ASP A 165 3.001 -17.286 -10.121 1.00 11.22 N ATOM 139 CA ASP A 165 3.139 -18.122 -8.942 1.00 64.21 C ATOM 140 C ASP A 165 4.605 -18.530 -8.779 1.00 22.41 C ATOM 141 O ASP A 165 5.307 -18.738 -9.766 1.00 33.01 O ATOM 142 CB ASP A 165 2.304 -19.398 -9.070 1.00 4.33 C ATOM 143 CG ASP A 165 2.836 -20.420 -10.077 1.00 12.30 C ATOM 144 OD1 ASP A 165 2.816 -20.187 -11.294 1.00 73.12 O ATOM 145 OD2 ASP A 165 3.292 -21.509 -9.558 1.00 21.33 O ATOM 0 H ASP A 165 3.558 -17.584 -10.922 1.00 11.22 H new ATOM 0 HA ASP A 165 2.793 -17.550 -8.081 1.00 64.21 H new ATOM 0 HB2 ASP A 165 2.242 -19.873 -8.091 1.00 4.33 H new ATOM 0 HB3 ASP A 165 1.289 -19.123 -9.356 1.00 4.33 H new ATOM 150 N PHE A 166 5.021 -18.634 -7.526 1.00 62.11 N ATOM 151 CA PHE A 166 6.390 -19.013 -7.221 1.00 71.41 C ATOM 152 C PHE A 166 6.510 -19.533 -5.787 1.00 3.55 C ATOM 153 O PHE A 166 5.596 -19.357 -4.982 1.00 25.22 O ATOM 154 CB PHE A 166 7.247 -17.755 -7.369 1.00 11.31 C ATOM 155 CG PHE A 166 7.327 -16.904 -6.099 1.00 31.45 C ATOM 156 CD1 PHE A 166 6.207 -16.302 -5.614 1.00 43.34 C ATOM 157 CD2 PHE A 166 8.515 -16.749 -5.458 1.00 1.51 C ATOM 158 CE1 PHE A 166 6.281 -15.513 -4.435 1.00 75.02 C ATOM 159 CE2 PHE A 166 8.589 -15.960 -4.280 1.00 3.14 C ATOM 160 CZ PHE A 166 7.470 -15.358 -3.793 1.00 33.15 C ATOM 0 H PHE A 166 4.434 -18.462 -6.710 1.00 62.11 H new ATOM 0 HA PHE A 166 6.714 -19.807 -7.894 1.00 71.41 H new ATOM 0 HB2 PHE A 166 8.255 -18.047 -7.663 1.00 11.31 H new ATOM 0 HB3 PHE A 166 6.843 -17.146 -8.178 1.00 11.31 H new ATOM 0 HD1 PHE A 166 5.263 -16.424 -6.125 1.00 43.34 H new ATOM 0 HD2 PHE A 166 9.403 -17.226 -5.845 1.00 1.51 H new ATOM 0 HE1 PHE A 166 5.393 -15.036 -4.048 1.00 75.02 H new ATOM 0 HE2 PHE A 166 9.533 -15.838 -3.770 1.00 3.14 H new ATOM 0 HZ PHE A 166 7.526 -14.757 -2.897 1.00 33.15 H new ATOM 169 N LYS A 167 7.643 -20.160 -5.511 1.00 3.10 N ATOM 170 CA LYS A 167 7.894 -20.705 -4.187 1.00 32.32 C ATOM 171 C LYS A 167 8.792 -19.744 -3.406 1.00 22.00 C ATOM 172 O LYS A 167 9.822 -19.302 -3.911 1.00 34.24 O ATOM 173 CB LYS A 167 8.455 -22.124 -4.290 1.00 65.55 C ATOM 174 CG LYS A 167 7.606 -22.982 -5.231 1.00 61.24 C ATOM 175 CD LYS A 167 6.524 -23.739 -4.457 1.00 12.01 C ATOM 176 CE LYS A 167 5.240 -22.912 -4.362 1.00 32.23 C ATOM 177 NZ LYS A 167 4.054 -23.798 -4.340 1.00 54.31 N ATOM 0 H LYS A 167 8.398 -20.303 -6.181 1.00 3.10 H new ATOM 0 HA LYS A 167 6.962 -20.795 -3.629 1.00 32.32 H new ATOM 0 HB2 LYS A 167 9.482 -22.087 -4.653 1.00 65.55 H new ATOM 0 HB3 LYS A 167 8.482 -22.581 -3.301 1.00 65.55 H new ATOM 0 HG2 LYS A 167 7.142 -22.349 -5.987 1.00 61.24 H new ATOM 0 HG3 LYS A 167 8.245 -23.691 -5.758 1.00 61.24 H new ATOM 0 HD2 LYS A 167 6.314 -24.688 -4.951 1.00 12.01 H new ATOM 0 HD3 LYS A 167 6.885 -23.974 -3.456 1.00 12.01 H new ATOM 0 HE2 LYS A 167 5.261 -22.299 -3.461 1.00 32.23 H new ATOM 0 HE3 LYS A 167 5.176 -22.230 -5.210 1.00 32.23 H new ATOM 0 HZ1 LYS A 167 3.191 -23.221 -4.275 1.00 54.31 H new ATOM 0 HZ2 LYS A 167 4.027 -24.364 -5.212 1.00 54.31 H new ATOM 0 HZ3 LYS A 167 4.109 -24.432 -3.517 1.00 54.31 H new ATOM 186 N ALA A 168 8.368 -19.449 -2.186 1.00 42.04 N ATOM 187 CA ALA A 168 9.122 -18.548 -1.330 1.00 44.23 C ATOM 188 C ALA A 168 9.924 -19.367 -0.317 1.00 41.43 C ATOM 189 O ALA A 168 9.585 -20.514 -0.032 1.00 43.30 O ATOM 190 CB ALA A 168 8.164 -17.564 -0.656 1.00 51.41 C ATOM 0 H ALA A 168 7.513 -19.817 -1.770 1.00 42.04 H new ATOM 0 HA ALA A 168 9.831 -17.963 -1.917 1.00 44.23 H new ATOM 0 HB1 ALA A 168 8.729 -16.888 -0.014 1.00 51.41 H new ATOM 0 HB2 ALA A 168 7.639 -16.987 -1.418 1.00 51.41 H new ATOM 0 HB3 ALA A 168 7.440 -18.115 -0.055 1.00 51.41 H new ATOM 196 N GLU A 169 10.974 -18.744 0.200 1.00 73.24 N ATOM 197 CA GLU A 169 11.828 -19.401 1.175 1.00 41.25 C ATOM 198 C GLU A 169 12.567 -18.360 2.019 1.00 51.03 C ATOM 199 O GLU A 169 13.632 -18.644 2.567 1.00 3.43 O ATOM 200 CB GLU A 169 12.812 -20.351 0.491 1.00 30.30 C ATOM 201 CG GLU A 169 13.578 -19.638 -0.625 1.00 12.42 C ATOM 202 CD GLU A 169 14.759 -20.483 -1.107 1.00 62.00 C ATOM 203 OE1 GLU A 169 15.834 -20.454 -0.491 1.00 43.31 O ATOM 204 OE2 GLU A 169 14.529 -21.189 -2.162 1.00 51.52 O ATOM 0 H GLU A 169 11.252 -17.792 -0.038 1.00 73.24 H new ATOM 0 HA GLU A 169 11.199 -19.997 1.836 1.00 41.25 H new ATOM 0 HB2 GLU A 169 13.515 -20.743 1.226 1.00 30.30 H new ATOM 0 HB3 GLU A 169 12.273 -21.204 0.079 1.00 30.30 H new ATOM 0 HG2 GLU A 169 12.907 -19.436 -1.460 1.00 12.42 H new ATOM 0 HG3 GLU A 169 13.939 -18.674 -0.265 1.00 12.42 H new ATOM 210 N LYS A 170 11.974 -17.179 2.098 1.00 33.32 N ATOM 211 CA LYS A 170 12.563 -16.094 2.865 1.00 65.12 C ATOM 212 C LYS A 170 11.875 -16.009 4.229 1.00 2.13 C ATOM 213 O LYS A 170 11.007 -16.822 4.542 1.00 11.31 O ATOM 214 CB LYS A 170 12.518 -14.788 2.070 1.00 73.32 C ATOM 215 CG LYS A 170 12.549 -15.062 0.564 1.00 25.22 C ATOM 216 CD LYS A 170 11.143 -14.987 -0.035 1.00 23.34 C ATOM 217 CE LYS A 170 11.195 -14.561 -1.503 1.00 32.10 C ATOM 218 NZ LYS A 170 9.829 -14.339 -2.027 1.00 11.03 N ATOM 0 H LYS A 170 11.091 -16.949 1.643 1.00 33.32 H new ATOM 0 HA LYS A 170 13.619 -16.289 3.051 1.00 65.12 H new ATOM 0 HB2 LYS A 170 11.614 -14.234 2.324 1.00 73.32 H new ATOM 0 HB3 LYS A 170 13.365 -14.160 2.347 1.00 73.32 H new ATOM 0 HG2 LYS A 170 13.197 -14.337 0.072 1.00 25.22 H new ATOM 0 HG3 LYS A 170 12.975 -16.048 0.379 1.00 25.22 H new ATOM 0 HD2 LYS A 170 10.656 -15.959 0.048 1.00 23.34 H new ATOM 0 HD3 LYS A 170 10.540 -14.278 0.532 1.00 23.34 H new ATOM 0 HE2 LYS A 170 11.782 -13.648 -1.602 1.00 32.10 H new ATOM 0 HE3 LYS A 170 11.697 -15.328 -2.093 1.00 32.10 H new ATOM 0 HZ1 LYS A 170 9.572 -15.117 -2.668 1.00 11.03 H new ATOM 0 HZ2 LYS A 170 9.155 -14.306 -1.236 1.00 11.03 H new ATOM 0 HZ3 LYS A 170 9.798 -13.438 -2.546 1.00 11.03 H new ATOM 227 N ALA A 171 12.288 -15.016 5.003 1.00 51.12 N ATOM 228 CA ALA A 171 11.722 -14.813 6.325 1.00 1.44 C ATOM 229 C ALA A 171 10.213 -14.593 6.202 1.00 11.14 C ATOM 230 O ALA A 171 9.459 -14.900 7.124 1.00 60.13 O ATOM 231 CB ALA A 171 12.428 -13.640 7.009 1.00 31.52 C ATOM 0 H ALA A 171 13.008 -14.343 4.739 1.00 51.12 H new ATOM 0 HA ALA A 171 11.877 -15.695 6.947 1.00 1.44 H new ATOM 0 HB1 ALA A 171 12.003 -13.488 8.001 1.00 31.52 H new ATOM 0 HB2 ALA A 171 13.492 -13.859 7.100 1.00 31.52 H new ATOM 0 HB3 ALA A 171 12.293 -12.737 6.414 1.00 31.52 H new ATOM 237 N ASP A 172 9.817 -14.063 5.054 1.00 31.35 N ATOM 238 CA ASP A 172 8.411 -13.798 4.797 1.00 0.32 C ATOM 239 C ASP A 172 7.913 -14.734 3.694 1.00 65.43 C ATOM 240 O ASP A 172 6.917 -14.446 3.032 1.00 65.15 O ATOM 241 CB ASP A 172 8.199 -12.358 4.325 1.00 63.22 C ATOM 242 CG ASP A 172 6.781 -11.816 4.520 1.00 75.30 C ATOM 243 OD1 ASP A 172 6.589 -10.684 4.987 1.00 24.12 O ATOM 244 OD2 ASP A 172 5.837 -12.619 4.162 1.00 64.55 O ATOM 0 H ASP A 172 10.445 -13.810 4.291 1.00 31.35 H new ATOM 0 HA ASP A 172 7.863 -13.958 5.726 1.00 0.32 H new ATOM 0 HB2 ASP A 172 8.896 -11.711 4.858 1.00 63.22 H new ATOM 0 HB3 ASP A 172 8.453 -12.297 3.267 1.00 63.22 H new ATOM 249 N GLU A 173 8.629 -15.838 3.531 1.00 73.05 N ATOM 250 CA GLU A 173 8.273 -16.818 2.520 1.00 63.31 C ATOM 251 C GLU A 173 6.752 -16.935 2.407 1.00 5.13 C ATOM 252 O GLU A 173 6.093 -17.421 3.325 1.00 63.43 O ATOM 253 CB GLU A 173 8.905 -18.177 2.828 1.00 72.51 C ATOM 254 CG GLU A 173 8.511 -18.663 4.224 1.00 31.11 C ATOM 255 CD GLU A 173 9.411 -19.813 4.678 1.00 44.23 C ATOM 256 OE1 GLU A 173 8.916 -20.807 5.232 1.00 51.22 O ATOM 257 OE2 GLU A 173 10.668 -19.650 4.438 1.00 2.31 O ATOM 0 H GLU A 173 9.454 -16.075 4.083 1.00 73.05 H new ATOM 0 HA GLU A 173 8.665 -16.480 1.561 1.00 63.31 H new ATOM 0 HB2 GLU A 173 8.588 -18.906 2.083 1.00 72.51 H new ATOM 0 HB3 GLU A 173 9.990 -18.101 2.759 1.00 72.51 H new ATOM 0 HG2 GLU A 173 8.582 -17.839 4.934 1.00 31.11 H new ATOM 0 HG3 GLU A 173 7.471 -18.990 4.219 1.00 31.11 H new ATOM 263 N LEU A 174 6.238 -16.482 1.274 1.00 11.33 N ATOM 264 CA LEU A 174 4.806 -16.529 1.029 1.00 12.31 C ATOM 265 C LEU A 174 4.550 -17.114 -0.361 1.00 74.34 C ATOM 266 O LEU A 174 4.835 -16.472 -1.372 1.00 63.13 O ATOM 267 CB LEU A 174 4.181 -15.149 1.239 1.00 1.32 C ATOM 268 CG LEU A 174 2.722 -15.000 0.804 1.00 15.15 C ATOM 269 CD1 LEU A 174 1.769 -15.320 1.957 1.00 33.24 C ATOM 270 CD2 LEU A 174 2.464 -13.611 0.216 1.00 14.54 C ATOM 0 H LEU A 174 6.787 -16.080 0.514 1.00 11.33 H new ATOM 0 HA LEU A 174 4.318 -17.187 1.748 1.00 12.31 H new ATOM 0 HB2 LEU A 174 4.251 -14.898 2.297 1.00 1.32 H new ATOM 0 HB3 LEU A 174 4.778 -14.416 0.697 1.00 1.32 H new ATOM 0 HG LEU A 174 2.526 -15.726 0.015 1.00 15.15 H new ATOM 0 HD11 LEU A 174 0.739 -15.206 1.620 1.00 33.24 H new ATOM 0 HD12 LEU A 174 1.931 -16.346 2.289 1.00 33.24 H new ATOM 0 HD13 LEU A 174 1.957 -14.637 2.785 1.00 33.24 H new ATOM 0 HD21 LEU A 174 1.419 -13.532 -0.085 1.00 14.54 H new ATOM 0 HD22 LEU A 174 2.684 -12.852 0.966 1.00 14.54 H new ATOM 0 HD23 LEU A 174 3.105 -13.459 -0.653 1.00 14.54 H new ATOM 281 N THR A 175 4.016 -18.326 -0.369 1.00 62.30 N ATOM 282 CA THR A 175 3.718 -19.005 -1.619 1.00 4.01 C ATOM 283 C THR A 175 2.322 -18.623 -2.114 1.00 3.30 C ATOM 284 O THR A 175 1.362 -18.630 -1.344 1.00 20.20 O ATOM 285 CB THR A 175 3.892 -20.508 -1.393 1.00 44.20 C ATOM 286 OG1 THR A 175 3.608 -21.086 -2.664 1.00 63.10 O ATOM 287 CG2 THR A 175 2.818 -21.090 -0.470 1.00 71.10 C ATOM 0 H THR A 175 3.782 -18.856 0.470 1.00 62.30 H new ATOM 0 HA THR A 175 4.404 -18.698 -2.409 1.00 4.01 H new ATOM 0 HB THR A 175 4.878 -20.699 -0.969 1.00 44.20 H new ATOM 0 HG1 THR A 175 3.385 -22.033 -2.550 1.00 63.10 H new ATOM 0 HG21 THR A 175 2.988 -22.159 -0.343 1.00 71.10 H new ATOM 0 HG22 THR A 175 2.867 -20.597 0.501 1.00 71.10 H new ATOM 0 HG23 THR A 175 1.834 -20.929 -0.910 1.00 71.10 H new ATOM 295 N THR A 176 2.253 -18.298 -3.395 1.00 34.44 N ATOM 296 CA THR A 176 0.989 -17.914 -4.003 1.00 14.50 C ATOM 297 C THR A 176 0.886 -18.478 -5.421 1.00 20.45 C ATOM 298 O THR A 176 1.882 -18.916 -5.993 1.00 75.23 O ATOM 299 CB THR A 176 0.884 -16.388 -3.948 1.00 24.04 C ATOM 300 OG1 THR A 176 1.189 -16.067 -2.593 1.00 33.41 O ATOM 301 CG2 THR A 176 -0.553 -15.894 -4.133 1.00 52.24 C ATOM 0 H THR A 176 3.051 -18.292 -4.030 1.00 34.44 H new ATOM 0 HA THR A 176 0.144 -18.334 -3.458 1.00 14.50 H new ATOM 0 HB THR A 176 1.521 -15.952 -4.718 1.00 24.04 H new ATOM 0 HG1 THR A 176 1.145 -15.096 -2.469 1.00 33.41 H new ATOM 0 HG21 THR A 176 -0.572 -14.805 -4.086 1.00 52.24 H new ATOM 0 HG22 THR A 176 -0.928 -16.222 -5.102 1.00 52.24 H new ATOM 0 HG23 THR A 176 -1.183 -16.303 -3.343 1.00 52.24 H new ATOM 309 N TYR A 177 -0.330 -18.451 -5.948 1.00 51.21 N ATOM 310 CA TYR A 177 -0.577 -18.955 -7.288 1.00 21.14 C ATOM 311 C TYR A 177 -0.924 -17.814 -8.248 1.00 4.30 C ATOM 312 O TYR A 177 -1.250 -16.710 -7.813 1.00 61.44 O ATOM 313 CB TYR A 177 -1.782 -19.891 -7.171 1.00 50.02 C ATOM 314 CG TYR A 177 -1.411 -21.353 -6.918 1.00 41.32 C ATOM 315 CD1 TYR A 177 -0.990 -22.150 -7.964 1.00 55.31 C ATOM 316 CD2 TYR A 177 -1.496 -21.876 -5.644 1.00 62.53 C ATOM 317 CE1 TYR A 177 -0.641 -23.526 -7.725 1.00 75.30 C ATOM 318 CE2 TYR A 177 -1.147 -23.253 -5.406 1.00 61.12 C ATOM 319 CZ TYR A 177 -0.736 -24.010 -6.459 1.00 43.23 C ATOM 320 OH TYR A 177 -0.406 -25.310 -6.234 1.00 44.41 O ATOM 0 H TYR A 177 -1.155 -18.088 -5.471 1.00 51.21 H new ATOM 0 HA TYR A 177 0.308 -19.459 -7.678 1.00 21.14 H new ATOM 0 HB2 TYR A 177 -2.422 -19.543 -6.360 1.00 50.02 H new ATOM 0 HB3 TYR A 177 -2.368 -19.829 -8.088 1.00 50.02 H new ATOM 0 HD1 TYR A 177 -0.923 -21.741 -8.961 1.00 55.31 H new ATOM 0 HD2 TYR A 177 -1.824 -21.253 -4.825 1.00 62.53 H new ATOM 0 HE1 TYR A 177 -0.311 -24.160 -8.535 1.00 75.30 H new ATOM 0 HE2 TYR A 177 -1.210 -23.675 -4.414 1.00 61.12 H new ATOM 0 HH TYR A 177 -0.521 -25.517 -5.283 1.00 44.41 H new ATOM 329 N VAL A 178 -0.842 -18.121 -9.533 1.00 14.13 N ATOM 330 CA VAL A 178 -1.143 -17.135 -10.558 1.00 1.40 C ATOM 331 C VAL A 178 -2.602 -16.694 -10.422 1.00 34.01 C ATOM 332 O VAL A 178 -3.419 -17.408 -9.843 1.00 60.33 O ATOM 333 CB VAL A 178 -0.816 -17.701 -11.942 1.00 65.23 C ATOM 334 CG1 VAL A 178 0.488 -18.501 -11.912 1.00 5.42 C ATOM 335 CG2 VAL A 178 -1.970 -18.554 -12.471 1.00 15.55 C ATOM 0 H VAL A 178 -0.572 -19.038 -9.889 1.00 14.13 H new ATOM 0 HA VAL A 178 -0.522 -16.249 -10.429 1.00 1.40 H new ATOM 0 HB VAL A 178 -0.679 -16.862 -12.624 1.00 65.23 H new ATOM 0 HG11 VAL A 178 0.698 -18.892 -12.907 1.00 5.42 H new ATOM 0 HG12 VAL A 178 1.306 -17.852 -11.597 1.00 5.42 H new ATOM 0 HG13 VAL A 178 0.391 -19.329 -11.210 1.00 5.42 H new ATOM 0 HG21 VAL A 178 -1.712 -18.944 -13.456 1.00 15.55 H new ATOM 0 HG22 VAL A 178 -2.152 -19.384 -11.788 1.00 15.55 H new ATOM 0 HG23 VAL A 178 -2.869 -17.943 -12.547 1.00 15.55 H new ATOM 345 N GLY A 179 -2.886 -15.520 -10.967 1.00 54.55 N ATOM 346 CA GLY A 179 -4.231 -14.975 -10.914 1.00 70.13 C ATOM 347 C GLY A 179 -4.818 -15.098 -9.506 1.00 55.33 C ATOM 348 O GLY A 179 -5.732 -15.888 -9.277 1.00 54.44 O ATOM 0 H GLY A 179 -2.206 -14.931 -11.448 1.00 54.55 H new ATOM 0 HA2 GLY A 179 -4.215 -13.927 -11.215 1.00 70.13 H new ATOM 0 HA3 GLY A 179 -4.868 -15.501 -11.625 1.00 70.13 H new ATOM 352 N GLU A 180 -4.266 -14.305 -8.599 1.00 15.14 N ATOM 353 CA GLU A 180 -4.723 -14.313 -7.220 1.00 62.50 C ATOM 354 C GLU A 180 -4.955 -12.883 -6.728 1.00 62.41 C ATOM 355 O GLU A 180 -4.659 -11.924 -7.437 1.00 1.24 O ATOM 356 CB GLU A 180 -3.730 -15.050 -6.318 1.00 14.31 C ATOM 357 CG GLU A 180 -4.456 -15.808 -5.206 1.00 62.42 C ATOM 358 CD GLU A 180 -3.602 -16.967 -4.685 1.00 1.35 C ATOM 359 OE1 GLU A 180 -2.859 -17.587 -5.460 1.00 5.12 O ATOM 360 OE2 GLU A 180 -3.730 -17.213 -3.424 1.00 34.44 O ATOM 0 H GLU A 180 -3.506 -13.653 -8.793 1.00 15.14 H new ATOM 0 HA GLU A 180 -5.671 -14.849 -7.175 1.00 62.50 H new ATOM 0 HB2 GLU A 180 -3.141 -15.748 -6.914 1.00 14.31 H new ATOM 0 HB3 GLU A 180 -3.032 -14.336 -5.880 1.00 14.31 H new ATOM 0 HG2 GLU A 180 -4.688 -15.126 -4.388 1.00 62.42 H new ATOM 0 HG3 GLU A 180 -5.405 -16.191 -5.581 1.00 62.42 H new ATOM 366 N ASN A 181 -5.481 -12.787 -5.516 1.00 22.24 N ATOM 367 CA ASN A 181 -5.757 -11.491 -4.920 1.00 10.24 C ATOM 368 C ASN A 181 -4.924 -11.332 -3.646 1.00 30.22 C ATOM 369 O ASN A 181 -4.830 -12.260 -2.844 1.00 54.54 O ATOM 370 CB ASN A 181 -7.233 -11.361 -4.539 1.00 74.12 C ATOM 371 CG ASN A 181 -7.896 -10.209 -5.297 1.00 31.03 C ATOM 372 OD1 ASN A 181 -8.400 -9.260 -4.719 1.00 74.52 O ATOM 373 ND2 ASN A 181 -7.868 -10.344 -6.620 1.00 63.32 N ATOM 0 H ASN A 181 -5.723 -13.586 -4.930 1.00 22.24 H new ATOM 0 HA ASN A 181 -5.506 -10.724 -5.652 1.00 10.24 H new ATOM 0 HB2 ASN A 181 -7.753 -12.293 -4.760 1.00 74.12 H new ATOM 0 HB3 ASN A 181 -7.322 -11.193 -3.466 1.00 74.12 H new ATOM 0 HD21 ASN A 181 -8.285 -9.628 -7.215 1.00 63.32 H new ATOM 0 HD22 ASN A 181 -7.430 -11.164 -7.040 1.00 63.32 H new ATOM 379 N LEU A 182 -4.343 -10.151 -3.500 1.00 31.12 N ATOM 380 CA LEU A 182 -3.522 -9.860 -2.337 1.00 15.31 C ATOM 381 C LEU A 182 -3.458 -8.344 -2.131 1.00 21.31 C ATOM 382 O LEU A 182 -3.465 -7.582 -3.096 1.00 22.21 O ATOM 383 CB LEU A 182 -2.149 -10.520 -2.472 1.00 61.34 C ATOM 384 CG LEU A 182 -1.211 -9.912 -3.517 1.00 63.24 C ATOM 385 CD1 LEU A 182 0.224 -10.405 -3.318 1.00 11.21 C ATOM 386 CD2 LEU A 182 -1.719 -10.184 -4.934 1.00 21.10 C ATOM 0 H LEU A 182 -4.424 -9.384 -4.168 1.00 31.12 H new ATOM 0 HA LEU A 182 -3.968 -10.287 -1.439 1.00 15.31 H new ATOM 0 HB2 LEU A 182 -1.653 -10.482 -1.502 1.00 61.34 H new ATOM 0 HB3 LEU A 182 -2.296 -11.573 -2.714 1.00 61.34 H new ATOM 0 HG LEU A 182 -1.202 -8.831 -3.380 1.00 63.24 H new ATOM 0 HD11 LEU A 182 0.870 -9.958 -4.073 1.00 11.21 H new ATOM 0 HD12 LEU A 182 0.573 -10.118 -2.326 1.00 11.21 H new ATOM 0 HD13 LEU A 182 0.252 -11.491 -3.413 1.00 11.21 H new ATOM 0 HD21 LEU A 182 -1.034 -9.741 -5.657 1.00 21.10 H new ATOM 0 HD22 LEU A 182 -1.776 -11.260 -5.100 1.00 21.10 H new ATOM 0 HD23 LEU A 182 -2.709 -9.745 -5.056 1.00 21.10 H new ATOM 397 N PHE A 183 -3.396 -7.954 -0.866 1.00 32.32 N ATOM 398 CA PHE A 183 -3.331 -6.544 -0.521 1.00 72.10 C ATOM 399 C PHE A 183 -1.985 -6.199 0.121 1.00 4.33 C ATOM 400 O PHE A 183 -1.599 -6.802 1.121 1.00 72.22 O ATOM 401 CB PHE A 183 -4.448 -6.279 0.489 1.00 4.31 C ATOM 402 CG PHE A 183 -5.805 -5.975 -0.148 1.00 20.03 C ATOM 403 CD1 PHE A 183 -6.391 -6.887 -0.969 1.00 32.22 C ATOM 404 CD2 PHE A 183 -6.426 -4.791 0.105 1.00 4.21 C ATOM 405 CE1 PHE A 183 -7.650 -6.605 -1.562 1.00 3.42 C ATOM 406 CE2 PHE A 183 -7.685 -4.509 -0.487 1.00 31.31 C ATOM 407 CZ PHE A 183 -8.271 -5.421 -1.308 1.00 73.40 C ATOM 0 H PHE A 183 -3.389 -8.589 -0.068 1.00 32.32 H new ATOM 0 HA PHE A 183 -3.442 -5.935 -1.418 1.00 72.10 H new ATOM 0 HB2 PHE A 183 -4.550 -7.148 1.139 1.00 4.31 H new ATOM 0 HB3 PHE A 183 -4.159 -5.440 1.122 1.00 4.31 H new ATOM 0 HD1 PHE A 183 -5.898 -7.827 -1.170 1.00 32.22 H new ATOM 0 HD2 PHE A 183 -5.961 -4.066 0.756 1.00 4.21 H new ATOM 0 HE1 PHE A 183 -8.114 -7.330 -2.214 1.00 3.42 H new ATOM 0 HE2 PHE A 183 -8.178 -3.569 -0.285 1.00 31.31 H new ATOM 0 HZ PHE A 183 -9.229 -5.206 -1.758 1.00 73.40 H new ATOM 416 N ILE A 184 -1.311 -5.230 -0.478 1.00 72.22 N ATOM 417 CA ILE A 184 -0.017 -4.798 0.023 1.00 14.15 C ATOM 418 C ILE A 184 -0.196 -4.167 1.405 1.00 41.32 C ATOM 419 O ILE A 184 -1.262 -3.637 1.717 1.00 51.23 O ATOM 420 CB ILE A 184 0.668 -3.877 -0.989 1.00 53.31 C ATOM 421 CG1 ILE A 184 1.327 -4.687 -2.108 1.00 42.34 C ATOM 422 CG2 ILE A 184 1.663 -2.944 -0.296 1.00 43.31 C ATOM 423 CD1 ILE A 184 0.302 -5.570 -2.822 1.00 65.43 C ATOM 0 H ILE A 184 -1.636 -4.731 -1.306 1.00 72.22 H new ATOM 0 HA ILE A 184 0.649 -5.652 0.145 1.00 14.15 H new ATOM 0 HB ILE A 184 -0.094 -3.249 -1.450 1.00 53.31 H new ATOM 0 HG12 ILE A 184 1.793 -4.011 -2.825 1.00 42.34 H new ATOM 0 HG13 ILE A 184 2.121 -5.308 -1.693 1.00 42.34 H new ATOM 0 HG21 ILE A 184 2.136 -2.300 -1.038 1.00 43.31 H new ATOM 0 HG22 ILE A 184 1.137 -2.330 0.435 1.00 43.31 H new ATOM 0 HG23 ILE A 184 2.426 -3.536 0.209 1.00 43.31 H new ATOM 0 HD11 ILE A 184 0.796 -6.135 -3.612 1.00 65.43 H new ATOM 0 HD12 ILE A 184 -0.144 -6.261 -2.107 1.00 65.43 H new ATOM 0 HD13 ILE A 184 -0.478 -4.944 -3.256 1.00 65.43 H new ATOM 434 N CYS A 185 0.863 -4.244 2.197 1.00 73.24 N ATOM 435 CA CYS A 185 0.837 -3.687 3.539 1.00 62.15 C ATOM 436 C CYS A 185 2.145 -2.928 3.770 1.00 70.11 C ATOM 437 O CYS A 185 2.134 -1.796 4.252 1.00 21.34 O ATOM 438 CB CYS A 185 0.611 -4.770 4.597 1.00 33.22 C ATOM 439 SG CYS A 185 -1.035 -4.557 5.367 1.00 31.40 S ATOM 0 H CYS A 185 1.745 -4.684 1.935 1.00 73.24 H new ATOM 0 HA CYS A 185 -0.003 -2.999 3.633 1.00 62.15 H new ATOM 0 HB2 CYS A 185 0.683 -5.757 4.140 1.00 33.22 H new ATOM 0 HB3 CYS A 185 1.388 -4.714 5.359 1.00 33.22 H new ATOM 0 HG CYS A 185 -1.218 -5.482 6.262 1.00 31.40 H new ATOM 444 N ALA A 186 3.241 -3.582 3.415 1.00 52.34 N ATOM 445 CA ALA A 186 4.555 -2.983 3.578 1.00 52.41 C ATOM 446 C ALA A 186 5.303 -3.033 2.244 1.00 21.51 C ATOM 447 O ALA A 186 4.883 -3.726 1.318 1.00 5.42 O ATOM 448 CB ALA A 186 5.310 -3.703 4.698 1.00 73.41 C ATOM 0 H ALA A 186 3.246 -4.520 3.015 1.00 52.34 H new ATOM 0 HA ALA A 186 4.466 -1.936 3.867 1.00 52.41 H new ATOM 0 HB1 ALA A 186 6.295 -3.253 4.820 1.00 73.41 H new ATOM 0 HB2 ALA A 186 4.752 -3.612 5.630 1.00 73.41 H new ATOM 0 HB3 ALA A 186 5.421 -4.757 4.443 1.00 73.41 H new ATOM 454 N HIS A 187 6.399 -2.291 2.188 1.00 60.24 N ATOM 455 CA HIS A 187 7.209 -2.243 0.983 1.00 71.10 C ATOM 456 C HIS A 187 8.676 -2.020 1.359 1.00 22.15 C ATOM 457 O HIS A 187 8.973 -1.329 2.332 1.00 23.45 O ATOM 458 CB HIS A 187 6.678 -1.185 0.013 1.00 43.02 C ATOM 459 CG HIS A 187 7.440 0.118 0.049 1.00 51.43 C ATOM 460 ND1 HIS A 187 8.490 0.396 -0.810 1.00 2.50 N ATOM 461 CD2 HIS A 187 7.294 1.215 0.846 1.00 52.44 C ATOM 462 CE1 HIS A 187 8.947 1.608 -0.532 1.00 51.41 C ATOM 463 NE2 HIS A 187 8.206 2.114 0.496 1.00 34.41 N ATOM 0 H HIS A 187 6.745 -1.718 2.958 1.00 60.24 H new ATOM 0 HA HIS A 187 7.145 -3.197 0.459 1.00 71.10 H new ATOM 0 HB2 HIS A 187 6.712 -1.586 -1.000 1.00 43.02 H new ATOM 0 HB3 HIS A 187 5.631 -0.988 0.243 1.00 43.02 H new ATOM 0 HD2 HIS A 187 6.560 1.333 1.630 1.00 52.44 H new ATOM 0 HE1 HIS A 187 9.763 2.108 -1.032 1.00 51.41 H new ATOM 0 HE2 HIS A 187 8.332 3.031 0.925 1.00 34.41 H new ATOM 471 N HIS A 188 9.554 -2.618 0.567 1.00 35.13 N ATOM 472 CA HIS A 188 10.981 -2.493 0.803 1.00 40.21 C ATOM 473 C HIS A 188 11.732 -2.581 -0.527 1.00 41.24 C ATOM 474 O HIS A 188 11.361 -3.361 -1.403 1.00 63.34 O ATOM 475 CB HIS A 188 11.456 -3.531 1.822 1.00 63.24 C ATOM 476 CG HIS A 188 10.727 -4.852 1.737 1.00 51.23 C ATOM 477 ND1 HIS A 188 11.382 -6.071 1.742 1.00 22.22 N ATOM 478 CD2 HIS A 188 9.395 -5.130 1.648 1.00 33.40 C ATOM 479 CE1 HIS A 188 10.475 -7.033 1.657 1.00 25.25 C ATOM 480 NE2 HIS A 188 9.244 -6.448 1.599 1.00 75.40 N ATOM 0 H HIS A 188 9.304 -3.191 -0.239 1.00 35.13 H new ATOM 0 HA HIS A 188 11.197 -1.517 1.238 1.00 40.21 H new ATOM 0 HB2 HIS A 188 12.522 -3.706 1.678 1.00 63.24 H new ATOM 0 HB3 HIS A 188 11.333 -3.123 2.825 1.00 63.24 H new ATOM 0 HD1 HIS A 188 12.391 -6.206 1.801 1.00 22.22 H new ATOM 0 HD2 HIS A 188 8.598 -4.402 1.622 1.00 33.40 H new ATOM 0 HE1 HIS A 188 10.675 -8.094 1.637 1.00 25.25 H new ATOM 487 N ASN A 189 12.775 -1.771 -0.636 1.00 15.12 N ATOM 488 CA ASN A 189 13.581 -1.747 -1.844 1.00 72.10 C ATOM 489 C ASN A 189 12.666 -1.574 -3.059 1.00 75.24 C ATOM 490 O ASN A 189 13.041 -1.924 -4.177 1.00 21.12 O ATOM 491 CB ASN A 189 14.353 -3.058 -2.017 1.00 11.34 C ATOM 492 CG ASN A 189 15.603 -2.848 -2.874 1.00 53.52 C ATOM 493 OD1 ASN A 189 15.840 -1.784 -3.424 1.00 70.31 O ATOM 494 ND2 ASN A 189 16.389 -3.918 -2.955 1.00 71.42 N ATOM 0 H ASN A 189 13.080 -1.126 0.093 1.00 15.12 H new ATOM 0 HA ASN A 189 14.287 -0.920 -1.762 1.00 72.10 H new ATOM 0 HB2 ASN A 189 14.639 -3.448 -1.040 1.00 11.34 H new ATOM 0 HB3 ASN A 189 13.710 -3.805 -2.482 1.00 11.34 H new ATOM 0 HD21 ASN A 189 17.249 -3.879 -3.502 1.00 71.42 H new ATOM 0 HD22 ASN A 189 16.132 -4.778 -2.470 1.00 71.42 H new ATOM 500 N CYS A 190 11.486 -1.033 -2.798 1.00 30.31 N ATOM 501 CA CYS A 190 10.515 -0.809 -3.856 1.00 3.14 C ATOM 502 C CYS A 190 10.519 -2.029 -4.778 1.00 24.41 C ATOM 503 O CYS A 190 10.219 -1.917 -5.965 1.00 13.34 O ATOM 504 CB CYS A 190 10.801 0.485 -4.621 1.00 51.11 C ATOM 505 SG CYS A 190 10.286 1.929 -3.623 1.00 2.52 S ATOM 0 H CYS A 190 11.180 -0.743 -1.869 1.00 30.31 H new ATOM 0 HA CYS A 190 9.523 -0.686 -3.422 1.00 3.14 H new ATOM 0 HB2 CYS A 190 11.864 0.553 -4.852 1.00 51.11 H new ATOM 0 HB3 CYS A 190 10.268 0.481 -5.572 1.00 51.11 H new ATOM 0 HG CYS A 190 10.535 3.022 -4.281 1.00 2.52 H new ATOM 510 N GLU A 191 10.861 -3.170 -4.196 1.00 4.24 N ATOM 511 CA GLU A 191 10.907 -4.411 -4.950 1.00 33.13 C ATOM 512 C GLU A 191 10.092 -5.494 -4.241 1.00 52.02 C ATOM 513 O GLU A 191 9.377 -6.260 -4.885 1.00 24.04 O ATOM 514 CB GLU A 191 12.351 -4.866 -5.169 1.00 62.11 C ATOM 515 CG GLU A 191 12.410 -6.064 -6.118 1.00 61.33 C ATOM 516 CD GLU A 191 13.624 -5.970 -7.045 1.00 55.00 C ATOM 517 OE1 GLU A 191 13.513 -6.267 -8.244 1.00 70.13 O ATOM 518 OE2 GLU A 191 14.712 -5.570 -6.479 1.00 55.10 O ATOM 0 H GLU A 191 11.109 -3.260 -3.211 1.00 4.24 H new ATOM 0 HA GLU A 191 10.464 -4.234 -5.930 1.00 33.13 H new ATOM 0 HB2 GLU A 191 12.937 -4.043 -5.579 1.00 62.11 H new ATOM 0 HB3 GLU A 191 12.801 -5.132 -4.213 1.00 62.11 H new ATOM 0 HG2 GLU A 191 12.459 -6.987 -5.541 1.00 61.33 H new ATOM 0 HG3 GLU A 191 11.497 -6.107 -6.712 1.00 61.33 H new ATOM 524 N TRP A 192 10.227 -5.524 -2.923 1.00 41.22 N ATOM 525 CA TRP A 192 9.513 -6.500 -2.119 1.00 22.40 C ATOM 526 C TRP A 192 8.386 -5.773 -1.383 1.00 63.45 C ATOM 527 O TRP A 192 8.612 -4.731 -0.770 1.00 23.04 O ATOM 528 CB TRP A 192 10.465 -7.237 -1.175 1.00 74.42 C ATOM 529 CG TRP A 192 11.456 -8.161 -1.889 1.00 44.02 C ATOM 530 CD1 TRP A 192 12.727 -7.903 -2.227 1.00 24.41 C ATOM 531 CD2 TRP A 192 11.203 -9.509 -2.338 1.00 50.13 C ATOM 532 NE1 TRP A 192 13.310 -8.983 -2.860 1.00 25.14 N ATOM 533 CE2 TRP A 192 12.354 -9.990 -2.929 1.00 2.35 C ATOM 534 CE3 TRP A 192 10.041 -10.296 -2.247 1.00 53.34 C ATOM 535 CZ2 TRP A 192 12.455 -11.275 -3.476 1.00 33.10 C ATOM 536 CZ3 TRP A 192 10.159 -11.577 -2.799 1.00 65.23 C ATOM 537 CH2 TRP A 192 11.310 -12.076 -3.398 1.00 63.51 C ATOM 0 H TRP A 192 10.821 -4.887 -2.392 1.00 41.22 H new ATOM 0 HA TRP A 192 9.075 -7.273 -2.751 1.00 22.40 H new ATOM 0 HB2 TRP A 192 11.022 -6.504 -0.592 1.00 74.42 H new ATOM 0 HB3 TRP A 192 9.878 -7.826 -0.470 1.00 74.42 H new ATOM 0 HD1 TRP A 192 13.231 -6.969 -2.029 1.00 24.41 H new ATOM 0 HE1 TRP A 192 14.266 -9.033 -3.212 1.00 25.14 H new ATOM 0 HE3 TRP A 192 9.130 -9.940 -1.788 1.00 53.34 H new ATOM 0 HZ2 TRP A 192 13.367 -11.629 -3.933 1.00 33.10 H new ATOM 0 HZ3 TRP A 192 9.295 -12.223 -2.757 1.00 65.23 H new ATOM 0 HH2 TRP A 192 11.321 -13.078 -3.802 1.00 63.51 H new ATOM 547 N PHE A 193 7.196 -6.352 -1.466 1.00 74.15 N ATOM 548 CA PHE A 193 6.035 -5.773 -0.816 1.00 4.34 C ATOM 549 C PHE A 193 5.359 -6.789 0.108 1.00 52.11 C ATOM 550 O PHE A 193 5.092 -7.919 -0.297 1.00 41.22 O ATOM 551 CB PHE A 193 5.054 -5.375 -1.921 1.00 71.01 C ATOM 552 CG PHE A 193 5.615 -4.354 -2.912 1.00 14.31 C ATOM 553 CD1 PHE A 193 6.579 -3.479 -2.515 1.00 20.23 C ATOM 554 CD2 PHE A 193 5.150 -4.319 -4.190 1.00 24.02 C ATOM 555 CE1 PHE A 193 7.099 -2.531 -3.436 1.00 41.43 C ATOM 556 CE2 PHE A 193 5.670 -3.370 -5.110 1.00 64.44 C ATOM 557 CZ PHE A 193 6.634 -2.497 -4.713 1.00 51.11 C ATOM 0 H PHE A 193 7.013 -7.217 -1.974 1.00 74.15 H new ATOM 0 HA PHE A 193 6.336 -4.917 -0.212 1.00 4.34 H new ATOM 0 HB2 PHE A 193 4.755 -6.270 -2.467 1.00 71.01 H new ATOM 0 HB3 PHE A 193 4.154 -4.965 -1.463 1.00 71.01 H new ATOM 0 HD1 PHE A 193 6.948 -3.506 -1.500 1.00 20.23 H new ATOM 0 HD2 PHE A 193 4.385 -5.013 -4.505 1.00 24.02 H new ATOM 0 HE1 PHE A 193 7.864 -1.837 -3.122 1.00 41.43 H new ATOM 0 HE2 PHE A 193 5.300 -3.342 -6.124 1.00 64.44 H new ATOM 0 HZ PHE A 193 7.031 -1.776 -5.413 1.00 51.11 H new ATOM 566 N ILE A 194 5.103 -6.349 1.331 1.00 21.24 N ATOM 567 CA ILE A 194 4.463 -7.207 2.315 1.00 11.44 C ATOM 568 C ILE A 194 2.944 -7.051 2.211 1.00 62.25 C ATOM 569 O ILE A 194 2.371 -6.127 2.784 1.00 4.11 O ATOM 570 CB ILE A 194 5.016 -6.921 3.713 1.00 3.01 C ATOM 571 CG1 ILE A 194 6.169 -7.869 4.051 1.00 41.00 C ATOM 572 CG2 ILE A 194 3.904 -6.975 4.763 1.00 1.42 C ATOM 573 CD1 ILE A 194 7.374 -7.610 3.144 1.00 71.33 C ATOM 0 H ILE A 194 5.327 -5.411 1.663 1.00 21.24 H new ATOM 0 HA ILE A 194 4.690 -8.254 2.114 1.00 11.44 H new ATOM 0 HB ILE A 194 5.419 -5.908 3.721 1.00 3.01 H new ATOM 0 HG12 ILE A 194 6.459 -7.738 5.094 1.00 41.00 H new ATOM 0 HG13 ILE A 194 5.840 -8.902 3.939 1.00 41.00 H new ATOM 0 HG21 ILE A 194 4.323 -6.768 5.748 1.00 1.42 H new ATOM 0 HG22 ILE A 194 3.145 -6.229 4.528 1.00 1.42 H new ATOM 0 HG23 ILE A 194 3.451 -7.966 4.762 1.00 1.42 H new ATOM 0 HD11 ILE A 194 8.180 -8.296 3.404 1.00 71.33 H new ATOM 0 HD12 ILE A 194 7.087 -7.765 2.104 1.00 71.33 H new ATOM 0 HD13 ILE A 194 7.715 -6.583 3.277 1.00 71.33 H new ATOM 584 N ALA A 195 2.338 -7.970 1.475 1.00 21.34 N ATOM 585 CA ALA A 195 0.896 -7.947 1.287 1.00 63.24 C ATOM 586 C ALA A 195 0.257 -9.032 2.156 1.00 12.21 C ATOM 587 O ALA A 195 0.940 -9.687 2.942 1.00 33.52 O ATOM 588 CB ALA A 195 0.572 -8.124 -0.197 1.00 11.44 C ATOM 0 H ALA A 195 2.818 -8.735 1.001 1.00 21.34 H new ATOM 0 HA ALA A 195 0.483 -6.988 1.599 1.00 63.24 H new ATOM 0 HB1 ALA A 195 -0.509 -8.107 -0.338 1.00 11.44 H new ATOM 0 HB2 ALA A 195 1.025 -7.313 -0.768 1.00 11.44 H new ATOM 0 HB3 ALA A 195 0.968 -9.078 -0.545 1.00 11.44 H new ATOM 594 N LYS A 196 -1.049 -9.187 1.987 1.00 72.14 N ATOM 595 CA LYS A 196 -1.788 -10.181 2.746 1.00 52.11 C ATOM 596 C LYS A 196 -2.982 -10.663 1.919 1.00 24.02 C ATOM 597 O LYS A 196 -3.626 -9.872 1.232 1.00 53.02 O ATOM 598 CB LYS A 196 -2.175 -9.628 4.119 1.00 72.24 C ATOM 599 CG LYS A 196 -3.557 -10.129 4.544 1.00 54.02 C ATOM 600 CD LYS A 196 -4.656 -9.184 4.054 1.00 74.44 C ATOM 601 CE LYS A 196 -5.918 -9.323 4.907 1.00 3.40 C ATOM 602 NZ LYS A 196 -7.030 -8.543 4.318 1.00 43.41 N ATOM 0 H LYS A 196 -1.613 -8.641 1.336 1.00 72.14 H new ATOM 0 HA LYS A 196 -1.163 -11.052 2.943 1.00 52.11 H new ATOM 0 HB2 LYS A 196 -1.432 -9.929 4.858 1.00 72.24 H new ATOM 0 HB3 LYS A 196 -2.173 -8.538 4.090 1.00 72.24 H new ATOM 0 HG2 LYS A 196 -3.725 -11.128 4.142 1.00 54.02 H new ATOM 0 HG3 LYS A 196 -3.600 -10.211 5.630 1.00 54.02 H new ATOM 0 HD2 LYS A 196 -4.299 -8.155 4.091 1.00 74.44 H new ATOM 0 HD3 LYS A 196 -4.891 -9.402 3.012 1.00 74.44 H new ATOM 0 HE2 LYS A 196 -6.201 -10.373 4.980 1.00 3.40 H new ATOM 0 HE3 LYS A 196 -5.719 -8.975 5.921 1.00 3.40 H new ATOM 0 HZ1 LYS A 196 -7.879 -8.648 4.909 1.00 43.41 H new ATOM 0 HZ2 LYS A 196 -6.763 -7.539 4.271 1.00 43.41 H new ATOM 0 HZ3 LYS A 196 -7.230 -8.893 3.359 1.00 43.41 H new ATOM 611 N PRO A 197 -3.249 -11.994 2.017 1.00 11.35 N ATOM 612 CA PRO A 197 -4.354 -12.590 1.286 1.00 5.42 C ATOM 613 C PRO A 197 -5.694 -12.238 1.936 1.00 60.43 C ATOM 614 O PRO A 197 -5.757 -11.978 3.136 1.00 34.14 O ATOM 615 CB PRO A 197 -4.067 -14.083 1.287 1.00 45.55 C ATOM 616 CG PRO A 197 -3.067 -14.313 2.410 1.00 74.11 C ATOM 617 CD PRO A 197 -2.509 -12.960 2.821 1.00 70.11 C ATOM 0 HA PRO A 197 -4.435 -12.215 0.266 1.00 5.42 H new ATOM 0 HB2 PRO A 197 -4.979 -14.656 1.452 1.00 45.55 H new ATOM 0 HB3 PRO A 197 -3.659 -14.403 0.328 1.00 45.55 H new ATOM 0 HG2 PRO A 197 -3.550 -14.800 3.257 1.00 74.11 H new ATOM 0 HG3 PRO A 197 -2.265 -14.972 2.078 1.00 74.11 H new ATOM 0 HD2 PRO A 197 -2.652 -12.780 3.887 1.00 70.11 H new ATOM 0 HD3 PRO A 197 -1.438 -12.898 2.628 1.00 70.11 H new ATOM 692 N GLY A 203 -1.276 -13.952 5.726 1.00 51.12 N ATOM 693 CA GLY A 203 -0.435 -12.767 5.715 1.00 12.10 C ATOM 694 C GLY A 203 -0.017 -12.377 7.134 1.00 30.13 C ATOM 695 O GLY A 203 -0.406 -13.031 8.101 1.00 32.04 O ATOM 0 HA2 GLY A 203 0.452 -12.952 5.109 1.00 12.10 H new ATOM 0 HA3 GLY A 203 -0.972 -11.940 5.250 1.00 12.10 H new ATOM 699 N PRO A 204 0.791 -11.287 7.216 1.00 51.22 N ATOM 700 CA PRO A 204 1.205 -10.570 6.022 1.00 52.12 C ATOM 701 C PRO A 204 2.277 -11.349 5.259 1.00 60.43 C ATOM 702 O PRO A 204 3.330 -11.669 5.811 1.00 3.43 O ATOM 703 CB PRO A 204 1.695 -9.221 6.524 1.00 35.24 C ATOM 704 CG PRO A 204 1.973 -9.403 8.006 1.00 4.33 C ATOM 705 CD PRO A 204 1.330 -10.709 8.444 1.00 14.22 C ATOM 0 HA PRO A 204 0.394 -10.443 5.305 1.00 52.12 H new ATOM 0 HB2 PRO A 204 2.595 -8.910 5.993 1.00 35.24 H new ATOM 0 HB3 PRO A 204 0.945 -8.447 6.360 1.00 35.24 H new ATOM 0 HG2 PRO A 204 3.047 -9.425 8.193 1.00 4.33 H new ATOM 0 HG3 PRO A 204 1.567 -8.567 8.576 1.00 4.33 H new ATOM 0 HD2 PRO A 204 2.059 -11.373 8.908 1.00 14.22 H new ATOM 0 HD3 PRO A 204 0.544 -10.536 9.179 1.00 14.22 H new ATOM 710 N GLY A 205 1.973 -11.635 4.002 1.00 74.34 N ATOM 711 CA GLY A 205 2.899 -12.371 3.157 1.00 21.44 C ATOM 712 C GLY A 205 3.702 -11.422 2.265 1.00 14.23 C ATOM 713 O GLY A 205 3.239 -10.330 1.939 1.00 32.01 O ATOM 0 H GLY A 205 1.099 -11.371 3.548 1.00 74.34 H new ATOM 0 HA2 GLY A 205 3.579 -12.954 3.778 1.00 21.44 H new ATOM 0 HA3 GLY A 205 2.348 -13.078 2.538 1.00 21.44 H new ATOM 717 N LEU A 206 4.892 -11.873 1.895 1.00 3.23 N ATOM 718 CA LEU A 206 5.764 -11.077 1.048 1.00 22.44 C ATOM 719 C LEU A 206 5.423 -11.343 -0.419 1.00 71.32 C ATOM 720 O LEU A 206 5.043 -12.457 -0.780 1.00 51.11 O ATOM 721 CB LEU A 206 7.230 -11.336 1.395 1.00 51.53 C ATOM 722 CG LEU A 206 8.253 -10.949 0.324 1.00 21.24 C ATOM 723 CD1 LEU A 206 9.077 -9.738 0.766 1.00 35.54 C ATOM 724 CD2 LEU A 206 9.138 -12.141 -0.046 1.00 1.33 C ATOM 0 H LEU A 206 5.273 -12.780 2.166 1.00 3.23 H new ATOM 0 HA LEU A 206 5.602 -10.014 1.226 1.00 22.44 H new ATOM 0 HB2 LEU A 206 7.468 -10.792 2.309 1.00 51.53 H new ATOM 0 HB3 LEU A 206 7.348 -12.397 1.615 1.00 51.53 H new ATOM 0 HG LEU A 206 7.712 -10.659 -0.577 1.00 21.24 H new ATOM 0 HD11 LEU A 206 9.796 -9.484 -0.013 1.00 35.54 H new ATOM 0 HD12 LEU A 206 8.414 -8.890 0.939 1.00 35.54 H new ATOM 0 HD13 LEU A 206 9.609 -9.976 1.687 1.00 35.54 H new ATOM 0 HD21 LEU A 206 9.856 -11.839 -0.809 1.00 1.33 H new ATOM 0 HD22 LEU A 206 9.673 -12.486 0.839 1.00 1.33 H new ATOM 0 HD23 LEU A 206 8.517 -12.949 -0.432 1.00 1.33 H new ATOM 735 N VAL A 207 5.571 -10.303 -1.227 1.00 24.44 N ATOM 736 CA VAL A 207 5.284 -10.412 -2.647 1.00 2.44 C ATOM 737 C VAL A 207 6.029 -9.306 -3.400 1.00 44.34 C ATOM 738 O VAL A 207 5.907 -8.130 -3.062 1.00 44.44 O ATOM 739 CB VAL A 207 3.771 -10.377 -2.879 1.00 54.33 C ATOM 740 CG1 VAL A 207 3.189 -11.792 -2.903 1.00 74.10 C ATOM 741 CG2 VAL A 207 3.075 -9.514 -1.826 1.00 64.42 C ATOM 0 H VAL A 207 5.886 -9.381 -0.925 1.00 24.44 H new ATOM 0 HA VAL A 207 5.638 -11.367 -3.036 1.00 2.44 H new ATOM 0 HB VAL A 207 3.591 -9.924 -3.854 1.00 54.33 H new ATOM 0 HG11 VAL A 207 2.113 -11.740 -3.069 1.00 74.10 H new ATOM 0 HG12 VAL A 207 3.653 -12.363 -3.707 1.00 74.10 H new ATOM 0 HG13 VAL A 207 3.386 -12.282 -1.950 1.00 74.10 H new ATOM 0 HG21 VAL A 207 2.001 -9.506 -2.014 1.00 64.42 H new ATOM 0 HG22 VAL A 207 3.267 -9.924 -0.835 1.00 64.42 H new ATOM 0 HG23 VAL A 207 3.460 -8.496 -1.878 1.00 64.42 H new ATOM 751 N PRO A 208 6.804 -9.736 -4.431 1.00 13.53 N ATOM 752 CA PRO A 208 7.569 -8.796 -5.233 1.00 62.34 C ATOM 753 C PRO A 208 6.659 -8.026 -6.192 1.00 20.43 C ATOM 754 O PRO A 208 5.466 -8.311 -6.284 1.00 52.01 O ATOM 755 CB PRO A 208 8.606 -9.646 -5.951 1.00 2.25 C ATOM 756 CG PRO A 208 8.090 -11.075 -5.887 1.00 13.44 C ATOM 757 CD PRO A 208 6.972 -11.121 -4.860 1.00 43.23 C ATOM 0 HA PRO A 208 8.051 -8.025 -4.632 1.00 62.34 H new ATOM 0 HB2 PRO A 208 8.730 -9.321 -6.984 1.00 2.25 H new ATOM 0 HB3 PRO A 208 9.581 -9.561 -5.471 1.00 2.25 H new ATOM 0 HG2 PRO A 208 7.725 -11.393 -6.863 1.00 13.44 H new ATOM 0 HG3 PRO A 208 8.892 -11.758 -5.609 1.00 13.44 H new ATOM 0 HD2 PRO A 208 6.053 -11.515 -5.293 1.00 43.23 H new ATOM 0 HD3 PRO A 208 7.232 -11.766 -4.021 1.00 43.23 H new ATOM 762 N VAL A 209 7.257 -7.066 -6.881 1.00 24.12 N ATOM 763 CA VAL A 209 6.515 -6.252 -7.830 1.00 22.41 C ATOM 764 C VAL A 209 6.628 -6.871 -9.224 1.00 61.51 C ATOM 765 O VAL A 209 6.147 -6.301 -10.201 1.00 31.51 O ATOM 766 CB VAL A 209 7.009 -4.805 -7.777 1.00 0.10 C ATOM 767 CG1 VAL A 209 7.822 -4.549 -6.506 1.00 20.23 C ATOM 768 CG2 VAL A 209 7.822 -4.457 -9.026 1.00 23.41 C ATOM 0 H VAL A 209 8.247 -6.833 -6.802 1.00 24.12 H new ATOM 0 HA VAL A 209 5.457 -6.230 -7.569 1.00 22.41 H new ATOM 0 HB VAL A 209 6.135 -4.154 -7.753 1.00 0.10 H new ATOM 0 HG11 VAL A 209 8.161 -3.513 -6.493 1.00 20.23 H new ATOM 0 HG12 VAL A 209 7.199 -4.738 -5.632 1.00 20.23 H new ATOM 0 HG13 VAL A 209 8.686 -5.214 -6.486 1.00 20.23 H new ATOM 0 HG21 VAL A 209 8.161 -3.423 -8.963 1.00 23.41 H new ATOM 0 HG22 VAL A 209 8.686 -5.119 -9.094 1.00 23.41 H new ATOM 0 HG23 VAL A 209 7.199 -4.581 -9.912 1.00 23.41 H new ATOM 778 N GLY A 210 7.266 -8.032 -9.271 1.00 31.50 N ATOM 779 CA GLY A 210 7.449 -8.735 -10.530 1.00 22.24 C ATOM 780 C GLY A 210 6.575 -9.990 -10.587 1.00 35.01 C ATOM 781 O GLY A 210 6.655 -10.763 -11.541 1.00 74.30 O ATOM 0 H GLY A 210 7.662 -8.503 -8.458 1.00 31.50 H new ATOM 0 HA2 GLY A 210 7.198 -8.074 -11.360 1.00 22.24 H new ATOM 0 HA3 GLY A 210 8.497 -9.011 -10.648 1.00 22.24 H new ATOM 785 N PHE A 211 5.760 -10.154 -9.555 1.00 34.42 N ATOM 786 CA PHE A 211 4.872 -11.301 -9.478 1.00 41.05 C ATOM 787 C PHE A 211 3.461 -10.877 -9.068 1.00 5.51 C ATOM 788 O PHE A 211 2.609 -11.720 -8.793 1.00 72.54 O ATOM 789 CB PHE A 211 5.443 -12.235 -8.408 1.00 22.44 C ATOM 790 CG PHE A 211 6.461 -13.245 -8.941 1.00 33.11 C ATOM 791 CD1 PHE A 211 7.766 -12.886 -9.079 1.00 25.02 C ATOM 792 CD2 PHE A 211 6.062 -14.500 -9.278 1.00 71.40 C ATOM 793 CE1 PHE A 211 8.711 -13.823 -9.574 1.00 34.11 C ATOM 794 CE2 PHE A 211 7.007 -15.437 -9.773 1.00 20.50 C ATOM 795 CZ PHE A 211 8.312 -15.078 -9.911 1.00 72.40 C ATOM 0 H PHE A 211 5.696 -9.511 -8.765 1.00 34.42 H new ATOM 0 HA PHE A 211 4.806 -11.787 -10.451 1.00 41.05 H new ATOM 0 HB2 PHE A 211 5.916 -11.634 -7.631 1.00 22.44 H new ATOM 0 HB3 PHE A 211 4.622 -12.776 -7.937 1.00 22.44 H new ATOM 0 HD1 PHE A 211 8.083 -11.889 -8.812 1.00 25.02 H new ATOM 0 HD2 PHE A 211 5.026 -14.784 -9.169 1.00 71.40 H new ATOM 0 HE1 PHE A 211 9.747 -13.539 -9.683 1.00 34.11 H new ATOM 0 HE2 PHE A 211 6.690 -16.434 -10.040 1.00 20.50 H new ATOM 0 HZ PHE A 211 9.031 -15.790 -10.288 1.00 72.40 H new ATOM 804 N VAL A 212 3.258 -9.568 -9.036 1.00 34.33 N ATOM 805 CA VAL A 212 1.964 -9.020 -8.665 1.00 2.02 C ATOM 806 C VAL A 212 1.771 -7.666 -9.352 1.00 65.22 C ATOM 807 O VAL A 212 2.735 -7.056 -9.811 1.00 71.05 O ATOM 808 CB VAL A 212 1.849 -8.939 -7.141 1.00 2.51 C ATOM 809 CG1 VAL A 212 2.347 -10.227 -6.483 1.00 33.51 C ATOM 810 CG2 VAL A 212 2.601 -7.721 -6.599 1.00 4.24 C ATOM 0 H VAL A 212 3.968 -8.871 -9.261 1.00 34.33 H new ATOM 0 HA VAL A 212 1.161 -9.674 -9.005 1.00 2.02 H new ATOM 0 HB VAL A 212 0.795 -8.822 -6.891 1.00 2.51 H new ATOM 0 HG11 VAL A 212 2.254 -10.142 -5.400 1.00 33.51 H new ATOM 0 HG12 VAL A 212 1.750 -11.069 -6.834 1.00 33.51 H new ATOM 0 HG13 VAL A 212 3.392 -10.389 -6.746 1.00 33.51 H new ATOM 0 HG21 VAL A 212 2.504 -7.687 -5.514 1.00 4.24 H new ATOM 0 HG22 VAL A 212 3.655 -7.795 -6.867 1.00 4.24 H new ATOM 0 HG23 VAL A 212 2.181 -6.812 -7.030 1.00 4.24 H new ATOM 820 N SER A 213 0.519 -7.238 -9.402 1.00 4.31 N ATOM 821 CA SER A 213 0.186 -5.968 -10.025 1.00 51.23 C ATOM 822 C SER A 213 -0.658 -5.121 -9.070 1.00 61.30 C ATOM 823 O SER A 213 -1.613 -5.617 -8.475 1.00 0.32 O ATOM 824 CB SER A 213 -0.557 -6.180 -11.345 1.00 51.54 C ATOM 825 OG SER A 213 -1.305 -5.030 -11.727 1.00 4.25 O ATOM 0 H SER A 213 -0.278 -7.748 -9.021 1.00 4.31 H new ATOM 0 HA SER A 213 1.115 -5.441 -10.243 1.00 51.23 H new ATOM 0 HB2 SER A 213 0.160 -6.423 -12.129 1.00 51.54 H new ATOM 0 HB3 SER A 213 -1.228 -7.034 -11.250 1.00 51.54 H new ATOM 0 HG SER A 213 -1.764 -5.205 -12.575 1.00 4.25 H new ATOM 830 N ILE A 214 -0.276 -3.857 -8.955 1.00 64.24 N ATOM 831 CA ILE A 214 -0.986 -2.937 -8.082 1.00 74.42 C ATOM 832 C ILE A 214 -2.239 -2.430 -8.798 1.00 3.50 C ATOM 833 O ILE A 214 -2.236 -2.255 -10.015 1.00 32.24 O ATOM 834 CB ILE A 214 -0.053 -1.821 -7.609 1.00 43.33 C ATOM 835 CG1 ILE A 214 1.273 -2.393 -7.102 1.00 3.53 C ATOM 836 CG2 ILE A 214 -0.738 -0.943 -6.559 1.00 60.02 C ATOM 837 CD1 ILE A 214 1.184 -2.745 -5.615 1.00 0.11 C ATOM 0 H ILE A 214 0.516 -3.449 -9.452 1.00 64.24 H new ATOM 0 HA ILE A 214 -1.319 -3.447 -7.178 1.00 74.42 H new ATOM 0 HB ILE A 214 0.177 -1.183 -8.462 1.00 43.33 H new ATOM 0 HG12 ILE A 214 1.533 -3.283 -7.675 1.00 3.53 H new ATOM 0 HG13 ILE A 214 2.071 -1.668 -7.261 1.00 3.53 H new ATOM 0 HG21 ILE A 214 -0.054 -0.157 -6.239 1.00 60.02 H new ATOM 0 HG22 ILE A 214 -1.632 -0.492 -6.989 1.00 60.02 H new ATOM 0 HG23 ILE A 214 -1.017 -1.553 -5.700 1.00 60.02 H new ATOM 0 HD11 ILE A 214 2.139 -3.149 -5.279 1.00 0.11 H new ATOM 0 HD12 ILE A 214 0.948 -1.848 -5.042 1.00 0.11 H new ATOM 0 HD13 ILE A 214 0.402 -3.489 -5.463 1.00 0.11 H new ATOM 848 N ILE A 215 -3.282 -2.207 -8.011 1.00 64.03 N ATOM 849 CA ILE A 215 -4.540 -1.722 -8.553 1.00 73.44 C ATOM 850 C ILE A 215 -5.418 -1.209 -7.411 1.00 4.41 C ATOM 851 O ILE A 215 -5.220 -1.579 -6.254 1.00 74.52 O ATOM 852 CB ILE A 215 -5.208 -2.804 -9.404 1.00 73.20 C ATOM 853 CG1 ILE A 215 -4.923 -4.198 -8.842 1.00 34.13 C ATOM 854 CG2 ILE A 215 -4.792 -2.681 -10.872 1.00 55.14 C ATOM 855 CD1 ILE A 215 -5.463 -5.285 -9.774 1.00 61.23 C ATOM 0 H ILE A 215 -3.281 -2.353 -7.002 1.00 64.03 H new ATOM 0 HA ILE A 215 -4.367 -0.881 -9.225 1.00 73.44 H new ATOM 0 HB ILE A 215 -6.287 -2.655 -9.361 1.00 73.20 H new ATOM 0 HG12 ILE A 215 -3.849 -4.328 -8.709 1.00 34.13 H new ATOM 0 HG13 ILE A 215 -5.380 -4.298 -7.858 1.00 34.13 H new ATOM 0 HG21 ILE A 215 -5.281 -3.462 -11.455 1.00 55.14 H new ATOM 0 HG22 ILE A 215 -5.088 -1.704 -11.253 1.00 55.14 H new ATOM 0 HG23 ILE A 215 -3.711 -2.790 -10.954 1.00 55.14 H new ATOM 0 HD11 ILE A 215 -5.247 -6.266 -9.352 1.00 61.23 H new ATOM 0 HD12 ILE A 215 -6.541 -5.167 -9.885 1.00 61.23 H new ATOM 0 HD13 ILE A 215 -4.986 -5.197 -10.750 1.00 61.23 H new ATOM 991 N ASP A 226 3.736 4.722 -11.941 1.00 31.43 N ATOM 992 CA ASP A 226 4.346 3.413 -11.783 1.00 62.33 C ATOM 993 C ASP A 226 4.262 2.989 -10.316 1.00 63.30 C ATOM 994 O ASP A 226 4.270 3.832 -9.421 1.00 4.21 O ATOM 995 CB ASP A 226 5.822 3.440 -12.183 1.00 13.13 C ATOM 996 CG ASP A 226 6.416 2.082 -12.560 1.00 34.12 C ATOM 997 OD1 ASP A 226 7.644 1.907 -12.585 1.00 25.42 O ATOM 998 OD2 ASP A 226 5.551 1.168 -12.842 1.00 54.21 O ATOM 0 HA ASP A 226 3.811 2.713 -12.425 1.00 62.33 H new ATOM 0 HB2 ASP A 226 5.941 4.119 -13.028 1.00 13.13 H new ATOM 0 HB3 ASP A 226 6.399 3.855 -11.357 1.00 13.13 H new ATOM 1003 N VAL A 227 4.183 1.681 -10.114 1.00 24.10 N ATOM 1004 CA VAL A 227 4.097 1.135 -8.770 1.00 1.23 C ATOM 1005 C VAL A 227 5.037 1.912 -7.847 1.00 15.43 C ATOM 1006 O VAL A 227 4.611 2.437 -6.820 1.00 4.43 O ATOM 1007 CB VAL A 227 4.390 -0.367 -8.796 1.00 54.02 C ATOM 1008 CG1 VAL A 227 5.401 -0.709 -9.892 1.00 52.54 C ATOM 1009 CG2 VAL A 227 4.877 -0.854 -7.429 1.00 14.30 C ATOM 0 H VAL A 227 4.177 0.984 -10.859 1.00 24.10 H new ATOM 0 HA VAL A 227 3.087 1.249 -8.375 1.00 1.23 H new ATOM 0 HB VAL A 227 3.459 -0.886 -9.025 1.00 54.02 H new ATOM 0 HG11 VAL A 227 5.592 -1.782 -9.889 1.00 52.54 H new ATOM 0 HG12 VAL A 227 5.000 -0.414 -10.862 1.00 52.54 H new ATOM 0 HG13 VAL A 227 6.333 -0.174 -9.707 1.00 52.54 H new ATOM 0 HG21 VAL A 227 5.078 -1.924 -7.475 1.00 14.30 H new ATOM 0 HG22 VAL A 227 5.790 -0.324 -7.158 1.00 14.30 H new ATOM 0 HG23 VAL A 227 4.110 -0.661 -6.679 1.00 14.30 H new ATOM 1019 N ILE A 228 6.299 1.963 -8.248 1.00 40.24 N ATOM 1020 CA ILE A 228 7.303 2.668 -7.469 1.00 70.14 C ATOM 1021 C ILE A 228 6.856 4.115 -7.259 1.00 44.42 C ATOM 1022 O ILE A 228 6.994 4.658 -6.163 1.00 54.12 O ATOM 1023 CB ILE A 228 8.678 2.539 -8.127 1.00 54.25 C ATOM 1024 CG1 ILE A 228 9.091 1.071 -8.254 1.00 42.24 C ATOM 1025 CG2 ILE A 228 9.725 3.365 -7.376 1.00 41.34 C ATOM 1026 CD1 ILE A 228 8.855 0.556 -9.675 1.00 34.24 C ATOM 0 H ILE A 228 6.649 1.528 -9.102 1.00 40.24 H new ATOM 0 HA ILE A 228 7.404 2.219 -6.481 1.00 70.14 H new ATOM 0 HB ILE A 228 8.612 2.943 -9.137 1.00 54.25 H new ATOM 0 HG12 ILE A 228 10.144 0.962 -7.994 1.00 42.24 H new ATOM 0 HG13 ILE A 228 8.524 0.467 -7.546 1.00 42.24 H new ATOM 0 HG21 ILE A 228 10.693 3.256 -7.864 1.00 41.34 H new ATOM 0 HG22 ILE A 228 9.432 4.415 -7.381 1.00 41.34 H new ATOM 0 HG23 ILE A 228 9.796 3.013 -6.347 1.00 41.34 H new ATOM 0 HD11 ILE A 228 9.157 -0.489 -9.738 1.00 34.24 H new ATOM 0 HD12 ILE A 228 7.797 0.644 -9.923 1.00 34.24 H new ATOM 0 HD13 ILE A 228 9.443 1.146 -10.378 1.00 34.24 H new ATOM 1037 N GLU A 229 6.327 4.699 -8.323 1.00 75.21 N ATOM 1038 CA GLU A 229 5.858 6.073 -8.270 1.00 64.24 C ATOM 1039 C GLU A 229 4.623 6.177 -7.372 1.00 11.31 C ATOM 1040 O GLU A 229 4.229 7.273 -6.978 1.00 30.43 O ATOM 1041 CB GLU A 229 5.564 6.608 -9.672 1.00 51.20 C ATOM 1042 CG GLU A 229 6.854 6.769 -10.479 1.00 55.51 C ATOM 1043 CD GLU A 229 6.762 7.969 -11.425 1.00 60.44 C ATOM 1044 OE1 GLU A 229 6.224 7.842 -12.536 1.00 43.34 O ATOM 1045 OE2 GLU A 229 7.274 9.062 -10.972 1.00 41.42 O ATOM 0 H GLU A 229 6.212 4.245 -9.229 1.00 75.21 H new ATOM 0 HA GLU A 229 6.648 6.690 -7.842 1.00 64.24 H new ATOM 0 HB2 GLU A 229 4.889 5.927 -10.191 1.00 51.20 H new ATOM 0 HB3 GLU A 229 5.054 7.569 -9.599 1.00 51.20 H new ATOM 0 HG2 GLU A 229 7.698 6.899 -9.801 1.00 55.51 H new ATOM 0 HG3 GLU A 229 7.044 5.862 -11.053 1.00 55.51 H new ATOM 1051 N ASP A 230 4.047 5.021 -7.076 1.00 60.22 N ATOM 1052 CA ASP A 230 2.865 4.968 -6.234 1.00 11.22 C ATOM 1053 C ASP A 230 3.292 4.863 -4.768 1.00 13.43 C ATOM 1054 O ASP A 230 2.506 5.150 -3.866 1.00 74.24 O ATOM 1055 CB ASP A 230 2.007 3.745 -6.564 1.00 34.30 C ATOM 1056 CG ASP A 230 0.600 3.760 -5.963 1.00 15.20 C ATOM 1057 OD1 ASP A 230 -0.397 3.549 -6.668 1.00 23.04 O ATOM 1058 OD2 ASP A 230 0.551 4.006 -4.698 1.00 62.10 O ATOM 0 H ASP A 230 4.377 4.114 -7.405 1.00 60.22 H new ATOM 0 HA ASP A 230 2.285 5.874 -6.411 1.00 11.22 H new ATOM 0 HB2 ASP A 230 1.922 3.661 -7.647 1.00 34.30 H new ATOM 0 HB3 ASP A 230 2.525 2.852 -6.215 1.00 34.30 H new ATOM 1063 N ILE A 231 4.537 4.453 -4.577 1.00 44.33 N ATOM 1064 CA ILE A 231 5.079 4.306 -3.236 1.00 14.51 C ATOM 1065 C ILE A 231 5.226 5.689 -2.597 1.00 52.42 C ATOM 1066 O ILE A 231 4.504 6.024 -1.659 1.00 24.32 O ATOM 1067 CB ILE A 231 6.380 3.503 -3.269 1.00 62.25 C ATOM 1068 CG1 ILE A 231 6.115 2.020 -3.000 1.00 55.10 C ATOM 1069 CG2 ILE A 231 7.410 4.086 -2.298 1.00 33.30 C ATOM 1070 CD1 ILE A 231 6.073 1.225 -4.307 1.00 40.10 C ATOM 0 H ILE A 231 5.186 4.218 -5.328 1.00 44.33 H new ATOM 0 HA ILE A 231 4.395 3.734 -2.609 1.00 14.51 H new ATOM 0 HB ILE A 231 6.803 3.579 -4.271 1.00 62.25 H new ATOM 0 HG12 ILE A 231 6.894 1.619 -2.351 1.00 55.10 H new ATOM 0 HG13 ILE A 231 5.169 1.906 -2.470 1.00 55.10 H new ATOM 0 HG21 ILE A 231 8.326 3.496 -2.341 1.00 33.30 H new ATOM 0 HG22 ILE A 231 7.629 5.117 -2.576 1.00 33.30 H new ATOM 0 HG23 ILE A 231 7.010 4.061 -1.284 1.00 33.30 H new ATOM 0 HD11 ILE A 231 5.883 0.174 -4.088 1.00 40.10 H new ATOM 0 HD12 ILE A 231 5.277 1.612 -4.943 1.00 40.10 H new ATOM 0 HD13 ILE A 231 7.029 1.321 -4.822 1.00 40.10 H new ATOM 1081 N LYS A 232 6.166 6.456 -3.130 1.00 71.24 N ATOM 1082 CA LYS A 232 6.418 7.794 -2.623 1.00 40.21 C ATOM 1083 C LYS A 232 5.145 8.633 -2.760 1.00 55.14 C ATOM 1084 O LYS A 232 4.953 9.599 -2.024 1.00 44.50 O ATOM 1085 CB LYS A 232 7.638 8.408 -3.313 1.00 5.23 C ATOM 1086 CG LYS A 232 7.268 8.960 -4.691 1.00 31.22 C ATOM 1087 CD LYS A 232 7.154 7.834 -5.721 1.00 43.24 C ATOM 1088 CE LYS A 232 8.425 6.982 -5.744 1.00 64.13 C ATOM 1089 NZ LYS A 232 9.613 7.817 -5.459 1.00 74.14 N ATOM 0 H LYS A 232 6.763 6.176 -3.908 1.00 71.24 H new ATOM 0 HA LYS A 232 6.666 7.760 -1.562 1.00 40.21 H new ATOM 0 HB2 LYS A 232 8.046 9.207 -2.695 1.00 5.23 H new ATOM 0 HB3 LYS A 232 8.419 7.655 -3.417 1.00 5.23 H new ATOM 0 HG2 LYS A 232 6.322 9.498 -4.629 1.00 31.22 H new ATOM 0 HG3 LYS A 232 8.022 9.678 -5.014 1.00 31.22 H new ATOM 0 HD2 LYS A 232 6.295 7.206 -5.485 1.00 43.24 H new ATOM 0 HD3 LYS A 232 6.977 8.257 -6.710 1.00 43.24 H new ATOM 0 HE2 LYS A 232 8.348 6.184 -5.006 1.00 64.13 H new ATOM 0 HE3 LYS A 232 8.533 6.506 -6.718 1.00 64.13 H new ATOM 0 HZ1 LYS A 232 10.451 7.392 -5.904 1.00 74.14 H new ATOM 0 HZ2 LYS A 232 9.465 8.773 -5.842 1.00 74.14 H new ATOM 0 HZ3 LYS A 232 9.758 7.874 -4.431 1.00 74.14 H new ATOM 1098 N SER A 233 4.311 8.234 -3.708 1.00 31.14 N ATOM 1099 CA SER A 233 3.063 8.938 -3.951 1.00 24.31 C ATOM 1100 C SER A 233 2.324 9.163 -2.631 1.00 60.12 C ATOM 1101 O SER A 233 2.023 10.300 -2.271 1.00 24.04 O ATOM 1102 CB SER A 233 2.177 8.164 -4.931 1.00 4.44 C ATOM 1103 OG SER A 233 2.358 8.603 -6.274 1.00 34.51 O ATOM 0 H SER A 233 4.474 7.432 -4.317 1.00 31.14 H new ATOM 0 HA SER A 233 3.296 9.904 -4.398 1.00 24.31 H new ATOM 0 HB2 SER A 233 2.405 7.100 -4.863 1.00 4.44 H new ATOM 0 HB3 SER A 233 1.131 8.285 -4.648 1.00 4.44 H new ATOM 0 HG SER A 233 3.261 8.369 -6.576 1.00 34.51 H new ATOM 1108 N VAL A 234 2.054 8.062 -1.945 1.00 21.31 N ATOM 1109 CA VAL A 234 1.355 8.126 -0.672 1.00 53.02 C ATOM 1110 C VAL A 234 2.379 8.184 0.463 1.00 64.12 C ATOM 1111 O VAL A 234 2.087 7.780 1.588 1.00 23.34 O ATOM 1112 CB VAL A 234 0.389 6.946 -0.546 1.00 31.44 C ATOM 1113 CG1 VAL A 234 -0.259 6.621 -1.894 1.00 53.32 C ATOM 1114 CG2 VAL A 234 1.094 5.719 0.034 1.00 70.42 C ATOM 0 H VAL A 234 2.306 7.121 -2.246 1.00 21.31 H new ATOM 0 HA VAL A 234 0.751 9.031 -0.612 1.00 53.02 H new ATOM 0 HB VAL A 234 -0.403 7.234 0.145 1.00 31.44 H new ATOM 0 HG11 VAL A 234 -0.941 5.779 -1.776 1.00 53.32 H new ATOM 0 HG12 VAL A 234 -0.813 7.489 -2.250 1.00 53.32 H new ATOM 0 HG13 VAL A 234 0.515 6.363 -2.617 1.00 53.32 H new ATOM 0 HG21 VAL A 234 0.385 4.895 0.113 1.00 70.42 H new ATOM 0 HG22 VAL A 234 1.916 5.429 -0.620 1.00 70.42 H new ATOM 0 HG23 VAL A 234 1.484 5.957 1.023 1.00 70.42 H new ATOM 1124 N ASN A 235 3.557 8.689 0.130 1.00 60.31 N ATOM 1125 CA ASN A 235 4.626 8.805 1.108 1.00 24.42 C ATOM 1126 C ASN A 235 4.665 7.539 1.967 1.00 72.31 C ATOM 1127 O ASN A 235 5.046 7.588 3.135 1.00 32.03 O ATOM 1128 CB ASN A 235 4.395 9.998 2.036 1.00 41.52 C ATOM 1129 CG ASN A 235 4.580 11.319 1.288 1.00 12.24 C ATOM 1130 OD1 ASN A 235 4.028 11.542 0.223 1.00 34.41 O ATOM 1131 ND2 ASN A 235 5.385 12.182 1.902 1.00 31.11 N ATOM 0 H ASN A 235 3.795 9.023 -0.804 1.00 60.31 H new ATOM 0 HA ASN A 235 5.563 8.943 0.569 1.00 24.42 H new ATOM 0 HB2 ASN A 235 3.389 9.950 2.452 1.00 41.52 H new ATOM 0 HB3 ASN A 235 5.090 9.951 2.875 1.00 41.52 H new ATOM 0 HD21 ASN A 235 5.571 13.093 1.482 1.00 31.11 H new ATOM 0 HD22 ASN A 235 5.816 11.933 2.792 1.00 31.11 H new ATOM 1137 N LEU A 236 4.266 6.434 1.353 1.00 50.34 N ATOM 1138 CA LEU A 236 4.252 5.157 2.047 1.00 31.14 C ATOM 1139 C LEU A 236 5.666 4.826 2.527 1.00 30.12 C ATOM 1140 O LEU A 236 6.593 4.734 1.723 1.00 24.03 O ATOM 1141 CB LEU A 236 3.633 4.074 1.160 1.00 43.03 C ATOM 1142 CG LEU A 236 3.969 2.629 1.535 1.00 31.24 C ATOM 1143 CD1 LEU A 236 3.121 2.158 2.718 1.00 61.11 C ATOM 1144 CD2 LEU A 236 3.830 1.702 0.325 1.00 33.00 C ATOM 0 H LEU A 236 3.950 6.397 0.384 1.00 50.34 H new ATOM 0 HA LEU A 236 3.620 5.211 2.934 1.00 31.14 H new ATOM 0 HB2 LEU A 236 2.550 4.191 1.180 1.00 43.03 H new ATOM 0 HB3 LEU A 236 3.954 4.246 0.133 1.00 43.03 H new ATOM 0 HG LEU A 236 5.011 2.592 1.851 1.00 31.24 H new ATOM 0 HD11 LEU A 236 3.380 1.128 2.964 1.00 61.11 H new ATOM 0 HD12 LEU A 236 3.313 2.796 3.580 1.00 61.11 H new ATOM 0 HD13 LEU A 236 2.065 2.214 2.454 1.00 61.11 H new ATOM 0 HD21 LEU A 236 4.074 0.681 0.619 1.00 33.00 H new ATOM 0 HD22 LEU A 236 2.805 1.738 -0.045 1.00 33.00 H new ATOM 0 HD23 LEU A 236 4.511 2.026 -0.462 1.00 33.00 H new ATOM 1155 N PRO A 237 5.791 4.650 3.869 1.00 1.34 N ATOM 1156 CA PRO A 237 7.076 4.331 4.466 1.00 50.20 C ATOM 1157 C PRO A 237 7.455 2.872 4.206 1.00 11.12 C ATOM 1158 O PRO A 237 6.594 2.050 3.893 1.00 14.12 O ATOM 1159 CB PRO A 237 6.914 4.648 5.944 1.00 22.35 C ATOM 1160 CG PRO A 237 5.416 4.689 6.199 1.00 1.41 C ATOM 1161 CD PRO A 237 4.715 4.752 4.851 1.00 43.14 C ATOM 0 HA PRO A 237 7.894 4.909 4.036 1.00 50.20 H new ATOM 0 HB2 PRO A 237 7.395 3.889 6.561 1.00 22.35 H new ATOM 0 HB3 PRO A 237 7.379 5.602 6.192 1.00 22.35 H new ATOM 0 HG2 PRO A 237 5.099 3.806 6.753 1.00 1.41 H new ATOM 0 HG3 PRO A 237 5.156 5.556 6.806 1.00 1.41 H new ATOM 0 HD2 PRO A 237 3.998 3.939 4.739 1.00 43.14 H new ATOM 0 HD3 PRO A 237 4.161 5.683 4.736 1.00 43.14 H new ATOM 1166 N THR A 238 8.743 2.594 4.344 1.00 4.44 N ATOM 1167 CA THR A 238 9.245 1.248 4.129 1.00 34.24 C ATOM 1168 C THR A 238 8.584 0.269 5.101 1.00 54.23 C ATOM 1169 O THR A 238 7.745 0.663 5.909 1.00 44.34 O ATOM 1170 CB THR A 238 10.770 1.288 4.248 1.00 62.41 C ATOM 1171 OG1 THR A 238 11.137 2.504 3.603 1.00 2.21 O ATOM 1172 CG2 THR A 238 11.452 0.202 3.412 1.00 44.41 C ATOM 0 H THR A 238 9.454 3.278 4.602 1.00 4.44 H new ATOM 0 HA THR A 238 8.992 0.886 3.133 1.00 34.24 H new ATOM 0 HB THR A 238 11.055 1.173 5.294 1.00 62.41 H new ATOM 0 HG1 THR A 238 11.387 3.169 4.277 1.00 2.21 H new ATOM 0 HG21 THR A 238 12.533 0.275 3.532 1.00 44.41 H new ATOM 0 HG22 THR A 238 11.115 -0.779 3.746 1.00 44.41 H new ATOM 0 HG23 THR A 238 11.194 0.336 2.361 1.00 44.41 H new ATOM 1180 N VAL A 239 8.988 -0.988 4.992 1.00 54.12 N ATOM 1181 CA VAL A 239 8.447 -2.026 5.852 1.00 23.23 C ATOM 1182 C VAL A 239 8.976 -1.832 7.274 1.00 52.24 C ATOM 1183 O VAL A 239 8.273 -2.106 8.246 1.00 15.15 O ATOM 1184 CB VAL A 239 8.771 -3.406 5.275 1.00 2.44 C ATOM 1185 CG1 VAL A 239 10.283 -3.627 5.201 1.00 13.42 C ATOM 1186 CG2 VAL A 239 8.094 -4.512 6.087 1.00 33.45 C ATOM 0 H VAL A 239 9.684 -1.311 4.320 1.00 54.12 H new ATOM 0 HA VAL A 239 7.360 -1.956 5.898 1.00 23.23 H new ATOM 0 HB VAL A 239 8.376 -3.447 4.260 1.00 2.44 H new ATOM 0 HG11 VAL A 239 10.487 -4.615 4.788 1.00 13.42 H new ATOM 0 HG12 VAL A 239 10.731 -2.867 4.561 1.00 13.42 H new ATOM 0 HG13 VAL A 239 10.710 -3.557 6.201 1.00 13.42 H new ATOM 0 HG21 VAL A 239 8.340 -5.482 5.656 1.00 33.45 H new ATOM 0 HG22 VAL A 239 8.445 -4.473 7.118 1.00 33.45 H new ATOM 0 HG23 VAL A 239 7.014 -4.369 6.066 1.00 33.45 H new ATOM 1196 N GLN A 240 10.213 -1.363 7.352 1.00 55.13 N ATOM 1197 CA GLN A 240 10.846 -1.130 8.639 1.00 33.31 C ATOM 1198 C GLN A 240 10.473 0.255 9.171 1.00 54.13 C ATOM 1199 O GLN A 240 10.619 0.527 10.361 1.00 55.12 O ATOM 1200 CB GLN A 240 12.364 -1.289 8.540 1.00 51.54 C ATOM 1201 CG GLN A 240 12.735 -2.590 7.825 1.00 24.31 C ATOM 1202 CD GLN A 240 14.019 -2.423 7.011 1.00 43.53 C ATOM 1203 OE1 GLN A 240 14.987 -3.147 7.175 1.00 23.31 O ATOM 1204 NE2 GLN A 240 13.975 -1.429 6.129 1.00 51.12 N ATOM 0 H GLN A 240 10.794 -1.138 6.544 1.00 55.13 H new ATOM 0 HA GLN A 240 10.481 -1.878 9.342 1.00 33.31 H new ATOM 0 HB2 GLN A 240 12.787 -0.441 8.002 1.00 51.54 H new ATOM 0 HB3 GLN A 240 12.800 -1.282 9.539 1.00 51.54 H new ATOM 0 HG2 GLN A 240 12.866 -3.387 8.557 1.00 24.31 H new ATOM 0 HG3 GLN A 240 11.920 -2.892 7.167 1.00 24.31 H new ATOM 0 HE21 GLN A 240 13.132 -0.861 6.043 1.00 51.12 H new ATOM 0 HE22 GLN A 240 14.784 -1.235 5.539 1.00 51.12 H new ATOM 1211 N GLU A 241 9.998 1.095 8.262 1.00 75.22 N ATOM 1212 CA GLU A 241 9.603 2.446 8.625 1.00 75.12 C ATOM 1213 C GLU A 241 8.166 2.456 9.148 1.00 32.23 C ATOM 1214 O GLU A 241 7.877 3.080 10.168 1.00 33.22 O ATOM 1215 CB GLU A 241 9.762 3.400 7.439 1.00 51.42 C ATOM 1216 CG GLU A 241 11.236 3.740 7.202 1.00 64.10 C ATOM 1217 CD GLU A 241 11.379 4.910 6.226 1.00 21.51 C ATOM 1218 OE1 GLU A 241 11.948 4.742 5.138 1.00 62.33 O ATOM 1219 OE2 GLU A 241 10.871 6.023 6.631 1.00 4.23 O ATOM 0 H GLU A 241 9.878 0.866 7.275 1.00 75.22 H new ATOM 0 HA GLU A 241 10.261 2.795 9.421 1.00 75.12 H new ATOM 0 HB2 GLU A 241 9.341 2.945 6.542 1.00 51.42 H new ATOM 0 HB3 GLU A 241 9.200 4.315 7.626 1.00 51.42 H new ATOM 0 HG2 GLU A 241 11.712 3.992 8.150 1.00 64.10 H new ATOM 0 HG3 GLU A 241 11.755 2.867 6.807 1.00 64.10 H new ATOM 1225 N TRP A 242 7.303 1.757 8.426 1.00 14.15 N ATOM 1226 CA TRP A 242 5.902 1.678 8.804 1.00 30.52 C ATOM 1227 C TRP A 242 5.809 0.881 10.107 1.00 52.31 C ATOM 1228 O TRP A 242 5.248 1.360 11.093 1.00 53.31 O ATOM 1229 CB TRP A 242 5.062 1.077 7.675 1.00 44.31 C ATOM 1230 CG TRP A 242 3.686 0.579 8.121 1.00 61.41 C ATOM 1231 CD1 TRP A 242 2.831 1.165 8.970 1.00 12.11 C ATOM 1232 CD2 TRP A 242 3.037 -0.641 7.704 1.00 74.12 C ATOM 1233 NE1 TRP A 242 1.683 0.416 9.130 1.00 24.34 N ATOM 1234 CE2 TRP A 242 1.813 -0.717 8.335 1.00 24.31 C ATOM 1235 CE3 TRP A 242 3.470 -1.647 6.822 1.00 60.34 C ATOM 1236 CZ2 TRP A 242 0.921 -1.781 8.152 1.00 2.42 C ATOM 1237 CZ3 TRP A 242 2.567 -2.703 6.650 1.00 73.01 C ATOM 1238 CH2 TRP A 242 1.331 -2.795 7.278 1.00 51.44 C ATOM 0 H TRP A 242 7.547 1.240 7.581 1.00 14.15 H new ATOM 0 HA TRP A 242 5.492 2.673 8.974 1.00 30.52 H new ATOM 0 HB2 TRP A 242 4.930 1.827 6.895 1.00 44.31 H new ATOM 0 HB3 TRP A 242 5.611 0.247 7.230 1.00 44.31 H new ATOM 0 HD1 TRP A 242 3.017 2.106 9.467 1.00 12.11 H new ATOM 0 HE1 TRP A 242 0.886 0.650 9.722 1.00 24.34 H new ATOM 0 HE3 TRP A 242 4.424 -1.608 6.317 1.00 60.34 H new ATOM 0 HZ2 TRP A 242 -0.032 -1.817 8.658 1.00 2.42 H new ATOM 0 HZ3 TRP A 242 2.851 -3.503 5.982 1.00 73.01 H new ATOM 0 HH2 TRP A 242 0.690 -3.644 7.093 1.00 51.44 H new ATOM 1248 N LYS A 243 6.366 -0.320 10.070 1.00 44.42 N ATOM 1249 CA LYS A 243 6.353 -1.187 11.236 1.00 50.33 C ATOM 1250 C LYS A 243 7.135 -0.521 12.371 1.00 31.24 C ATOM 1251 O LYS A 243 6.983 -0.890 13.534 1.00 24.21 O ATOM 1252 CB LYS A 243 6.866 -2.582 10.873 1.00 32.21 C ATOM 1253 CG LYS A 243 5.957 -3.248 9.839 1.00 32.33 C ATOM 1254 CD LYS A 243 6.017 -4.773 9.956 1.00 54.22 C ATOM 1255 CE LYS A 243 7.456 -5.276 9.821 1.00 44.32 C ATOM 1256 NZ LYS A 243 7.646 -6.516 10.608 1.00 14.21 N ATOM 0 H LYS A 243 6.829 -0.714 9.251 1.00 44.42 H new ATOM 0 HA LYS A 243 5.333 -1.330 11.592 1.00 50.33 H new ATOM 0 HB2 LYS A 243 7.880 -2.509 10.478 1.00 32.21 H new ATOM 0 HB3 LYS A 243 6.916 -3.200 11.770 1.00 32.21 H new ATOM 0 HG2 LYS A 243 4.931 -2.909 9.980 1.00 32.33 H new ATOM 0 HG3 LYS A 243 6.258 -2.945 8.836 1.00 32.33 H new ATOM 0 HD2 LYS A 243 5.608 -5.084 10.917 1.00 54.22 H new ATOM 0 HD3 LYS A 243 5.396 -5.226 9.183 1.00 54.22 H new ATOM 0 HE2 LYS A 243 7.685 -5.465 8.772 1.00 44.32 H new ATOM 0 HE3 LYS A 243 8.150 -4.509 10.166 1.00 44.32 H new ATOM 0 HZ1 LYS A 243 8.657 -6.642 10.819 1.00 14.21 H new ATOM 0 HZ2 LYS A 243 7.112 -6.448 11.498 1.00 14.21 H new ATOM 0 HZ3 LYS A 243 7.303 -7.331 10.060 1.00 14.21 H new ATOM 1265 N SER A 244 7.954 0.450 11.993 1.00 22.44 N ATOM 1266 CA SER A 244 8.758 1.170 12.964 1.00 54.21 C ATOM 1267 C SER A 244 7.899 1.566 14.166 1.00 53.31 C ATOM 1268 O SER A 244 8.109 1.071 15.272 1.00 3.14 O ATOM 1269 CB SER A 244 9.398 2.411 12.336 1.00 1.14 C ATOM 1270 OG SER A 244 10.626 2.758 12.970 1.00 2.11 O ATOM 0 H SER A 244 8.077 0.754 11.027 1.00 22.44 H new ATOM 0 HA SER A 244 9.559 0.511 13.301 1.00 54.21 H new ATOM 0 HB2 SER A 244 9.576 2.230 11.276 1.00 1.14 H new ATOM 0 HB3 SER A 244 8.705 3.250 12.404 1.00 1.14 H new ATOM 0 HG SER A 244 11.003 3.553 12.539 1.00 2.11 H new ATOM 1577 N PHE B 470 10.803 -9.153 8.709 1.00 63.41 N ATOM 1578 CA PHE B 470 9.973 -9.135 7.517 1.00 62.44 C ATOM 1579 C PHE B 470 10.810 -8.837 6.271 1.00 63.53 C ATOM 1580 O PHE B 470 10.265 -8.588 5.197 1.00 41.30 O ATOM 1581 CB PHE B 470 8.944 -8.019 7.704 1.00 41.03 C ATOM 1582 CG PHE B 470 7.664 -8.465 8.414 1.00 52.34 C ATOM 1583 CD1 PHE B 470 7.681 -9.561 9.220 1.00 4.53 C ATOM 1584 CD2 PHE B 470 6.511 -7.767 8.239 1.00 71.11 C ATOM 1585 CE1 PHE B 470 6.492 -9.974 9.879 1.00 60.04 C ATOM 1586 CE2 PHE B 470 5.323 -8.181 8.897 1.00 4.31 C ATOM 1587 CZ PHE B 470 5.339 -9.275 9.704 1.00 61.41 C ATOM 0 HA PHE B 470 9.498 -10.107 7.380 1.00 62.44 H new ATOM 0 HB2 PHE B 470 9.400 -7.210 8.274 1.00 41.03 H new ATOM 0 HB3 PHE B 470 8.683 -7.612 6.727 1.00 41.03 H new ATOM 0 HD1 PHE B 470 8.597 -10.116 9.359 1.00 4.53 H new ATOM 0 HD2 PHE B 470 6.498 -6.897 7.599 1.00 71.11 H new ATOM 0 HE1 PHE B 470 6.504 -10.844 10.519 1.00 60.04 H new ATOM 0 HE2 PHE B 470 4.407 -7.627 8.756 1.00 4.31 H new ATOM 0 HZ PHE B 470 4.436 -9.589 10.206 1.00 61.41 H new ATOM 1596 N ILE B 471 12.122 -8.875 6.456 1.00 14.34 N ATOM 1597 CA ILE B 471 13.040 -8.611 5.360 1.00 61.11 C ATOM 1598 C ILE B 471 13.244 -9.894 4.553 1.00 61.31 C ATOM 1599 O ILE B 471 13.309 -10.985 5.119 1.00 14.22 O ATOM 1600 CB ILE B 471 14.341 -8.002 5.886 1.00 24.44 C ATOM 1601 CG1 ILE B 471 14.078 -6.665 6.581 1.00 72.03 C ATOM 1602 CG2 ILE B 471 15.377 -7.873 4.767 1.00 44.35 C ATOM 1603 CD1 ILE B 471 13.163 -5.777 5.735 1.00 75.23 C ATOM 0 H ILE B 471 12.571 -9.084 7.348 1.00 14.34 H new ATOM 0 HA ILE B 471 12.620 -7.869 4.681 1.00 61.11 H new ATOM 0 HB ILE B 471 14.757 -8.677 6.634 1.00 24.44 H new ATOM 0 HG12 ILE B 471 13.621 -6.841 7.555 1.00 72.03 H new ATOM 0 HG13 ILE B 471 15.023 -6.153 6.761 1.00 72.03 H new ATOM 0 HG21 ILE B 471 16.293 -7.437 5.167 1.00 44.35 H new ATOM 0 HG22 ILE B 471 15.594 -8.859 4.356 1.00 44.35 H new ATOM 0 HG23 ILE B 471 14.984 -7.230 3.979 1.00 44.35 H new ATOM 0 HD11 ILE B 471 12.992 -4.833 6.252 1.00 75.23 H new ATOM 0 HD12 ILE B 471 13.634 -5.583 4.771 1.00 75.23 H new ATOM 0 HD13 ILE B 471 12.210 -6.282 5.578 1.00 75.23 H new ATOM 1614 N PRO B 472 13.341 -9.718 3.208 1.00 31.43 N ATOM 1615 CA PRO B 472 13.536 -10.849 2.316 1.00 44.44 C ATOM 1616 C PRO B 472 14.976 -11.361 2.387 1.00 43.51 C ATOM 1617 O PRO B 472 15.774 -10.872 3.186 1.00 10.13 O ATOM 1618 CB PRO B 472 13.157 -10.334 0.938 1.00 10.34 C ATOM 1619 CG PRO B 472 13.210 -8.817 1.031 1.00 13.12 C ATOM 1620 CD PRO B 472 13.267 -8.442 2.502 1.00 44.22 C ATOM 0 HA PRO B 472 12.923 -11.709 2.587 1.00 44.44 H new ATOM 0 HB2 PRO B 472 13.847 -10.703 0.180 1.00 10.34 H new ATOM 0 HB3 PRO B 472 12.161 -10.673 0.655 1.00 10.34 H new ATOM 0 HG2 PRO B 472 14.084 -8.433 0.505 1.00 13.12 H new ATOM 0 HG3 PRO B 472 12.333 -8.375 0.558 1.00 13.12 H new ATOM 0 HD2 PRO B 472 14.135 -7.819 2.718 1.00 44.22 H new ATOM 0 HD3 PRO B 472 12.385 -7.875 2.800 1.00 44.22 H new ATOM 1625 N SER B 473 15.265 -12.340 1.542 1.00 15.14 N ATOM 1626 CA SER B 473 16.595 -12.923 1.499 1.00 30.11 C ATOM 1627 C SER B 473 17.135 -12.890 0.067 1.00 5.33 C ATOM 1628 O SER B 473 18.194 -13.447 -0.213 1.00 12.20 O ATOM 1629 CB SER B 473 16.583 -14.358 2.029 1.00 35.31 C ATOM 1630 OG SER B 473 17.870 -14.966 1.950 1.00 33.35 O ATOM 0 H SER B 473 14.601 -12.744 0.882 1.00 15.14 H new ATOM 0 HA SER B 473 17.249 -12.332 2.140 1.00 30.11 H new ATOM 0 HB2 SER B 473 16.244 -14.359 3.065 1.00 35.31 H new ATOM 0 HB3 SER B 473 15.867 -14.949 1.459 1.00 35.31 H new ATOM 0 HG SER B 473 18.393 -14.534 1.243 1.00 33.35 H new ATOM 1635 N ARG B 474 16.381 -12.230 -0.800 1.00 43.31 N ATOM 1636 CA ARG B 474 16.771 -12.116 -2.195 1.00 22.14 C ATOM 1637 C ARG B 474 16.411 -10.731 -2.735 1.00 10.14 C ATOM 1638 O ARG B 474 15.528 -10.062 -2.200 1.00 30.53 O ATOM 1639 CB ARG B 474 16.083 -13.184 -3.047 1.00 14.20 C ATOM 1640 CG ARG B 474 16.459 -14.589 -2.575 1.00 23.40 C ATOM 1641 CD ARG B 474 17.821 -15.009 -3.130 1.00 71.53 C ATOM 1642 NE ARG B 474 17.706 -15.313 -4.575 1.00 64.44 N ATOM 1643 CZ ARG B 474 18.742 -15.277 -5.440 1.00 23.33 C ATOM 1644 NH1 ARG B 474 19.980 -14.948 -5.015 1.00 44.11 N ATOM 1645 NH2 ARG B 474 18.525 -15.568 -6.710 1.00 3.45 N ATOM 0 H ARG B 474 15.502 -11.769 -0.563 1.00 43.31 H new ATOM 0 HA ARG B 474 17.850 -12.262 -2.252 1.00 22.14 H new ATOM 0 HB2 ARG B 474 15.002 -13.056 -2.993 1.00 14.20 H new ATOM 0 HB3 ARG B 474 16.367 -13.059 -4.092 1.00 14.20 H new ATOM 0 HG2 ARG B 474 16.482 -14.616 -1.486 1.00 23.40 H new ATOM 0 HG3 ARG B 474 15.697 -15.300 -2.895 1.00 23.40 H new ATOM 0 HD2 ARG B 474 18.548 -14.212 -2.974 1.00 71.53 H new ATOM 0 HD3 ARG B 474 18.188 -15.884 -2.594 1.00 71.53 H new ATOM 0 HE ARG B 474 16.787 -15.565 -4.939 1.00 64.44 H new ATOM 0 HH11 ARG B 474 20.139 -14.724 -4.033 1.00 44.11 H new ATOM 0 HH12 ARG B 474 20.756 -14.924 -5.676 1.00 44.11 H new ATOM 0 HH21 ARG B 474 17.586 -15.815 -7.023 1.00 3.45 H new ATOM 0 HH22 ARG B 474 19.296 -15.546 -7.377 1.00 3.45 H new ATOM 1655 N PRO B 475 17.131 -10.331 -3.818 1.00 45.41 N ATOM 1656 CA PRO B 475 16.896 -9.038 -4.436 1.00 31.42 C ATOM 1657 C PRO B 475 15.604 -9.049 -5.257 1.00 1.11 C ATOM 1658 O PRO B 475 14.980 -8.007 -5.454 1.00 60.03 O ATOM 1659 CB PRO B 475 18.133 -8.774 -5.280 1.00 65.31 C ATOM 1660 CG PRO B 475 18.803 -10.125 -5.471 1.00 61.41 C ATOM 1661 CD PRO B 475 18.184 -11.097 -4.478 1.00 75.32 C ATOM 0 HA PRO B 475 16.752 -8.243 -3.705 1.00 31.42 H new ATOM 0 HB2 PRO B 475 17.864 -8.332 -6.239 1.00 65.31 H new ATOM 0 HB3 PRO B 475 18.803 -8.073 -4.783 1.00 65.31 H new ATOM 0 HG2 PRO B 475 18.662 -10.480 -6.492 1.00 61.41 H new ATOM 0 HG3 PRO B 475 19.878 -10.045 -5.307 1.00 61.41 H new ATOM 0 HD2 PRO B 475 17.779 -11.974 -4.982 1.00 75.32 H new ATOM 0 HD3 PRO B 475 18.923 -11.455 -3.761 1.00 75.32 H new ATOM 1666 N ALA B 476 15.241 -10.239 -5.714 1.00 5.20 N ATOM 1667 CA ALA B 476 14.035 -10.399 -6.507 1.00 32.40 C ATOM 1668 C ALA B 476 14.085 -11.744 -7.236 1.00 1.24 C ATOM 1669 O ALA B 476 15.137 -12.149 -7.726 1.00 74.30 O ATOM 1670 CB ALA B 476 13.898 -9.218 -7.471 1.00 21.54 C ATOM 0 H ALA B 476 15.761 -11.101 -5.550 1.00 5.20 H new ATOM 0 HA ALA B 476 13.152 -10.402 -5.868 1.00 32.40 H new ATOM 0 HB1 ALA B 476 12.993 -9.338 -8.067 1.00 21.54 H new ATOM 0 HB2 ALA B 476 13.839 -8.290 -6.903 1.00 21.54 H new ATOM 0 HB3 ALA B 476 14.765 -9.185 -8.131 1.00 21.54 H new ATOM 1676 N PRO B 477 12.903 -12.415 -7.285 1.00 11.24 N ATOM 1677 CA PRO B 477 12.802 -13.705 -7.946 1.00 62.22 C ATOM 1678 C PRO B 477 12.813 -13.545 -9.467 1.00 43.34 C ATOM 1679 O PRO B 477 13.199 -12.496 -9.982 1.00 24.01 O ATOM 1680 CB PRO B 477 11.511 -14.314 -7.422 1.00 73.33 C ATOM 1681 CG PRO B 477 10.706 -13.159 -6.851 1.00 2.04 C ATOM 1682 CD PRO B 477 11.636 -11.964 -6.715 1.00 60.32 C ATOM 0 HA PRO B 477 13.650 -14.355 -7.732 1.00 62.22 H new ATOM 0 HB2 PRO B 477 10.963 -14.814 -8.220 1.00 73.33 H new ATOM 0 HB3 PRO B 477 11.715 -15.063 -6.657 1.00 73.33 H new ATOM 0 HG2 PRO B 477 9.868 -12.918 -7.505 1.00 2.04 H new ATOM 0 HG3 PRO B 477 10.287 -13.429 -5.882 1.00 2.04 H new ATOM 0 HD2 PRO B 477 11.248 -11.097 -7.249 1.00 60.32 H new ATOM 0 HD3 PRO B 477 11.753 -11.670 -5.672 1.00 60.32 H new ATOM 1687 N LYS B 478 12.386 -14.601 -10.144 1.00 53.31 N ATOM 1688 CA LYS B 478 12.343 -14.591 -11.597 1.00 53.10 C ATOM 1689 C LYS B 478 10.952 -15.023 -12.064 1.00 14.24 C ATOM 1690 O LYS B 478 10.700 -16.211 -12.257 1.00 24.25 O ATOM 1691 CB LYS B 478 13.477 -15.441 -12.173 1.00 42.32 C ATOM 1692 CG LYS B 478 13.697 -16.702 -11.335 1.00 63.13 C ATOM 1693 CD LYS B 478 14.714 -16.450 -10.220 1.00 55.21 C ATOM 1694 CE LYS B 478 15.030 -17.740 -9.464 1.00 65.21 C ATOM 1695 NZ LYS B 478 13.912 -18.101 -8.564 1.00 44.11 N ATOM 0 H LYS B 478 12.067 -15.469 -9.714 1.00 53.31 H new ATOM 0 HA LYS B 478 12.508 -13.583 -11.976 1.00 53.10 H new ATOM 0 HB2 LYS B 478 13.242 -15.719 -13.200 1.00 42.32 H new ATOM 0 HB3 LYS B 478 14.396 -14.855 -12.204 1.00 42.32 H new ATOM 0 HG2 LYS B 478 12.750 -17.025 -10.902 1.00 63.13 H new ATOM 0 HG3 LYS B 478 14.047 -17.512 -11.975 1.00 63.13 H new ATOM 0 HD2 LYS B 478 15.630 -16.040 -10.645 1.00 55.21 H new ATOM 0 HD3 LYS B 478 14.322 -15.705 -9.527 1.00 55.21 H new ATOM 0 HE2 LYS B 478 15.210 -18.549 -10.172 1.00 65.21 H new ATOM 0 HE3 LYS B 478 15.945 -17.614 -8.885 1.00 65.21 H new ATOM 0 HZ1 LYS B 478 14.143 -18.980 -8.058 1.00 44.11 H new ATOM 0 HZ2 LYS B 478 13.759 -17.336 -7.876 1.00 44.11 H new ATOM 0 HZ3 LYS B 478 13.047 -18.241 -9.124 1.00 44.11 H new ATOM 1704 N PRO B 479 10.063 -14.009 -12.237 1.00 12.33 N ATOM 1705 CA PRO B 479 8.704 -14.271 -12.678 1.00 0.24 C ATOM 1706 C PRO B 479 8.666 -14.605 -14.171 1.00 41.25 C ATOM 1707 O PRO B 479 9.467 -14.087 -14.947 1.00 53.51 O ATOM 1708 CB PRO B 479 7.927 -13.012 -12.331 1.00 10.53 C ATOM 1709 CG PRO B 479 8.967 -11.921 -12.137 1.00 0.01 C ATOM 1710 CD PRO B 479 10.327 -12.589 -12.019 1.00 2.41 C ATOM 0 HA PRO B 479 8.265 -15.141 -12.190 1.00 0.24 H new ATOM 0 HB2 PRO B 479 7.231 -12.751 -13.128 1.00 10.53 H new ATOM 0 HB3 PRO B 479 7.337 -13.154 -11.426 1.00 10.53 H new ATOM 0 HG2 PRO B 479 8.954 -11.227 -12.978 1.00 0.01 H new ATOM 0 HG3 PRO B 479 8.748 -11.340 -11.241 1.00 0.01 H new ATOM 0 HD2 PRO B 479 11.026 -12.198 -12.759 1.00 2.41 H new ATOM 0 HD3 PRO B 479 10.770 -12.415 -11.039 1.00 2.41 H new ATOM 1715 N PRO B 480 7.702 -15.492 -14.537 1.00 12.32 N ATOM 1716 CA PRO B 480 7.550 -15.900 -15.924 1.00 5.30 C ATOM 1717 C PRO B 480 6.896 -14.793 -16.753 1.00 64.42 C ATOM 1718 O PRO B 480 5.758 -14.407 -16.491 1.00 1.41 O ATOM 1719 CB PRO B 480 6.719 -17.172 -15.869 1.00 34.41 C ATOM 1720 CG PRO B 480 6.047 -17.173 -14.506 1.00 64.32 C ATOM 1721 CD PRO B 480 6.736 -16.126 -13.646 1.00 50.22 C ATOM 0 HA PRO B 480 8.505 -16.084 -16.416 1.00 5.30 H new ATOM 0 HB2 PRO B 480 5.979 -17.190 -16.669 1.00 34.41 H new ATOM 0 HB3 PRO B 480 7.347 -18.054 -15.996 1.00 34.41 H new ATOM 0 HG2 PRO B 480 4.985 -16.948 -14.604 1.00 64.32 H new ATOM 0 HG3 PRO B 480 6.123 -18.157 -14.044 1.00 64.32 H new ATOM 0 HD2 PRO B 480 6.021 -15.401 -13.256 1.00 50.22 H new ATOM 0 HD3 PRO B 480 7.229 -16.581 -12.787 1.00 50.22 H new