USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=20 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 :FLIP no HE2:sc= -2.45! F(o=-3.3,f=-2.2!) USER MOD Set 1.2: A 190 CYS SG : rot -46:sc= 0.289 USER MOD Single : A 159 TYR OH : rot 156:sc= -0.518 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 LYS NZ :NH3+ 150:sc= -0.15 (180deg=-0.913) USER MOD Single : A 170 LYS NZ :NH3+ 145:sc= -8.36! (180deg=-10.4!) USER MOD Single : A 175 THR OG1 : rot 180:sc= -0.0817 USER MOD Single : A 176 THR OG1 : rot -39:sc= 0.0833 USER MOD Single : A 177 TYR OH : rot 180:sc= 0 USER MOD Single : A 181 ASN : amide:sc= -0.489 X(o=-0.49,f=0) USER MOD Single : A 185 CYS SG : rot -51:sc= -1.4! USER MOD Single : A 188 HIS : no HE2:sc= -12.6! C(o=-13!,f=-16!) USER MOD Single : A 189 ASN : amide:sc= -0.486 X(o=-0.49,f=-0.65) USER MOD Single : A 196 LYS NZ :NH3+ -128:sc= -0.646 (180deg=-2.2!) USER MOD Single : A 213 SER OG : rot 180:sc= 0 USER MOD Single : A 232 LYS NZ :NH3+ -160:sc= -0.35 (180deg=-0.947) USER MOD Single : A 233 SER OG : rot 101:sc= 1.06 USER MOD Single : A 235 ASN : amide:sc= -0.0872 K(o=-0.087,f=-1.8!) USER MOD Single : A 238 THR OG1 : rot 110:sc= 1.3 USER MOD Single : A 240 GLN : amide:sc= -3.29 K(o=-3.3,f=-13!) USER MOD Single : A 243 LYS NZ :NH3+ -115:sc= -1.47 (180deg=-3.84!) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD Single : B 473 SER OG : rot 180:sc= 0 USER MOD Single : B 478 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.087) USER MOD ----------------------------------------------------------------- ATOM 36 N TYR A 159 -4.322 -2.313 -3.722 1.00 43.14 N ATOM 37 CA TYR A 159 -4.418 -3.758 -3.842 1.00 52.22 C ATOM 38 C TYR A 159 -3.442 -4.286 -4.896 1.00 50.11 C ATOM 39 O TYR A 159 -3.179 -3.617 -5.895 1.00 62.12 O ATOM 40 CB TYR A 159 -5.848 -4.049 -4.299 1.00 22.13 C ATOM 41 CG TYR A 159 -6.390 -5.399 -3.825 1.00 33.41 C ATOM 42 CD1 TYR A 159 -6.199 -5.799 -2.518 1.00 72.52 C ATOM 43 CD2 TYR A 159 -7.070 -6.217 -4.705 1.00 71.10 C ATOM 44 CE1 TYR A 159 -6.709 -7.070 -2.072 1.00 71.43 C ATOM 45 CE2 TYR A 159 -7.580 -7.488 -4.259 1.00 71.02 C ATOM 46 CZ TYR A 159 -7.374 -7.851 -2.965 1.00 23.44 C ATOM 47 OH TYR A 159 -7.856 -9.052 -2.544 1.00 44.34 O ATOM 0 HA TYR A 159 -4.176 -4.239 -2.894 1.00 52.22 H new ATOM 0 HB2 TYR A 159 -6.503 -3.258 -3.934 1.00 22.13 H new ATOM 0 HB3 TYR A 159 -5.884 -4.017 -5.388 1.00 22.13 H new ATOM 0 HD1 TYR A 159 -5.667 -5.159 -1.830 1.00 72.52 H new ATOM 0 HD2 TYR A 159 -7.220 -5.904 -5.728 1.00 71.10 H new ATOM 0 HE1 TYR A 159 -6.567 -7.395 -1.052 1.00 71.43 H new ATOM 0 HE2 TYR A 159 -8.114 -8.138 -4.937 1.00 71.02 H new ATOM 0 HH TYR A 159 -8.604 -9.323 -3.117 1.00 44.34 H new ATOM 56 N ALA A 160 -2.931 -5.480 -4.638 1.00 63.13 N ATOM 57 CA ALA A 160 -1.990 -6.105 -5.552 1.00 24.51 C ATOM 58 C ALA A 160 -2.587 -7.412 -6.077 1.00 24.51 C ATOM 59 O ALA A 160 -3.253 -8.136 -5.338 1.00 41.43 O ATOM 60 CB ALA A 160 -0.652 -6.320 -4.840 1.00 14.24 C ATOM 0 H ALA A 160 -3.151 -6.032 -3.809 1.00 63.13 H new ATOM 0 HA ALA A 160 -1.803 -5.460 -6.410 1.00 24.51 H new ATOM 0 HB1 ALA A 160 0.054 -6.789 -5.526 1.00 14.24 H new ATOM 0 HB2 ALA A 160 -0.256 -5.359 -4.512 1.00 14.24 H new ATOM 0 HB3 ALA A 160 -0.800 -6.966 -3.974 1.00 14.24 H new ATOM 66 N ILE A 161 -2.326 -7.676 -7.349 1.00 30.15 N ATOM 67 CA ILE A 161 -2.830 -8.883 -7.981 1.00 33.41 C ATOM 68 C ILE A 161 -1.652 -9.728 -8.468 1.00 34.20 C ATOM 69 O ILE A 161 -0.742 -9.215 -9.118 1.00 50.43 O ATOM 70 CB ILE A 161 -3.832 -8.533 -9.083 1.00 22.13 C ATOM 71 CG1 ILE A 161 -4.813 -9.684 -9.319 1.00 61.35 C ATOM 72 CG2 ILE A 161 -3.112 -8.121 -10.369 1.00 22.31 C ATOM 73 CD1 ILE A 161 -4.205 -10.741 -10.244 1.00 45.41 C ATOM 0 H ILE A 161 -1.772 -7.075 -7.959 1.00 30.15 H new ATOM 0 HA ILE A 161 -3.381 -9.488 -7.261 1.00 33.41 H new ATOM 0 HB ILE A 161 -4.417 -7.675 -8.752 1.00 22.13 H new ATOM 0 HG12 ILE A 161 -5.080 -10.140 -8.366 1.00 61.35 H new ATOM 0 HG13 ILE A 161 -5.733 -9.298 -9.757 1.00 61.35 H new ATOM 0 HG21 ILE A 161 -3.847 -7.878 -11.136 1.00 22.31 H new ATOM 0 HG22 ILE A 161 -2.489 -7.248 -10.174 1.00 22.31 H new ATOM 0 HG23 ILE A 161 -2.486 -8.943 -10.715 1.00 22.31 H new ATOM 0 HD11 ILE A 161 -4.922 -11.548 -10.396 1.00 45.41 H new ATOM 0 HD12 ILE A 161 -3.961 -10.287 -11.205 1.00 45.41 H new ATOM 0 HD13 ILE A 161 -3.298 -11.142 -9.792 1.00 45.41 H new ATOM 84 N VAL A 162 -1.706 -11.009 -8.135 1.00 34.31 N ATOM 85 CA VAL A 162 -0.654 -11.930 -8.531 1.00 25.43 C ATOM 86 C VAL A 162 -1.038 -12.600 -9.852 1.00 12.02 C ATOM 87 O VAL A 162 -2.073 -13.258 -9.941 1.00 41.10 O ATOM 88 CB VAL A 162 -0.387 -12.934 -7.407 1.00 33.14 C ATOM 89 CG1 VAL A 162 0.035 -14.291 -7.973 1.00 74.40 C ATOM 90 CG2 VAL A 162 0.660 -12.398 -6.429 1.00 32.44 C ATOM 0 H VAL A 162 -2.462 -11.431 -7.595 1.00 34.31 H new ATOM 0 HA VAL A 162 0.280 -11.393 -8.698 1.00 25.43 H new ATOM 0 HB VAL A 162 -1.317 -13.075 -6.857 1.00 33.14 H new ATOM 0 HG11 VAL A 162 0.219 -14.986 -7.154 1.00 74.40 H new ATOM 0 HG12 VAL A 162 -0.758 -14.682 -8.610 1.00 74.40 H new ATOM 0 HG13 VAL A 162 0.946 -14.173 -8.560 1.00 74.40 H new ATOM 0 HG21 VAL A 162 0.831 -13.131 -5.641 1.00 32.44 H new ATOM 0 HG22 VAL A 162 1.593 -12.213 -6.961 1.00 32.44 H new ATOM 0 HG23 VAL A 162 0.303 -11.467 -5.988 1.00 32.44 H new ATOM 100 N LEU A 163 -0.182 -12.408 -10.846 1.00 30.34 N ATOM 101 CA LEU A 163 -0.419 -12.985 -12.158 1.00 31.14 C ATOM 102 C LEU A 163 0.403 -14.267 -12.304 1.00 65.15 C ATOM 103 O LEU A 163 0.178 -15.054 -13.222 1.00 3.44 O ATOM 104 CB LEU A 163 -0.148 -11.953 -13.255 1.00 2.53 C ATOM 105 CG LEU A 163 -0.269 -10.486 -12.838 1.00 12.05 C ATOM 106 CD1 LEU A 163 0.377 -9.566 -13.876 1.00 60.03 C ATOM 107 CD2 LEU A 163 -1.728 -10.111 -12.570 1.00 1.13 C ATOM 0 H LEU A 163 0.676 -11.861 -10.769 1.00 30.34 H new ATOM 0 HA LEU A 163 -1.467 -13.264 -12.267 1.00 31.14 H new ATOM 0 HB2 LEU A 163 0.857 -12.119 -13.642 1.00 2.53 H new ATOM 0 HB3 LEU A 163 -0.840 -12.135 -14.077 1.00 2.53 H new ATOM 0 HG LEU A 163 0.276 -10.350 -11.904 1.00 12.05 H new ATOM 0 HD11 LEU A 163 0.277 -8.529 -13.555 1.00 60.03 H new ATOM 0 HD12 LEU A 163 1.434 -9.815 -13.975 1.00 60.03 H new ATOM 0 HD13 LEU A 163 -0.119 -9.698 -14.838 1.00 60.03 H new ATOM 0 HD21 LEU A 163 -1.786 -9.063 -12.275 1.00 1.13 H new ATOM 0 HD22 LEU A 163 -2.316 -10.267 -13.475 1.00 1.13 H new ATOM 0 HD23 LEU A 163 -2.123 -10.736 -11.769 1.00 1.13 H new ATOM 118 N TYR A 164 1.341 -14.438 -11.383 1.00 10.02 N ATOM 119 CA TYR A 164 2.199 -15.610 -11.396 1.00 72.31 C ATOM 120 C TYR A 164 2.524 -16.069 -9.973 1.00 31.22 C ATOM 121 O TYR A 164 2.456 -15.279 -9.032 1.00 32.41 O ATOM 122 CB TYR A 164 3.493 -15.177 -12.088 1.00 61.41 C ATOM 123 CG TYR A 164 3.296 -14.111 -13.166 1.00 70.32 C ATOM 124 CD1 TYR A 164 2.893 -14.477 -14.435 1.00 64.44 C ATOM 125 CD2 TYR A 164 3.521 -12.781 -12.872 1.00 32.30 C ATOM 126 CE1 TYR A 164 2.708 -13.473 -15.450 1.00 22.35 C ATOM 127 CE2 TYR A 164 3.335 -11.777 -13.887 1.00 74.22 C ATOM 128 CZ TYR A 164 2.938 -12.173 -15.126 1.00 62.23 C ATOM 129 OH TYR A 164 2.762 -11.225 -16.085 1.00 42.41 O ATOM 0 H TYR A 164 1.525 -13.784 -10.623 1.00 10.02 H new ATOM 0 HA TYR A 164 1.709 -16.439 -11.907 1.00 72.31 H new ATOM 0 HB2 TYR A 164 4.184 -14.796 -11.337 1.00 61.41 H new ATOM 0 HB3 TYR A 164 3.962 -16.052 -12.538 1.00 61.41 H new ATOM 0 HD1 TYR A 164 2.716 -15.517 -14.666 1.00 64.44 H new ATOM 0 HD2 TYR A 164 3.837 -12.494 -11.880 1.00 32.30 H new ATOM 0 HE1 TYR A 164 2.394 -13.746 -16.446 1.00 22.35 H new ATOM 0 HE2 TYR A 164 3.507 -10.733 -13.669 1.00 74.22 H new ATOM 0 HH TYR A 164 2.961 -10.341 -15.712 1.00 42.41 H new ATOM 138 N ASP A 165 2.869 -17.343 -9.860 1.00 74.12 N ATOM 139 CA ASP A 165 3.204 -17.916 -8.568 1.00 51.21 C ATOM 140 C ASP A 165 4.713 -17.804 -8.342 1.00 62.10 C ATOM 141 O ASP A 165 5.486 -17.752 -9.298 1.00 5.05 O ATOM 142 CB ASP A 165 2.826 -19.397 -8.508 1.00 4.02 C ATOM 143 CG ASP A 165 3.519 -20.285 -9.543 1.00 44.31 C ATOM 144 OD1 ASP A 165 3.227 -20.212 -10.745 1.00 23.31 O ATOM 145 OD2 ASP A 165 4.407 -21.090 -9.063 1.00 2.30 O ATOM 0 H ASP A 165 2.924 -17.995 -10.643 1.00 74.12 H new ATOM 0 HA ASP A 165 2.650 -17.371 -7.803 1.00 51.21 H new ATOM 0 HB2 ASP A 165 3.059 -19.776 -7.513 1.00 4.02 H new ATOM 0 HB3 ASP A 165 1.748 -19.487 -8.639 1.00 4.02 H new ATOM 150 N PHE A 166 5.088 -17.772 -7.071 1.00 52.13 N ATOM 151 CA PHE A 166 6.491 -17.667 -6.707 1.00 23.24 C ATOM 152 C PHE A 166 6.805 -18.529 -5.482 1.00 54.22 C ATOM 153 O PHE A 166 5.979 -18.654 -4.579 1.00 71.00 O ATOM 154 CB PHE A 166 6.756 -16.200 -6.366 1.00 52.21 C ATOM 155 CG PHE A 166 7.992 -15.978 -5.492 1.00 63.04 C ATOM 156 CD1 PHE A 166 9.236 -16.082 -6.033 1.00 5.43 C ATOM 157 CD2 PHE A 166 7.847 -15.678 -4.173 1.00 51.32 C ATOM 158 CE1 PHE A 166 10.383 -15.875 -5.221 1.00 72.42 C ATOM 159 CE2 PHE A 166 8.995 -15.472 -3.362 1.00 1.43 C ATOM 160 CZ PHE A 166 10.238 -15.575 -3.903 1.00 23.10 C ATOM 0 H PHE A 166 4.445 -17.817 -6.281 1.00 52.13 H new ATOM 0 HA PHE A 166 7.116 -18.012 -7.530 1.00 23.24 H new ATOM 0 HB2 PHE A 166 6.873 -15.638 -7.292 1.00 52.21 H new ATOM 0 HB3 PHE A 166 5.884 -15.793 -5.854 1.00 52.21 H new ATOM 0 HD1 PHE A 166 9.351 -16.322 -7.080 1.00 5.43 H new ATOM 0 HD2 PHE A 166 6.860 -15.597 -3.743 1.00 51.32 H new ATOM 0 HE1 PHE A 166 11.370 -15.956 -5.651 1.00 72.42 H new ATOM 0 HE2 PHE A 166 8.880 -15.233 -2.315 1.00 1.43 H new ATOM 0 HZ PHE A 166 11.110 -15.418 -3.286 1.00 23.10 H new ATOM 169 N LYS A 167 8.000 -19.100 -5.491 1.00 51.01 N ATOM 170 CA LYS A 167 8.434 -19.946 -4.392 1.00 1.34 C ATOM 171 C LYS A 167 8.979 -19.068 -3.263 1.00 20.24 C ATOM 172 O LYS A 167 9.797 -18.181 -3.501 1.00 34.34 O ATOM 173 CB LYS A 167 9.426 -21.000 -4.885 1.00 74.31 C ATOM 174 CG LYS A 167 8.909 -21.691 -6.150 1.00 51.53 C ATOM 175 CD LYS A 167 9.523 -23.083 -6.305 1.00 44.44 C ATOM 176 CE LYS A 167 8.703 -24.131 -5.550 1.00 1.31 C ATOM 177 NZ LYS A 167 7.336 -24.221 -6.111 1.00 70.14 N ATOM 0 H LYS A 167 8.682 -18.994 -6.242 1.00 51.01 H new ATOM 0 HA LYS A 167 7.590 -20.503 -3.985 1.00 1.34 H new ATOM 0 HB2 LYS A 167 10.388 -20.531 -5.090 1.00 74.31 H new ATOM 0 HB3 LYS A 167 9.593 -21.741 -4.104 1.00 74.31 H new ATOM 0 HG2 LYS A 167 7.823 -21.772 -6.106 1.00 51.53 H new ATOM 0 HG3 LYS A 167 9.149 -21.085 -7.024 1.00 51.53 H new ATOM 0 HD2 LYS A 167 9.573 -23.347 -7.361 1.00 44.44 H new ATOM 0 HD3 LYS A 167 10.546 -23.077 -5.929 1.00 44.44 H new ATOM 0 HE2 LYS A 167 9.194 -25.102 -5.615 1.00 1.31 H new ATOM 0 HE3 LYS A 167 8.652 -23.870 -4.493 1.00 1.31 H new ATOM 0 HZ1 LYS A 167 6.974 -25.188 -5.989 1.00 70.14 H new ATOM 0 HZ2 LYS A 167 6.712 -23.553 -5.615 1.00 70.14 H new ATOM 0 HZ3 LYS A 167 7.360 -23.985 -7.124 1.00 70.14 H new ATOM 186 N ALA A 168 8.504 -19.347 -2.058 1.00 70.12 N ATOM 187 CA ALA A 168 8.933 -18.594 -0.892 1.00 63.34 C ATOM 188 C ALA A 168 10.060 -19.353 -0.187 1.00 62.13 C ATOM 189 O ALA A 168 10.037 -20.580 -0.116 1.00 60.41 O ATOM 190 CB ALA A 168 7.735 -18.346 0.025 1.00 4.12 C ATOM 0 H ALA A 168 7.826 -20.084 -1.864 1.00 70.12 H new ATOM 0 HA ALA A 168 9.325 -17.620 -1.187 1.00 63.34 H new ATOM 0 HB1 ALA A 168 8.057 -17.781 0.900 1.00 4.12 H new ATOM 0 HB2 ALA A 168 6.976 -17.779 -0.514 1.00 4.12 H new ATOM 0 HB3 ALA A 168 7.317 -19.301 0.344 1.00 4.12 H new ATOM 196 N GLU A 169 11.019 -18.591 0.316 1.00 40.41 N ATOM 197 CA GLU A 169 12.152 -19.175 1.013 1.00 71.34 C ATOM 198 C GLU A 169 12.798 -18.142 1.937 1.00 53.53 C ATOM 199 O GLU A 169 13.981 -18.245 2.260 1.00 52.15 O ATOM 200 CB GLU A 169 13.173 -19.740 0.023 1.00 53.34 C ATOM 201 CG GLU A 169 13.677 -18.650 -0.926 1.00 42.33 C ATOM 202 CD GLU A 169 14.931 -19.109 -1.671 1.00 71.33 C ATOM 203 OE1 GLU A 169 16.053 -18.779 -1.260 1.00 42.23 O ATOM 204 OE2 GLU A 169 14.710 -19.836 -2.714 1.00 1.10 O ATOM 0 H GLU A 169 11.035 -17.573 0.255 1.00 40.41 H new ATOM 0 HA GLU A 169 11.790 -20.002 1.623 1.00 71.34 H new ATOM 0 HB2 GLU A 169 14.013 -20.170 0.568 1.00 53.34 H new ATOM 0 HB3 GLU A 169 12.719 -20.547 -0.552 1.00 53.34 H new ATOM 0 HG2 GLU A 169 12.896 -18.397 -1.643 1.00 42.33 H new ATOM 0 HG3 GLU A 169 13.896 -17.744 -0.361 1.00 42.33 H new ATOM 210 N LYS A 170 11.994 -17.168 2.338 1.00 61.22 N ATOM 211 CA LYS A 170 12.473 -16.116 3.219 1.00 10.12 C ATOM 212 C LYS A 170 11.618 -16.091 4.487 1.00 52.11 C ATOM 213 O LYS A 170 10.745 -16.938 4.669 1.00 62.20 O ATOM 214 CB LYS A 170 12.516 -14.777 2.480 1.00 54.33 C ATOM 215 CG LYS A 170 11.674 -14.827 1.204 1.00 14.22 C ATOM 216 CD LYS A 170 10.180 -14.803 1.533 1.00 32.11 C ATOM 217 CE LYS A 170 9.338 -15.020 0.274 1.00 34.14 C ATOM 218 NZ LYS A 170 7.905 -14.782 0.561 1.00 15.01 N ATOM 0 H LYS A 170 11.014 -17.085 2.069 1.00 61.22 H new ATOM 0 HA LYS A 170 13.499 -16.316 3.529 1.00 10.12 H new ATOM 0 HB2 LYS A 170 12.147 -13.986 3.132 1.00 54.33 H new ATOM 0 HB3 LYS A 170 13.547 -14.529 2.230 1.00 54.33 H new ATOM 0 HG2 LYS A 170 11.923 -13.979 0.566 1.00 14.22 H new ATOM 0 HG3 LYS A 170 11.912 -15.730 0.642 1.00 14.22 H new ATOM 0 HD2 LYS A 170 9.953 -15.578 2.265 1.00 32.11 H new ATOM 0 HD3 LYS A 170 9.920 -13.848 1.989 1.00 32.11 H new ATOM 0 HE2 LYS A 170 9.673 -14.347 -0.515 1.00 34.14 H new ATOM 0 HE3 LYS A 170 9.477 -16.037 -0.093 1.00 34.14 H new ATOM 0 HZ1 LYS A 170 7.451 -14.354 -0.271 1.00 15.01 H new ATOM 0 HZ2 LYS A 170 7.441 -15.686 0.782 1.00 15.01 H new ATOM 0 HZ3 LYS A 170 7.816 -14.139 1.373 1.00 15.01 H new ATOM 227 N ALA A 171 11.898 -15.109 5.331 1.00 50.42 N ATOM 228 CA ALA A 171 11.165 -14.962 6.578 1.00 41.00 C ATOM 229 C ALA A 171 9.676 -14.789 6.272 1.00 61.13 C ATOM 230 O ALA A 171 8.827 -15.339 6.971 1.00 64.11 O ATOM 231 CB ALA A 171 11.738 -13.786 7.371 1.00 15.52 C ATOM 0 H ALA A 171 12.622 -14.407 5.176 1.00 50.42 H new ATOM 0 HA ALA A 171 11.273 -15.854 7.194 1.00 41.00 H new ATOM 0 HB1 ALA A 171 11.189 -13.675 8.306 1.00 15.52 H new ATOM 0 HB2 ALA A 171 12.790 -13.972 7.588 1.00 15.52 H new ATOM 0 HB3 ALA A 171 11.644 -12.872 6.785 1.00 15.52 H new ATOM 237 N ASP A 172 9.405 -14.022 5.226 1.00 0.20 N ATOM 238 CA ASP A 172 8.033 -13.770 4.818 1.00 10.20 C ATOM 239 C ASP A 172 7.566 -14.894 3.890 1.00 43.32 C ATOM 240 O ASP A 172 6.509 -14.793 3.271 1.00 12.21 O ATOM 241 CB ASP A 172 7.919 -12.449 4.056 1.00 75.31 C ATOM 242 CG ASP A 172 7.989 -11.191 4.925 1.00 61.53 C ATOM 243 OD1 ASP A 172 8.904 -10.368 4.783 1.00 54.34 O ATOM 244 OD2 ASP A 172 7.039 -11.073 5.789 1.00 31.33 O ATOM 0 H ASP A 172 10.112 -13.567 4.649 1.00 0.20 H new ATOM 0 HA ASP A 172 7.418 -13.722 5.716 1.00 10.20 H new ATOM 0 HB2 ASP A 172 8.717 -12.405 3.315 1.00 75.31 H new ATOM 0 HB3 ASP A 172 6.976 -12.443 3.510 1.00 75.31 H new ATOM 249 N GLU A 173 8.378 -15.938 3.825 1.00 32.43 N ATOM 250 CA GLU A 173 8.061 -17.080 2.984 1.00 73.31 C ATOM 251 C GLU A 173 6.555 -17.349 2.998 1.00 52.50 C ATOM 252 O GLU A 173 6.047 -18.007 3.905 1.00 41.21 O ATOM 253 CB GLU A 173 8.844 -18.319 3.423 1.00 22.44 C ATOM 254 CG GLU A 173 8.737 -18.527 4.935 1.00 52.12 C ATOM 255 CD GLU A 173 9.915 -19.352 5.460 1.00 15.45 C ATOM 256 OE1 GLU A 173 10.321 -19.184 6.619 1.00 60.53 O ATOM 257 OE2 GLU A 173 10.410 -20.192 4.616 1.00 24.33 O ATOM 0 H GLU A 173 9.255 -16.018 4.340 1.00 32.43 H new ATOM 0 HA GLU A 173 8.358 -16.847 1.962 1.00 73.31 H new ATOM 0 HB2 GLU A 173 8.462 -19.198 2.903 1.00 22.44 H new ATOM 0 HB3 GLU A 173 9.891 -18.211 3.140 1.00 22.44 H new ATOM 0 HG2 GLU A 173 8.713 -17.560 5.438 1.00 52.12 H new ATOM 0 HG3 GLU A 173 7.801 -19.033 5.171 1.00 52.12 H new ATOM 263 N LEU A 174 5.883 -16.826 1.983 1.00 42.15 N ATOM 264 CA LEU A 174 4.445 -17.001 1.867 1.00 63.22 C ATOM 265 C LEU A 174 4.103 -17.452 0.445 1.00 4.44 C ATOM 266 O LEU A 174 3.961 -16.626 -0.454 1.00 54.41 O ATOM 267 CB LEU A 174 3.714 -15.730 2.303 1.00 31.44 C ATOM 268 CG LEU A 174 2.987 -15.802 3.647 1.00 3.35 C ATOM 269 CD1 LEU A 174 2.248 -17.131 3.800 1.00 24.24 C ATOM 270 CD2 LEU A 174 3.952 -15.545 4.807 1.00 13.12 C ATOM 0 H LEU A 174 6.308 -16.281 1.233 1.00 42.15 H new ATOM 0 HA LEU A 174 4.101 -17.785 2.541 1.00 63.22 H new ATOM 0 HB2 LEU A 174 4.437 -14.916 2.347 1.00 31.44 H new ATOM 0 HB3 LEU A 174 2.988 -15.470 1.533 1.00 31.44 H new ATOM 0 HG LEU A 174 2.236 -15.012 3.672 1.00 3.35 H new ATOM 0 HD11 LEU A 174 1.740 -17.156 4.764 1.00 24.24 H new ATOM 0 HD12 LEU A 174 1.514 -17.234 3.000 1.00 24.24 H new ATOM 0 HD13 LEU A 174 2.962 -17.953 3.745 1.00 24.24 H new ATOM 0 HD21 LEU A 174 3.410 -15.602 5.751 1.00 13.12 H new ATOM 0 HD22 LEU A 174 4.742 -16.296 4.796 1.00 13.12 H new ATOM 0 HD23 LEU A 174 4.393 -14.554 4.701 1.00 13.12 H new ATOM 281 N THR A 175 3.980 -18.761 0.288 1.00 63.31 N ATOM 282 CA THR A 175 3.657 -19.332 -1.009 1.00 74.34 C ATOM 283 C THR A 175 2.320 -18.786 -1.513 1.00 74.01 C ATOM 284 O THR A 175 1.464 -18.399 -0.719 1.00 54.03 O ATOM 285 CB THR A 175 3.679 -20.856 -0.874 1.00 51.04 C ATOM 286 OG1 THR A 175 3.058 -21.320 -2.070 1.00 2.33 O ATOM 287 CG2 THR A 175 2.762 -21.359 0.242 1.00 12.11 C ATOM 0 H THR A 175 4.098 -19.443 1.037 1.00 63.31 H new ATOM 0 HA THR A 175 4.393 -19.048 -1.761 1.00 74.34 H new ATOM 0 HB THR A 175 4.699 -21.188 -0.682 1.00 51.04 H new ATOM 0 HG1 THR A 175 3.032 -22.300 -2.066 1.00 2.33 H new ATOM 0 HG21 THR A 175 2.815 -22.446 0.294 1.00 12.11 H new ATOM 0 HG22 THR A 175 3.080 -20.934 1.194 1.00 12.11 H new ATOM 0 HG23 THR A 175 1.736 -21.056 0.034 1.00 12.11 H new ATOM 295 N THR A 176 2.182 -18.773 -2.831 1.00 53.14 N ATOM 296 CA THR A 176 0.964 -18.280 -3.451 1.00 54.23 C ATOM 297 C THR A 176 0.772 -18.916 -4.829 1.00 50.05 C ATOM 298 O THR A 176 1.635 -19.655 -5.301 1.00 32.54 O ATOM 299 CB THR A 176 1.037 -16.753 -3.492 1.00 51.33 C ATOM 300 OG1 THR A 176 1.382 -16.386 -2.158 1.00 52.12 O ATOM 301 CG2 THR A 176 -0.330 -16.106 -3.715 1.00 30.04 C ATOM 0 H THR A 176 2.894 -19.096 -3.486 1.00 53.14 H new ATOM 0 HA THR A 176 0.085 -18.561 -2.872 1.00 54.23 H new ATOM 0 HB THR A 176 1.717 -16.444 -4.286 1.00 51.33 H new ATOM 0 HG1 THR A 176 0.907 -16.965 -1.526 1.00 52.12 H new ATOM 0 HG21 THR A 176 -0.220 -15.022 -3.736 1.00 30.04 H new ATOM 0 HG22 THR A 176 -0.743 -16.447 -4.664 1.00 30.04 H new ATOM 0 HG23 THR A 176 -1.002 -16.387 -2.904 1.00 30.04 H new ATOM 309 N TYR A 177 -0.363 -18.605 -5.437 1.00 22.43 N ATOM 310 CA TYR A 177 -0.679 -19.137 -6.752 1.00 2.42 C ATOM 311 C TYR A 177 -0.932 -18.009 -7.754 1.00 44.22 C ATOM 312 O TYR A 177 -1.258 -16.889 -7.363 1.00 10.25 O ATOM 313 CB TYR A 177 -1.964 -19.949 -6.580 1.00 31.14 C ATOM 314 CG TYR A 177 -1.730 -21.415 -6.214 1.00 43.21 C ATOM 315 CD1 TYR A 177 -0.973 -22.221 -7.039 1.00 35.21 C ATOM 316 CD2 TYR A 177 -2.276 -21.932 -5.056 1.00 64.24 C ATOM 317 CE1 TYR A 177 -0.753 -23.601 -6.694 1.00 61.43 C ATOM 318 CE2 TYR A 177 -2.055 -23.313 -4.711 1.00 30.42 C ATOM 319 CZ TYR A 177 -1.305 -24.079 -5.547 1.00 22.33 C ATOM 320 OH TYR A 177 -1.097 -25.383 -5.220 1.00 21.31 O ATOM 0 H TYR A 177 -1.076 -17.991 -5.043 1.00 22.43 H new ATOM 0 HA TYR A 177 0.147 -19.738 -7.132 1.00 2.42 H new ATOM 0 HB2 TYR A 177 -2.574 -19.485 -5.805 1.00 31.14 H new ATOM 0 HB3 TYR A 177 -2.537 -19.904 -7.506 1.00 31.14 H new ATOM 0 HD1 TYR A 177 -0.545 -21.816 -7.944 1.00 35.21 H new ATOM 0 HD2 TYR A 177 -2.868 -21.302 -4.409 1.00 64.24 H new ATOM 0 HE1 TYR A 177 -0.163 -24.242 -7.332 1.00 61.43 H new ATOM 0 HE2 TYR A 177 -2.476 -23.731 -3.808 1.00 30.42 H new ATOM 0 HH TYR A 177 -1.550 -25.584 -4.374 1.00 21.31 H new ATOM 329 N VAL A 178 -0.772 -18.343 -9.026 1.00 42.14 N ATOM 330 CA VAL A 178 -0.978 -17.371 -10.086 1.00 31.33 C ATOM 331 C VAL A 178 -2.415 -16.849 -10.020 1.00 32.33 C ATOM 332 O VAL A 178 -3.292 -17.503 -9.458 1.00 70.40 O ATOM 333 CB VAL A 178 -0.629 -17.993 -11.440 1.00 12.35 C ATOM 334 CG1 VAL A 178 0.666 -18.802 -11.354 1.00 40.44 C ATOM 335 CG2 VAL A 178 -1.781 -18.856 -11.960 1.00 55.33 C ATOM 0 H VAL A 178 -0.502 -19.273 -9.346 1.00 42.14 H new ATOM 0 HA VAL A 178 -0.315 -16.516 -9.956 1.00 31.33 H new ATOM 0 HB VAL A 178 -0.471 -17.182 -12.151 1.00 12.35 H new ATOM 0 HG11 VAL A 178 0.891 -19.233 -12.329 1.00 40.44 H new ATOM 0 HG12 VAL A 178 1.483 -18.149 -11.049 1.00 40.44 H new ATOM 0 HG13 VAL A 178 0.548 -19.601 -10.623 1.00 40.44 H new ATOM 0 HG21 VAL A 178 -1.507 -19.286 -12.923 1.00 55.33 H new ATOM 0 HG22 VAL A 178 -1.985 -19.657 -11.250 1.00 55.33 H new ATOM 0 HG23 VAL A 178 -2.673 -18.240 -12.078 1.00 55.33 H new ATOM 345 N GLY A 179 -2.612 -15.676 -10.604 1.00 43.52 N ATOM 346 CA GLY A 179 -3.926 -15.058 -10.618 1.00 3.12 C ATOM 347 C GLY A 179 -4.555 -15.073 -9.223 1.00 4.50 C ATOM 348 O GLY A 179 -5.544 -15.766 -8.991 1.00 24.32 O ATOM 0 H GLY A 179 -1.883 -15.137 -11.071 1.00 43.52 H new ATOM 0 HA2 GLY A 179 -3.845 -14.031 -10.973 1.00 3.12 H new ATOM 0 HA3 GLY A 179 -4.573 -15.587 -11.318 1.00 3.12 H new ATOM 352 N GLU A 180 -3.955 -14.299 -8.330 1.00 14.22 N ATOM 353 CA GLU A 180 -4.443 -14.213 -6.964 1.00 31.20 C ATOM 354 C GLU A 180 -4.621 -12.750 -6.555 1.00 65.05 C ATOM 355 O GLU A 180 -4.164 -11.847 -7.253 1.00 12.52 O ATOM 356 CB GLU A 180 -3.505 -14.943 -6.001 1.00 41.21 C ATOM 357 CG GLU A 180 -4.297 -15.705 -4.937 1.00 24.13 C ATOM 358 CD GLU A 180 -5.295 -16.669 -5.582 1.00 3.32 C ATOM 359 OE1 GLU A 180 -4.921 -17.441 -6.477 1.00 23.40 O ATOM 360 OE2 GLU A 180 -6.498 -16.598 -5.120 1.00 73.11 O ATOM 0 H GLU A 180 -3.135 -13.725 -8.526 1.00 14.22 H new ATOM 0 HA GLU A 180 -5.415 -14.704 -6.914 1.00 31.20 H new ATOM 0 HB2 GLU A 180 -2.875 -15.637 -6.557 1.00 41.21 H new ATOM 0 HB3 GLU A 180 -2.841 -14.225 -5.520 1.00 41.21 H new ATOM 0 HG2 GLU A 180 -3.612 -16.260 -4.297 1.00 24.13 H new ATOM 0 HG3 GLU A 180 -4.828 -14.999 -4.299 1.00 24.13 H new ATOM 366 N ASN A 181 -5.285 -12.562 -5.423 1.00 72.53 N ATOM 367 CA ASN A 181 -5.529 -11.224 -4.913 1.00 43.24 C ATOM 368 C ASN A 181 -4.861 -11.077 -3.543 1.00 54.44 C ATOM 369 O ASN A 181 -5.095 -11.882 -2.645 1.00 3.14 O ATOM 370 CB ASN A 181 -7.026 -10.965 -4.738 1.00 22.15 C ATOM 371 CG ASN A 181 -7.811 -11.443 -5.962 1.00 5.41 C ATOM 372 OD1 ASN A 181 -8.767 -12.195 -5.864 1.00 70.03 O ATOM 373 ND2 ASN A 181 -7.356 -10.964 -7.116 1.00 32.24 N ATOM 0 H ASN A 181 -5.661 -13.314 -4.846 1.00 72.53 H new ATOM 0 HA ASN A 181 -5.121 -10.510 -5.629 1.00 43.24 H new ATOM 0 HB2 ASN A 181 -7.386 -11.479 -3.847 1.00 22.15 H new ATOM 0 HB3 ASN A 181 -7.199 -9.900 -4.583 1.00 22.15 H new ATOM 0 HD21 ASN A 181 -7.812 -11.222 -7.991 1.00 32.24 H new ATOM 0 HD22 ASN A 181 -6.551 -10.338 -7.126 1.00 32.24 H new ATOM 379 N LEU A 182 -4.043 -10.040 -3.429 1.00 64.44 N ATOM 380 CA LEU A 182 -3.340 -9.777 -2.185 1.00 52.34 C ATOM 381 C LEU A 182 -3.465 -8.293 -1.837 1.00 13.25 C ATOM 382 O LEU A 182 -3.387 -7.437 -2.717 1.00 51.42 O ATOM 383 CB LEU A 182 -1.892 -10.267 -2.273 1.00 0.13 C ATOM 384 CG LEU A 182 -1.590 -11.268 -3.391 1.00 5.15 C ATOM 385 CD1 LEU A 182 -1.797 -10.633 -4.766 1.00 53.43 C ATOM 386 CD2 LEU A 182 -0.186 -11.856 -3.235 1.00 12.25 C ATOM 0 H LEU A 182 -3.852 -9.373 -4.177 1.00 64.44 H new ATOM 0 HA LEU A 182 -3.793 -10.337 -1.367 1.00 52.34 H new ATOM 0 HB2 LEU A 182 -1.243 -9.401 -2.403 1.00 0.13 H new ATOM 0 HB3 LEU A 182 -1.626 -10.725 -1.320 1.00 0.13 H new ATOM 0 HG LEU A 182 -2.296 -12.095 -3.310 1.00 5.15 H new ATOM 0 HD11 LEU A 182 -1.576 -11.366 -5.542 1.00 53.43 H new ATOM 0 HD12 LEU A 182 -2.831 -10.303 -4.863 1.00 53.43 H new ATOM 0 HD13 LEU A 182 -1.132 -9.777 -4.875 1.00 53.43 H new ATOM 0 HD21 LEU A 182 0.004 -12.564 -4.042 1.00 12.25 H new ATOM 0 HD22 LEU A 182 0.551 -11.054 -3.275 1.00 12.25 H new ATOM 0 HD23 LEU A 182 -0.111 -12.369 -2.276 1.00 12.25 H new ATOM 397 N PHE A 183 -3.659 -8.033 -0.553 1.00 44.41 N ATOM 398 CA PHE A 183 -3.797 -6.666 -0.078 1.00 62.52 C ATOM 399 C PHE A 183 -2.480 -6.153 0.505 1.00 42.05 C ATOM 400 O PHE A 183 -2.162 -6.422 1.663 1.00 2.34 O ATOM 401 CB PHE A 183 -4.858 -6.681 1.024 1.00 44.42 C ATOM 402 CG PHE A 183 -5.490 -5.314 1.297 1.00 22.44 C ATOM 403 CD1 PHE A 183 -4.760 -4.335 1.896 1.00 21.15 C ATOM 404 CD2 PHE A 183 -6.781 -5.079 0.942 1.00 13.02 C ATOM 405 CE1 PHE A 183 -5.348 -3.067 2.150 1.00 70.51 C ATOM 406 CE2 PHE A 183 -7.369 -3.811 1.195 1.00 74.23 C ATOM 407 CZ PHE A 183 -6.639 -2.832 1.795 1.00 55.02 C ATOM 0 H PHE A 183 -3.724 -8.746 0.174 1.00 44.41 H new ATOM 0 HA PHE A 183 -4.077 -6.011 -0.903 1.00 62.52 H new ATOM 0 HB2 PHE A 183 -5.644 -7.385 0.749 1.00 44.42 H new ATOM 0 HB3 PHE A 183 -4.406 -7.052 1.944 1.00 44.42 H new ATOM 0 HD1 PHE A 183 -3.734 -4.521 2.178 1.00 21.15 H new ATOM 0 HD2 PHE A 183 -7.360 -5.857 0.467 1.00 13.02 H new ATOM 0 HE1 PHE A 183 -4.769 -2.289 2.625 1.00 70.51 H new ATOM 0 HE2 PHE A 183 -8.394 -3.624 0.911 1.00 74.23 H new ATOM 0 HZ PHE A 183 -7.085 -1.868 1.989 1.00 55.02 H new ATOM 416 N ILE A 184 -1.747 -5.423 -0.322 1.00 35.31 N ATOM 417 CA ILE A 184 -0.471 -4.869 0.096 1.00 65.02 C ATOM 418 C ILE A 184 -0.658 -4.103 1.407 1.00 43.44 C ATOM 419 O ILE A 184 -1.763 -3.662 1.721 1.00 71.43 O ATOM 420 CB ILE A 184 0.143 -4.028 -1.026 1.00 64.12 C ATOM 421 CG1 ILE A 184 0.557 -4.909 -2.207 1.00 41.12 C ATOM 422 CG2 ILE A 184 1.309 -3.185 -0.503 1.00 34.43 C ATOM 423 CD1 ILE A 184 1.542 -5.992 -1.764 1.00 22.34 C ATOM 0 H ILE A 184 -2.013 -5.202 -1.282 1.00 35.31 H new ATOM 0 HA ILE A 184 0.245 -5.667 0.292 1.00 65.02 H new ATOM 0 HB ILE A 184 -0.617 -3.337 -1.391 1.00 64.12 H new ATOM 0 HG12 ILE A 184 -0.326 -5.373 -2.646 1.00 41.12 H new ATOM 0 HG13 ILE A 184 1.013 -4.293 -2.983 1.00 41.12 H new ATOM 0 HG21 ILE A 184 1.728 -2.597 -1.320 1.00 34.43 H new ATOM 0 HG22 ILE A 184 0.952 -2.516 0.280 1.00 34.43 H new ATOM 0 HG23 ILE A 184 2.079 -3.841 -0.097 1.00 34.43 H new ATOM 0 HD11 ILE A 184 1.820 -6.604 -2.622 1.00 22.34 H new ATOM 0 HD12 ILE A 184 2.434 -5.524 -1.348 1.00 22.34 H new ATOM 0 HD13 ILE A 184 1.075 -6.621 -1.006 1.00 22.34 H new ATOM 434 N CYS A 185 0.439 -3.967 2.138 1.00 64.03 N ATOM 435 CA CYS A 185 0.410 -3.261 3.408 1.00 33.25 C ATOM 436 C CYS A 185 1.781 -2.621 3.634 1.00 1.33 C ATOM 437 O CYS A 185 1.870 -1.475 4.072 1.00 70.23 O ATOM 438 CB CYS A 185 0.015 -4.187 4.561 1.00 34.32 C ATOM 439 SG CYS A 185 1.465 -5.161 5.105 1.00 32.22 S ATOM 0 H CYS A 185 1.354 -4.334 1.875 1.00 64.03 H new ATOM 0 HA CYS A 185 -0.352 -2.482 3.377 1.00 33.25 H new ATOM 0 HB2 CYS A 185 -0.372 -3.600 5.394 1.00 34.32 H new ATOM 0 HB3 CYS A 185 -0.785 -4.856 4.244 1.00 34.32 H new ATOM 0 HG CYS A 185 2.014 -5.734 4.075 1.00 32.22 H new ATOM 444 N ALA A 186 2.814 -3.389 3.324 1.00 61.25 N ATOM 445 CA ALA A 186 4.177 -2.911 3.488 1.00 71.22 C ATOM 446 C ALA A 186 4.891 -2.944 2.135 1.00 32.53 C ATOM 447 O ALA A 186 4.391 -3.536 1.179 1.00 30.24 O ATOM 448 CB ALA A 186 4.891 -3.756 4.544 1.00 4.31 C ATOM 0 H ALA A 186 2.736 -4.339 2.960 1.00 61.25 H new ATOM 0 HA ALA A 186 4.182 -1.879 3.838 1.00 71.22 H new ATOM 0 HB1 ALA A 186 5.913 -3.397 4.667 1.00 4.31 H new ATOM 0 HB2 ALA A 186 4.362 -3.675 5.493 1.00 4.31 H new ATOM 0 HB3 ALA A 186 4.908 -4.798 4.225 1.00 4.31 H new ATOM 454 N HIS A 187 6.050 -2.303 2.097 1.00 14.25 N ATOM 455 CA HIS A 187 6.837 -2.252 0.877 1.00 35.15 C ATOM 456 C HIS A 187 8.302 -1.977 1.222 1.00 4.42 C ATOM 457 O HIS A 187 8.593 -1.233 2.157 1.00 43.12 O ATOM 458 CB HIS A 187 6.257 -1.229 -0.103 1.00 62.23 C ATOM 459 CG HIS A 187 6.963 0.106 -0.086 1.00 43.10 C ATOM 460 ND1 HIS A 187 6.798 1.191 0.723 1.00 3.42 N flip ATOM 461 CD2 HIS A 187 7.968 0.433 -0.979 1.00 5.44 C flip ATOM 462 CE1 HIS A 187 7.657 2.131 0.346 1.00 0.10 C flip ATOM 463 NE2 HIS A 187 8.383 1.662 -0.710 1.00 74.41 N flip ATOM 0 H HIS A 187 6.463 -1.815 2.892 1.00 14.25 H new ATOM 0 HA HIS A 187 6.793 -3.217 0.372 1.00 35.15 H new ATOM 0 HB2 HIS A 187 6.303 -1.640 -1.111 1.00 62.23 H new ATOM 0 HB3 HIS A 187 5.203 -1.074 0.130 1.00 62.23 H new ATOM 0 HD1 HIS A 187 6.128 1.268 1.488 1.00 3.42 H new ATOM 0 HD2 HIS A 187 8.349 -0.205 -1.762 1.00 5.44 H new ATOM 0 HE1 HIS A 187 7.763 3.105 0.800 1.00 0.10 H new ATOM 471 N HIS A 188 9.185 -2.593 0.449 1.00 0.13 N ATOM 472 CA HIS A 188 10.612 -2.424 0.662 1.00 30.11 C ATOM 473 C HIS A 188 11.336 -2.437 -0.686 1.00 61.24 C ATOM 474 O HIS A 188 10.998 -3.222 -1.569 1.00 63.42 O ATOM 475 CB HIS A 188 11.145 -3.479 1.632 1.00 64.30 C ATOM 476 CG HIS A 188 10.280 -4.714 1.733 1.00 71.12 C ATOM 477 ND1 HIS A 188 10.750 -5.984 1.446 1.00 55.24 N ATOM 478 CD2 HIS A 188 8.973 -4.859 2.092 1.00 43.01 C ATOM 479 CE1 HIS A 188 9.761 -6.846 1.626 1.00 63.13 C ATOM 480 NE2 HIS A 188 8.660 -6.147 2.026 1.00 62.43 N ATOM 0 H HIS A 188 8.939 -3.210 -0.325 1.00 0.13 H new ATOM 0 HA HIS A 188 10.803 -1.457 1.128 1.00 30.11 H new ATOM 0 HB2 HIS A 188 12.146 -3.774 1.318 1.00 64.30 H new ATOM 0 HB3 HIS A 188 11.240 -3.033 2.622 1.00 64.30 H new ATOM 0 HD1 HIS A 188 11.697 -6.216 1.147 1.00 55.24 H new ATOM 0 HD2 HIS A 188 8.305 -4.061 2.381 1.00 43.01 H new ATOM 0 HE1 HIS A 188 9.816 -7.915 1.481 1.00 63.13 H new ATOM 487 N ASN A 189 12.320 -1.557 -0.801 1.00 44.41 N ATOM 488 CA ASN A 189 13.096 -1.457 -2.025 1.00 55.00 C ATOM 489 C ASN A 189 12.145 -1.346 -3.218 1.00 50.50 C ATOM 490 O ASN A 189 12.521 -1.654 -4.348 1.00 22.30 O ATOM 491 CB ASN A 189 13.966 -2.699 -2.228 1.00 55.01 C ATOM 492 CG ASN A 189 15.038 -2.449 -3.292 1.00 43.25 C ATOM 493 OD1 ASN A 189 15.736 -1.449 -3.283 1.00 13.42 O ATOM 494 ND2 ASN A 189 15.129 -3.412 -4.204 1.00 74.21 N ATOM 0 H ASN A 189 12.598 -0.907 -0.066 1.00 44.41 H new ATOM 0 HA ASN A 189 13.735 -0.577 -1.949 1.00 55.00 H new ATOM 0 HB2 ASN A 189 14.441 -2.973 -1.286 1.00 55.01 H new ATOM 0 HB3 ASN A 189 13.341 -3.541 -2.527 1.00 55.01 H new ATOM 0 HD21 ASN A 189 15.815 -3.340 -4.955 1.00 74.21 H new ATOM 0 HD22 ASN A 189 14.513 -4.223 -4.152 1.00 74.21 H new ATOM 500 N CYS A 190 10.931 -0.902 -2.927 1.00 64.22 N ATOM 501 CA CYS A 190 9.922 -0.745 -3.962 1.00 50.13 C ATOM 502 C CYS A 190 10.004 -1.952 -4.899 1.00 40.15 C ATOM 503 O CYS A 190 9.660 -1.853 -6.075 1.00 72.34 O ATOM 504 CB CYS A 190 10.087 0.575 -4.716 1.00 53.14 C ATOM 505 SG CYS A 190 10.518 1.915 -3.547 1.00 24.04 S ATOM 0 H CYS A 190 10.623 -0.646 -1.989 1.00 64.22 H new ATOM 0 HA CYS A 190 8.932 -0.706 -3.507 1.00 50.13 H new ATOM 0 HB2 CYS A 190 10.866 0.476 -5.472 1.00 53.14 H new ATOM 0 HB3 CYS A 190 9.164 0.822 -5.240 1.00 53.14 H new ATOM 0 HG CYS A 190 9.734 1.856 -2.512 1.00 24.04 H new ATOM 510 N GLU A 191 10.461 -3.064 -4.341 1.00 52.55 N ATOM 511 CA GLU A 191 10.594 -4.288 -5.112 1.00 30.25 C ATOM 512 C GLU A 191 9.831 -5.427 -4.434 1.00 23.05 C ATOM 513 O GLU A 191 9.218 -6.255 -5.105 1.00 34.24 O ATOM 514 CB GLU A 191 12.066 -4.655 -5.311 1.00 22.24 C ATOM 515 CG GLU A 191 12.203 -5.955 -6.107 1.00 73.30 C ATOM 516 CD GLU A 191 13.250 -5.812 -7.214 1.00 10.04 C ATOM 517 OE1 GLU A 191 14.250 -5.102 -7.032 1.00 72.22 O ATOM 518 OE2 GLU A 191 12.997 -6.471 -8.293 1.00 20.23 O ATOM 0 H GLU A 191 10.744 -3.142 -3.364 1.00 52.55 H new ATOM 0 HA GLU A 191 10.160 -4.122 -6.098 1.00 30.25 H new ATOM 0 HB2 GLU A 191 12.578 -3.848 -5.835 1.00 22.24 H new ATOM 0 HB3 GLU A 191 12.552 -4.765 -4.341 1.00 22.24 H new ATOM 0 HG2 GLU A 191 12.485 -6.768 -5.438 1.00 73.30 H new ATOM 0 HG3 GLU A 191 11.241 -6.221 -6.544 1.00 73.30 H new ATOM 524 N TRP A 192 9.893 -5.433 -3.110 1.00 73.11 N ATOM 525 CA TRP A 192 9.217 -6.457 -2.333 1.00 21.24 C ATOM 526 C TRP A 192 8.105 -5.782 -1.527 1.00 40.31 C ATOM 527 O TRP A 192 8.350 -4.801 -0.825 1.00 65.24 O ATOM 528 CB TRP A 192 10.208 -7.225 -1.457 1.00 20.25 C ATOM 529 CG TRP A 192 11.088 -8.210 -2.230 1.00 12.34 C ATOM 530 CD1 TRP A 192 12.337 -8.022 -2.678 1.00 64.51 C ATOM 531 CD2 TRP A 192 10.733 -9.550 -2.629 1.00 55.14 C ATOM 532 NE1 TRP A 192 12.812 -9.140 -3.334 1.00 21.33 N ATOM 533 CE2 TRP A 192 11.804 -10.098 -3.304 1.00 63.44 C ATOM 534 CE3 TRP A 192 9.546 -10.275 -2.428 1.00 30.32 C ATOM 535 CZ2 TRP A 192 11.796 -11.395 -3.831 1.00 75.21 C ATOM 536 CZ3 TRP A 192 9.553 -11.570 -2.962 1.00 40.15 C ATOM 537 CH2 TRP A 192 10.623 -12.136 -3.644 1.00 43.14 C ATOM 0 H TRP A 192 10.402 -4.744 -2.556 1.00 73.11 H new ATOM 0 HA TRP A 192 8.768 -7.204 -2.988 1.00 21.24 H new ATOM 0 HB2 TRP A 192 10.848 -6.511 -0.939 1.00 20.25 H new ATOM 0 HB3 TRP A 192 9.655 -7.770 -0.693 1.00 20.25 H new ATOM 0 HD1 TRP A 192 12.901 -7.111 -2.543 1.00 64.51 H new ATOM 0 HE1 TRP A 192 13.732 -9.244 -3.762 1.00 21.33 H new ATOM 0 HE3 TRP A 192 8.695 -9.866 -1.903 1.00 30.32 H new ATOM 0 HZ2 TRP A 192 12.649 -11.802 -4.354 1.00 75.21 H new ATOM 0 HZ3 TRP A 192 8.664 -12.171 -2.835 1.00 40.15 H new ATOM 0 HH2 TRP A 192 10.550 -13.143 -4.028 1.00 43.14 H new ATOM 547 N PHE A 193 6.907 -6.332 -1.655 1.00 2.35 N ATOM 548 CA PHE A 193 5.757 -5.794 -0.948 1.00 11.25 C ATOM 549 C PHE A 193 5.194 -6.818 0.041 1.00 33.03 C ATOM 550 O PHE A 193 5.402 -8.019 -0.119 1.00 71.30 O ATOM 551 CB PHE A 193 4.692 -5.478 -1.999 1.00 32.41 C ATOM 552 CG PHE A 193 5.099 -4.384 -2.988 1.00 34.24 C ATOM 553 CD1 PHE A 193 6.136 -3.556 -2.696 1.00 54.41 C ATOM 554 CD2 PHE A 193 4.423 -4.241 -4.159 1.00 35.23 C ATOM 555 CE1 PHE A 193 6.513 -2.540 -3.614 1.00 42.44 C ATOM 556 CE2 PHE A 193 4.800 -3.225 -5.077 1.00 61.00 C ATOM 557 CZ PHE A 193 5.838 -2.396 -4.785 1.00 21.45 C ATOM 0 H PHE A 193 6.707 -7.145 -2.238 1.00 2.35 H new ATOM 0 HA PHE A 193 6.048 -4.907 -0.386 1.00 11.25 H new ATOM 0 HB2 PHE A 193 4.462 -6.388 -2.554 1.00 32.41 H new ATOM 0 HB3 PHE A 193 3.776 -5.173 -1.493 1.00 32.41 H new ATOM 0 HD1 PHE A 193 6.673 -3.670 -1.766 1.00 54.41 H new ATOM 0 HD2 PHE A 193 3.599 -4.900 -4.391 1.00 35.23 H new ATOM 0 HE1 PHE A 193 7.337 -1.881 -3.381 1.00 42.44 H new ATOM 0 HE2 PHE A 193 4.263 -3.111 -6.007 1.00 61.00 H new ATOM 0 HZ PHE A 193 6.126 -1.624 -5.483 1.00 21.45 H new ATOM 566 N ILE A 194 4.491 -6.304 1.039 1.00 2.10 N ATOM 567 CA ILE A 194 3.897 -7.158 2.053 1.00 23.42 C ATOM 568 C ILE A 194 2.376 -6.993 2.026 1.00 72.32 C ATOM 569 O ILE A 194 1.848 -5.990 2.505 1.00 34.11 O ATOM 570 CB ILE A 194 4.521 -6.880 3.423 1.00 35.03 C ATOM 571 CG1 ILE A 194 6.047 -6.824 3.328 1.00 54.34 C ATOM 572 CG2 ILE A 194 4.048 -7.901 4.458 1.00 65.34 C ATOM 573 CD1 ILE A 194 6.652 -8.226 3.391 1.00 64.34 C ATOM 0 H ILE A 194 4.319 -5.307 1.167 1.00 2.10 H new ATOM 0 HA ILE A 194 4.109 -8.206 1.839 1.00 23.42 H new ATOM 0 HB ILE A 194 4.183 -5.900 3.761 1.00 35.03 H new ATOM 0 HG12 ILE A 194 6.339 -6.340 2.396 1.00 54.34 H new ATOM 0 HG13 ILE A 194 6.443 -6.216 4.141 1.00 54.34 H new ATOM 0 HG21 ILE A 194 4.506 -7.681 5.422 1.00 65.34 H new ATOM 0 HG22 ILE A 194 2.963 -7.849 4.551 1.00 65.34 H new ATOM 0 HG23 ILE A 194 4.337 -8.903 4.139 1.00 65.34 H new ATOM 0 HD11 ILE A 194 7.738 -8.157 3.321 1.00 64.34 H new ATOM 0 HD12 ILE A 194 6.378 -8.698 4.334 1.00 64.34 H new ATOM 0 HD13 ILE A 194 6.272 -8.824 2.562 1.00 64.34 H new ATOM 584 N ALA A 195 1.714 -7.991 1.460 1.00 21.30 N ATOM 585 CA ALA A 195 0.265 -7.970 1.364 1.00 12.41 C ATOM 586 C ALA A 195 -0.323 -8.981 2.350 1.00 0.12 C ATOM 587 O ALA A 195 0.407 -9.777 2.937 1.00 51.23 O ATOM 588 CB ALA A 195 -0.156 -8.251 -0.080 1.00 51.25 C ATOM 0 H ALA A 195 2.155 -8.820 1.063 1.00 21.30 H new ATOM 0 HA ALA A 195 -0.122 -6.987 1.631 1.00 12.41 H new ATOM 0 HB1 ALA A 195 -1.244 -8.235 -0.152 1.00 51.25 H new ATOM 0 HB2 ALA A 195 0.262 -7.487 -0.736 1.00 51.25 H new ATOM 0 HB3 ALA A 195 0.213 -9.231 -0.383 1.00 51.25 H new ATOM 594 N LYS A 196 -1.638 -8.915 2.501 1.00 24.32 N ATOM 595 CA LYS A 196 -2.333 -9.816 3.406 1.00 50.21 C ATOM 596 C LYS A 196 -3.634 -10.285 2.752 1.00 0.41 C ATOM 597 O LYS A 196 -4.083 -9.703 1.766 1.00 45.21 O ATOM 598 CB LYS A 196 -2.534 -9.153 4.770 1.00 23.31 C ATOM 599 CG LYS A 196 -1.362 -9.459 5.706 1.00 10.54 C ATOM 600 CD LYS A 196 -1.446 -8.617 6.981 1.00 44.25 C ATOM 601 CE LYS A 196 -1.224 -7.135 6.675 1.00 54.40 C ATOM 602 NZ LYS A 196 -2.519 -6.450 6.466 1.00 4.24 N ATOM 0 H LYS A 196 -2.240 -8.252 2.013 1.00 24.32 H new ATOM 0 HA LYS A 196 -1.732 -10.706 3.595 1.00 50.21 H new ATOM 0 HB2 LYS A 196 -2.631 -8.075 4.644 1.00 23.31 H new ATOM 0 HB3 LYS A 196 -3.463 -9.507 5.217 1.00 23.31 H new ATOM 0 HG2 LYS A 196 -1.365 -10.518 5.964 1.00 10.54 H new ATOM 0 HG3 LYS A 196 -0.421 -9.258 5.194 1.00 10.54 H new ATOM 0 HD2 LYS A 196 -2.422 -8.753 7.448 1.00 44.25 H new ATOM 0 HD3 LYS A 196 -0.699 -8.960 7.697 1.00 44.25 H new ATOM 0 HE2 LYS A 196 -0.685 -6.664 7.497 1.00 54.40 H new ATOM 0 HE3 LYS A 196 -0.603 -7.030 5.786 1.00 54.40 H new ATOM 0 HZ1 LYS A 196 -2.496 -5.931 5.565 1.00 4.24 H new ATOM 0 HZ2 LYS A 196 -3.284 -7.154 6.440 1.00 4.24 H new ATOM 0 HZ3 LYS A 196 -2.689 -5.783 7.246 1.00 4.24 H new ATOM 611 N PRO A 197 -4.219 -11.361 3.343 1.00 62.22 N ATOM 612 CA PRO A 197 -5.460 -11.916 2.830 1.00 52.13 C ATOM 613 C PRO A 197 -6.650 -11.026 3.193 1.00 51.52 C ATOM 614 O PRO A 197 -6.510 -10.082 3.971 1.00 61.43 O ATOM 615 CB PRO A 197 -5.550 -13.306 3.436 1.00 60.21 C ATOM 616 CG PRO A 197 -4.603 -13.305 4.625 1.00 10.33 C ATOM 617 CD PRO A 197 -3.716 -12.077 4.513 1.00 51.52 C ATOM 0 HA PRO A 197 -5.479 -11.970 1.741 1.00 52.13 H new ATOM 0 HB2 PRO A 197 -6.570 -13.530 3.749 1.00 60.21 H new ATOM 0 HB3 PRO A 197 -5.265 -14.068 2.710 1.00 60.21 H new ATOM 0 HG2 PRO A 197 -5.164 -13.287 5.560 1.00 10.33 H new ATOM 0 HG3 PRO A 197 -3.999 -14.213 4.633 1.00 10.33 H new ATOM 0 HD2 PRO A 197 -3.777 -11.461 5.410 1.00 51.52 H new ATOM 0 HD3 PRO A 197 -2.669 -12.355 4.388 1.00 51.52 H new ATOM 692 N GLY A 203 -1.160 -14.534 5.755 1.00 34.25 N ATOM 693 CA GLY A 203 -0.409 -13.291 5.717 1.00 71.33 C ATOM 694 C GLY A 203 0.394 -13.097 7.006 1.00 14.32 C ATOM 695 O GLY A 203 0.223 -13.846 7.966 1.00 41.13 O ATOM 0 HA2 GLY A 203 0.266 -13.295 4.861 1.00 71.33 H new ATOM 0 HA3 GLY A 203 -1.092 -12.453 5.580 1.00 71.33 H new ATOM 699 N PRO A 204 1.272 -12.060 6.984 1.00 53.34 N ATOM 700 CA PRO A 204 1.412 -11.221 5.806 1.00 14.42 C ATOM 701 C PRO A 204 2.188 -11.947 4.705 1.00 52.43 C ATOM 702 O PRO A 204 3.278 -12.463 4.946 1.00 61.30 O ATOM 703 CB PRO A 204 2.114 -9.965 6.297 1.00 21.55 C ATOM 704 CG PRO A 204 2.754 -10.338 7.624 1.00 63.14 C ATOM 705 CD PRO A 204 2.155 -11.659 8.077 1.00 11.53 C ATOM 0 HA PRO A 204 0.453 -10.973 5.351 1.00 14.42 H new ATOM 0 HB2 PRO A 204 2.865 -9.632 5.581 1.00 21.55 H new ATOM 0 HB3 PRO A 204 1.406 -9.145 6.421 1.00 21.55 H new ATOM 0 HG2 PRO A 204 3.835 -10.427 7.515 1.00 63.14 H new ATOM 0 HG3 PRO A 204 2.572 -9.562 8.367 1.00 63.14 H new ATOM 0 HD2 PRO A 204 2.930 -12.405 8.254 1.00 11.53 H new ATOM 0 HD3 PRO A 204 1.603 -11.544 9.010 1.00 11.53 H new ATOM 710 N GLY A 205 1.595 -11.964 3.520 1.00 11.33 N ATOM 711 CA GLY A 205 2.217 -12.617 2.381 1.00 70.12 C ATOM 712 C GLY A 205 3.056 -11.627 1.571 1.00 73.22 C ATOM 713 O GLY A 205 2.541 -10.616 1.095 1.00 12.20 O ATOM 0 H GLY A 205 0.690 -11.536 3.324 1.00 11.33 H new ATOM 0 HA2 GLY A 205 2.848 -13.436 2.727 1.00 70.12 H new ATOM 0 HA3 GLY A 205 1.448 -13.054 1.744 1.00 70.12 H new ATOM 717 N LEU A 206 4.333 -11.953 1.439 1.00 50.21 N ATOM 718 CA LEU A 206 5.248 -11.104 0.694 1.00 44.11 C ATOM 719 C LEU A 206 5.073 -11.363 -0.804 1.00 61.41 C ATOM 720 O LEU A 206 4.779 -12.486 -1.213 1.00 1.43 O ATOM 721 CB LEU A 206 6.683 -11.300 1.189 1.00 35.32 C ATOM 722 CG LEU A 206 7.789 -10.988 0.179 1.00 55.41 C ATOM 723 CD1 LEU A 206 8.658 -9.824 0.661 1.00 72.35 C ATOM 724 CD2 LEU A 206 8.619 -12.235 -0.130 1.00 34.11 C ATOM 0 H LEU A 206 4.756 -12.793 1.835 1.00 50.21 H new ATOM 0 HA LEU A 206 5.017 -10.053 0.865 1.00 44.11 H new ATOM 0 HB2 LEU A 206 6.832 -10.672 2.067 1.00 35.32 H new ATOM 0 HB3 LEU A 206 6.796 -12.334 1.514 1.00 35.32 H new ATOM 0 HG LEU A 206 7.321 -10.676 -0.755 1.00 55.41 H new ATOM 0 HD11 LEU A 206 9.437 -9.622 -0.075 1.00 72.35 H new ATOM 0 HD12 LEU A 206 8.039 -8.936 0.787 1.00 72.35 H new ATOM 0 HD13 LEU A 206 9.118 -10.084 1.614 1.00 72.35 H new ATOM 0 HD21 LEU A 206 9.398 -11.984 -0.850 1.00 34.11 H new ATOM 0 HD22 LEU A 206 9.078 -12.603 0.787 1.00 34.11 H new ATOM 0 HD23 LEU A 206 7.973 -13.008 -0.548 1.00 34.11 H new ATOM 735 N VAL A 207 5.260 -10.306 -1.581 1.00 24.00 N ATOM 736 CA VAL A 207 5.126 -10.405 -3.024 1.00 51.25 C ATOM 737 C VAL A 207 5.849 -9.226 -3.681 1.00 24.42 C ATOM 738 O VAL A 207 5.626 -8.075 -3.312 1.00 51.32 O ATOM 739 CB VAL A 207 3.648 -10.489 -3.408 1.00 22.32 C ATOM 740 CG1 VAL A 207 3.169 -9.178 -4.035 1.00 41.23 C ATOM 741 CG2 VAL A 207 3.390 -11.671 -4.344 1.00 54.02 C ATOM 0 H VAL A 207 5.503 -9.377 -1.238 1.00 24.00 H new ATOM 0 HA VAL A 207 5.595 -11.319 -3.389 1.00 51.25 H new ATOM 0 HB VAL A 207 3.074 -10.654 -2.496 1.00 22.32 H new ATOM 0 HG11 VAL A 207 2.115 -9.265 -4.299 1.00 41.23 H new ATOM 0 HG12 VAL A 207 3.299 -8.365 -3.321 1.00 41.23 H new ATOM 0 HG13 VAL A 207 3.752 -8.970 -4.932 1.00 41.23 H new ATOM 0 HG21 VAL A 207 2.331 -11.707 -4.601 1.00 54.02 H new ATOM 0 HG22 VAL A 207 3.980 -11.551 -5.253 1.00 54.02 H new ATOM 0 HG23 VAL A 207 3.674 -12.598 -3.846 1.00 54.02 H new ATOM 751 N PRO A 208 6.721 -9.565 -4.667 1.00 62.30 N ATOM 752 CA PRO A 208 7.477 -8.549 -5.379 1.00 44.25 C ATOM 753 C PRO A 208 6.589 -7.801 -6.374 1.00 52.41 C ATOM 754 O PRO A 208 5.400 -8.090 -6.489 1.00 31.55 O ATOM 755 CB PRO A 208 8.615 -9.302 -6.048 1.00 71.35 C ATOM 756 CG PRO A 208 8.193 -10.762 -6.072 1.00 1.21 C ATOM 757 CD PRO A 208 7.010 -10.920 -5.130 1.00 23.23 C ATOM 0 HA PRO A 208 7.864 -7.773 -4.718 1.00 44.25 H new ATOM 0 HB2 PRO A 208 8.789 -8.929 -7.057 1.00 71.35 H new ATOM 0 HB3 PRO A 208 9.546 -9.174 -5.496 1.00 71.35 H new ATOM 0 HG2 PRO A 208 7.919 -11.064 -7.083 1.00 1.21 H new ATOM 0 HG3 PRO A 208 9.018 -11.403 -5.760 1.00 1.21 H new ATOM 0 HD2 PRO A 208 6.152 -11.355 -5.642 1.00 23.23 H new ATOM 0 HD3 PRO A 208 7.252 -11.580 -4.297 1.00 23.23 H new ATOM 762 N VAL A 209 7.201 -6.852 -7.068 1.00 65.21 N ATOM 763 CA VAL A 209 6.480 -6.060 -8.050 1.00 61.53 C ATOM 764 C VAL A 209 6.730 -6.636 -9.446 1.00 2.42 C ATOM 765 O VAL A 209 6.278 -6.074 -10.443 1.00 45.11 O ATOM 766 CB VAL A 209 6.880 -4.588 -7.930 1.00 25.43 C ATOM 767 CG1 VAL A 209 7.287 -4.246 -6.495 1.00 35.51 C ATOM 768 CG2 VAL A 209 7.998 -4.241 -8.916 1.00 44.01 C ATOM 0 H VAL A 209 8.188 -6.614 -6.970 1.00 65.21 H new ATOM 0 HA VAL A 209 5.407 -6.107 -7.866 1.00 61.53 H new ATOM 0 HB VAL A 209 6.010 -3.982 -8.185 1.00 25.43 H new ATOM 0 HG11 VAL A 209 7.567 -3.194 -6.437 1.00 35.51 H new ATOM 0 HG12 VAL A 209 6.449 -4.436 -5.824 1.00 35.51 H new ATOM 0 HG13 VAL A 209 8.135 -4.864 -6.200 1.00 35.51 H new ATOM 0 HG21 VAL A 209 8.263 -3.189 -8.810 1.00 44.01 H new ATOM 0 HG22 VAL A 209 8.872 -4.858 -8.707 1.00 44.01 H new ATOM 0 HG23 VAL A 209 7.656 -4.428 -9.934 1.00 44.01 H new ATOM 778 N GLY A 210 7.449 -7.748 -9.473 1.00 4.12 N ATOM 779 CA GLY A 210 7.764 -8.405 -10.729 1.00 25.45 C ATOM 780 C GLY A 210 6.921 -9.669 -10.913 1.00 34.44 C ATOM 781 O GLY A 210 7.008 -10.333 -11.945 1.00 52.13 O ATOM 0 H GLY A 210 7.823 -8.211 -8.644 1.00 4.12 H new ATOM 0 HA2 GLY A 210 7.584 -7.720 -11.557 1.00 25.45 H new ATOM 0 HA3 GLY A 210 8.823 -8.663 -10.753 1.00 25.45 H new ATOM 785 N PHE A 211 6.121 -9.963 -9.898 1.00 55.15 N ATOM 786 CA PHE A 211 5.264 -11.134 -9.936 1.00 10.44 C ATOM 787 C PHE A 211 3.811 -10.759 -9.630 1.00 34.41 C ATOM 788 O PHE A 211 2.936 -11.624 -9.602 1.00 52.03 O ATOM 789 CB PHE A 211 5.768 -12.093 -8.856 1.00 1.44 C ATOM 790 CG PHE A 211 6.730 -13.163 -9.374 1.00 73.22 C ATOM 791 CD1 PHE A 211 8.058 -12.888 -9.486 1.00 62.01 C ATOM 792 CD2 PHE A 211 6.259 -14.390 -9.724 1.00 13.43 C ATOM 793 CE1 PHE A 211 8.951 -13.881 -9.966 1.00 73.54 C ATOM 794 CE2 PHE A 211 7.152 -15.383 -10.206 1.00 21.10 C ATOM 795 CZ PHE A 211 8.480 -15.108 -10.316 1.00 14.11 C ATOM 0 H PHE A 211 6.049 -9.409 -9.044 1.00 55.15 H new ATOM 0 HA PHE A 211 5.295 -11.586 -10.927 1.00 10.44 H new ATOM 0 HB2 PHE A 211 6.267 -11.517 -8.077 1.00 1.44 H new ATOM 0 HB3 PHE A 211 4.912 -12.583 -8.391 1.00 1.44 H new ATOM 0 HD1 PHE A 211 8.433 -11.914 -9.209 1.00 62.01 H new ATOM 0 HD2 PHE A 211 5.205 -14.609 -9.635 1.00 13.43 H new ATOM 0 HE1 PHE A 211 10.005 -13.662 -10.053 1.00 73.54 H new ATOM 0 HE2 PHE A 211 6.777 -16.357 -10.485 1.00 21.10 H new ATOM 0 HZ PHE A 211 9.160 -15.864 -10.681 1.00 14.11 H new ATOM 804 N VAL A 212 3.600 -9.470 -9.410 1.00 60.22 N ATOM 805 CA VAL A 212 2.269 -8.971 -9.109 1.00 41.31 C ATOM 806 C VAL A 212 2.075 -7.611 -9.782 1.00 64.23 C ATOM 807 O VAL A 212 3.027 -7.028 -10.299 1.00 64.32 O ATOM 808 CB VAL A 212 2.058 -8.925 -7.594 1.00 52.55 C ATOM 809 CG1 VAL A 212 2.758 -10.099 -6.906 1.00 73.42 C ATOM 810 CG2 VAL A 212 2.533 -7.589 -7.015 1.00 62.52 C ATOM 0 H VAL A 212 4.328 -8.756 -9.434 1.00 60.22 H new ATOM 0 HA VAL A 212 1.509 -9.642 -9.509 1.00 41.31 H new ATOM 0 HB VAL A 212 0.989 -9.014 -7.402 1.00 52.55 H new ATOM 0 HG11 VAL A 212 2.592 -10.042 -5.830 1.00 73.42 H new ATOM 0 HG12 VAL A 212 2.354 -11.037 -7.286 1.00 73.42 H new ATOM 0 HG13 VAL A 212 3.828 -10.055 -7.111 1.00 73.42 H new ATOM 0 HG21 VAL A 212 2.372 -7.582 -5.937 1.00 62.52 H new ATOM 0 HG22 VAL A 212 3.595 -7.459 -7.224 1.00 62.52 H new ATOM 0 HG23 VAL A 212 1.971 -6.774 -7.471 1.00 62.52 H new ATOM 820 N SER A 213 0.835 -7.144 -9.752 1.00 54.04 N ATOM 821 CA SER A 213 0.504 -5.863 -10.353 1.00 1.03 C ATOM 822 C SER A 213 -0.271 -5.001 -9.354 1.00 42.12 C ATOM 823 O SER A 213 -1.118 -5.506 -8.619 1.00 20.41 O ATOM 824 CB SER A 213 -0.309 -6.049 -11.635 1.00 72.53 C ATOM 825 OG SER A 213 -1.200 -4.961 -11.866 1.00 24.10 O ATOM 0 H SER A 213 0.048 -7.629 -9.321 1.00 54.04 H new ATOM 0 HA SER A 213 1.434 -5.358 -10.615 1.00 1.03 H new ATOM 0 HB2 SER A 213 0.369 -6.148 -12.483 1.00 72.53 H new ATOM 0 HB3 SER A 213 -0.878 -6.976 -11.572 1.00 72.53 H new ATOM 0 HG SER A 213 -1.699 -5.117 -12.695 1.00 24.10 H new ATOM 830 N ILE A 214 0.047 -3.715 -9.358 1.00 53.44 N ATOM 831 CA ILE A 214 -0.608 -2.779 -8.461 1.00 12.32 C ATOM 832 C ILE A 214 -1.935 -2.332 -9.078 1.00 43.21 C ATOM 833 O ILE A 214 -2.010 -2.075 -10.279 1.00 24.52 O ATOM 834 CB ILE A 214 0.331 -1.620 -8.117 1.00 24.13 C ATOM 835 CG1 ILE A 214 1.647 -2.136 -7.531 1.00 25.22 C ATOM 836 CG2 ILE A 214 -0.356 -0.616 -7.188 1.00 0.00 C ATOM 837 CD1 ILE A 214 1.535 -2.327 -6.017 1.00 50.24 C ATOM 0 H ILE A 214 0.750 -3.299 -9.969 1.00 53.44 H new ATOM 0 HA ILE A 214 -0.843 -3.261 -7.512 1.00 12.32 H new ATOM 0 HB ILE A 214 0.575 -1.092 -9.039 1.00 24.13 H new ATOM 0 HG12 ILE A 214 1.913 -3.082 -8.002 1.00 25.22 H new ATOM 0 HG13 ILE A 214 2.449 -1.433 -7.754 1.00 25.22 H new ATOM 0 HG21 ILE A 214 0.332 0.198 -6.959 1.00 0.00 H new ATOM 0 HG22 ILE A 214 -1.242 -0.214 -7.679 1.00 0.00 H new ATOM 0 HG23 ILE A 214 -0.648 -1.116 -6.264 1.00 0.00 H new ATOM 0 HD11 ILE A 214 2.484 -2.694 -5.625 1.00 50.24 H new ATOM 0 HD12 ILE A 214 1.293 -1.374 -5.547 1.00 50.24 H new ATOM 0 HD13 ILE A 214 0.748 -3.049 -5.799 1.00 50.24 H new ATOM 848 N ILE A 215 -2.949 -2.254 -8.228 1.00 54.10 N ATOM 849 CA ILE A 215 -4.269 -1.843 -8.676 1.00 64.33 C ATOM 850 C ILE A 215 -5.123 -1.477 -7.460 1.00 51.21 C ATOM 851 O ILE A 215 -4.817 -1.879 -6.338 1.00 12.53 O ATOM 852 CB ILE A 215 -4.894 -2.921 -9.564 1.00 43.31 C ATOM 853 CG1 ILE A 215 -4.647 -4.316 -8.987 1.00 23.51 C ATOM 854 CG2 ILE A 215 -4.396 -2.800 -11.005 1.00 13.42 C ATOM 855 CD1 ILE A 215 -5.537 -5.357 -9.670 1.00 73.10 C ATOM 0 H ILE A 215 -2.883 -2.468 -7.233 1.00 54.10 H new ATOM 0 HA ILE A 215 -4.200 -0.951 -9.299 1.00 64.33 H new ATOM 0 HB ILE A 215 -5.973 -2.766 -9.583 1.00 43.31 H new ATOM 0 HG12 ILE A 215 -3.599 -4.587 -9.117 1.00 23.51 H new ATOM 0 HG13 ILE A 215 -4.845 -4.310 -7.915 1.00 23.51 H new ATOM 0 HG21 ILE A 215 -4.855 -3.578 -11.615 1.00 13.42 H new ATOM 0 HG22 ILE A 215 -4.665 -1.821 -11.402 1.00 13.42 H new ATOM 0 HG23 ILE A 215 -3.312 -2.915 -11.026 1.00 13.42 H new ATOM 0 HD11 ILE A 215 -5.342 -6.340 -9.241 1.00 73.10 H new ATOM 0 HD12 ILE A 215 -6.584 -5.096 -9.518 1.00 73.10 H new ATOM 0 HD13 ILE A 215 -5.320 -5.377 -10.738 1.00 73.10 H new ATOM 991 N ASP A 226 3.639 4.598 -12.175 1.00 40.32 N ATOM 992 CA ASP A 226 4.493 3.459 -11.883 1.00 53.12 C ATOM 993 C ASP A 226 4.391 3.119 -10.395 1.00 51.10 C ATOM 994 O ASP A 226 4.263 4.011 -9.558 1.00 11.23 O ATOM 995 CB ASP A 226 5.957 3.774 -12.196 1.00 50.11 C ATOM 996 CG ASP A 226 6.775 2.593 -12.722 1.00 11.14 C ATOM 997 OD1 ASP A 226 6.665 1.465 -12.218 1.00 40.11 O ATOM 998 OD2 ASP A 226 7.563 2.870 -13.707 1.00 3.13 O ATOM 0 HA ASP A 226 4.164 2.623 -12.501 1.00 53.12 H new ATOM 0 HB2 ASP A 226 5.991 4.577 -12.933 1.00 50.11 H new ATOM 0 HB3 ASP A 226 6.433 4.152 -11.291 1.00 50.11 H new ATOM 1003 N VAL A 227 4.453 1.827 -10.110 1.00 34.31 N ATOM 1004 CA VAL A 227 4.369 1.358 -8.737 1.00 32.12 C ATOM 1005 C VAL A 227 5.244 2.241 -7.846 1.00 75.24 C ATOM 1006 O VAL A 227 4.752 2.860 -6.905 1.00 51.40 O ATOM 1007 CB VAL A 227 4.746 -0.124 -8.667 1.00 10.44 C ATOM 1008 CG1 VAL A 227 6.078 -0.384 -9.372 1.00 32.24 C ATOM 1009 CG2 VAL A 227 4.789 -0.609 -7.216 1.00 50.12 C ATOM 0 H VAL A 227 4.560 1.090 -10.807 1.00 34.31 H new ATOM 0 HA VAL A 227 3.347 1.437 -8.368 1.00 32.12 H new ATOM 0 HB VAL A 227 3.975 -0.692 -9.188 1.00 10.44 H new ATOM 0 HG11 VAL A 227 6.323 -1.444 -9.308 1.00 32.24 H new ATOM 0 HG12 VAL A 227 5.998 -0.093 -10.419 1.00 32.24 H new ATOM 0 HG13 VAL A 227 6.864 0.199 -8.892 1.00 32.24 H new ATOM 0 HG21 VAL A 227 5.059 -1.665 -7.193 1.00 50.12 H new ATOM 0 HG22 VAL A 227 5.530 -0.033 -6.662 1.00 50.12 H new ATOM 0 HG23 VAL A 227 3.809 -0.475 -6.758 1.00 50.12 H new ATOM 1019 N ILE A 228 6.527 2.271 -8.176 1.00 61.22 N ATOM 1020 CA ILE A 228 7.476 3.068 -7.418 1.00 73.42 C ATOM 1021 C ILE A 228 6.919 4.482 -7.237 1.00 60.43 C ATOM 1022 O ILE A 228 6.933 5.021 -6.132 1.00 2.21 O ATOM 1023 CB ILE A 228 8.856 3.031 -8.079 1.00 2.30 C ATOM 1024 CG1 ILE A 228 9.444 1.619 -8.042 1.00 31.33 C ATOM 1025 CG2 ILE A 228 9.796 4.059 -7.446 1.00 4.43 C ATOM 1026 CD1 ILE A 228 9.908 1.181 -9.433 1.00 13.20 C ATOM 0 H ILE A 228 6.931 1.756 -8.958 1.00 61.22 H new ATOM 0 HA ILE A 228 7.614 2.649 -6.421 1.00 73.42 H new ATOM 0 HB ILE A 228 8.739 3.304 -9.128 1.00 2.30 H new ATOM 0 HG12 ILE A 228 10.284 1.589 -7.348 1.00 31.33 H new ATOM 0 HG13 ILE A 228 8.697 0.920 -7.667 1.00 31.33 H new ATOM 0 HG21 ILE A 228 10.769 4.011 -7.934 1.00 4.43 H new ATOM 0 HG22 ILE A 228 9.378 5.058 -7.568 1.00 4.43 H new ATOM 0 HG23 ILE A 228 9.912 3.841 -6.384 1.00 4.43 H new ATOM 0 HD11 ILE A 228 10.322 0.174 -9.378 1.00 13.20 H new ATOM 0 HD12 ILE A 228 9.060 1.188 -10.118 1.00 13.20 H new ATOM 0 HD13 ILE A 228 10.673 1.868 -9.795 1.00 13.20 H new ATOM 1037 N GLU A 229 6.443 5.040 -8.339 1.00 14.32 N ATOM 1038 CA GLU A 229 5.882 6.380 -8.317 1.00 0.54 C ATOM 1039 C GLU A 229 4.598 6.405 -7.484 1.00 24.40 C ATOM 1040 O GLU A 229 4.201 7.454 -6.979 1.00 63.11 O ATOM 1041 CB GLU A 229 5.624 6.892 -9.736 1.00 22.12 C ATOM 1042 CG GLU A 229 6.935 7.045 -10.509 1.00 72.11 C ATOM 1043 CD GLU A 229 6.857 8.213 -11.495 1.00 4.25 C ATOM 1044 OE1 GLU A 229 6.312 8.057 -12.598 1.00 51.14 O ATOM 1045 OE2 GLU A 229 7.385 9.314 -11.079 1.00 5.21 O ATOM 0 H GLU A 229 6.434 4.589 -9.254 1.00 14.32 H new ATOM 0 HA GLU A 229 6.608 7.047 -7.852 1.00 0.54 H new ATOM 0 HB2 GLU A 229 4.966 6.201 -10.262 1.00 22.12 H new ATOM 0 HB3 GLU A 229 5.109 7.852 -9.692 1.00 22.12 H new ATOM 0 HG2 GLU A 229 7.756 7.208 -9.811 1.00 72.11 H new ATOM 0 HG3 GLU A 229 7.153 6.123 -11.048 1.00 72.11 H new ATOM 1051 N ASP A 230 3.984 5.236 -7.367 1.00 41.35 N ATOM 1052 CA ASP A 230 2.754 5.110 -6.605 1.00 4.13 C ATOM 1053 C ASP A 230 3.094 4.900 -5.128 1.00 11.44 C ATOM 1054 O ASP A 230 2.235 5.058 -4.261 1.00 11.22 O ATOM 1055 CB ASP A 230 1.934 3.908 -7.077 1.00 24.11 C ATOM 1056 CG ASP A 230 1.320 4.051 -8.470 1.00 1.04 C ATOM 1057 OD1 ASP A 230 1.740 3.382 -9.425 1.00 32.51 O ATOM 1058 OD2 ASP A 230 0.355 4.904 -8.556 1.00 42.04 O ATOM 0 H ASP A 230 4.316 4.368 -7.787 1.00 41.35 H new ATOM 0 HA ASP A 230 2.173 6.021 -6.749 1.00 4.13 H new ATOM 0 HB2 ASP A 230 2.573 3.025 -7.067 1.00 24.11 H new ATOM 0 HB3 ASP A 230 1.133 3.730 -6.360 1.00 24.11 H new ATOM 1063 N ILE A 231 4.348 4.548 -4.887 1.00 4.01 N ATOM 1064 CA ILE A 231 4.812 4.315 -3.529 1.00 52.32 C ATOM 1065 C ILE A 231 4.937 5.655 -2.801 1.00 61.22 C ATOM 1066 O ILE A 231 4.171 5.940 -1.881 1.00 30.21 O ATOM 1067 CB ILE A 231 6.104 3.497 -3.538 1.00 65.22 C ATOM 1068 CG1 ILE A 231 5.818 2.017 -3.274 1.00 63.05 C ATOM 1069 CG2 ILE A 231 7.122 4.069 -2.549 1.00 44.40 C ATOM 1070 CD1 ILE A 231 5.734 1.233 -4.585 1.00 72.43 C ATOM 0 H ILE A 231 5.057 4.418 -5.608 1.00 4.01 H new ATOM 0 HA ILE A 231 4.088 3.717 -2.976 1.00 52.32 H new ATOM 0 HB ILE A 231 6.546 3.567 -4.532 1.00 65.22 H new ATOM 0 HG12 ILE A 231 6.603 1.598 -2.645 1.00 63.05 H new ATOM 0 HG13 ILE A 231 4.882 1.916 -2.725 1.00 63.05 H new ATOM 0 HG21 ILE A 231 8.032 3.469 -2.575 1.00 44.40 H new ATOM 0 HG22 ILE A 231 7.358 5.097 -2.823 1.00 44.40 H new ATOM 0 HG23 ILE A 231 6.703 4.049 -1.543 1.00 44.40 H new ATOM 0 HD11 ILE A 231 5.530 0.184 -4.369 1.00 72.43 H new ATOM 0 HD12 ILE A 231 4.932 1.639 -5.201 1.00 72.43 H new ATOM 0 HD13 ILE A 231 6.680 1.316 -5.120 1.00 72.43 H new ATOM 1081 N LYS A 232 5.908 6.441 -3.239 1.00 42.44 N ATOM 1082 CA LYS A 232 6.144 7.744 -2.639 1.00 11.52 C ATOM 1083 C LYS A 232 4.901 8.618 -2.824 1.00 62.11 C ATOM 1084 O LYS A 232 4.712 9.595 -2.101 1.00 73.54 O ATOM 1085 CB LYS A 232 7.423 8.369 -3.201 1.00 61.24 C ATOM 1086 CG LYS A 232 7.153 9.066 -4.535 1.00 14.01 C ATOM 1087 CD LYS A 232 7.020 8.048 -5.669 1.00 65.53 C ATOM 1088 CE LYS A 232 8.292 7.207 -5.802 1.00 33.24 C ATOM 1089 NZ LYS A 232 9.493 8.050 -5.613 1.00 2.42 N ATOM 0 H LYS A 232 6.541 6.202 -4.002 1.00 42.44 H new ATOM 0 HA LYS A 232 6.309 7.645 -1.566 1.00 11.52 H new ATOM 0 HB2 LYS A 232 7.825 9.087 -2.486 1.00 61.24 H new ATOM 0 HB3 LYS A 232 8.180 7.597 -3.337 1.00 61.24 H new ATOM 0 HG2 LYS A 232 6.240 9.656 -4.463 1.00 14.01 H new ATOM 0 HG3 LYS A 232 7.964 9.760 -4.758 1.00 14.01 H new ATOM 0 HD2 LYS A 232 6.167 7.396 -5.480 1.00 65.53 H new ATOM 0 HD3 LYS A 232 6.823 8.567 -6.607 1.00 65.53 H new ATOM 0 HE2 LYS A 232 8.284 6.405 -5.064 1.00 33.24 H new ATOM 0 HE3 LYS A 232 8.322 6.736 -6.784 1.00 33.24 H new ATOM 0 HZ1 LYS A 232 10.320 7.574 -6.027 1.00 2.42 H new ATOM 0 HZ2 LYS A 232 9.350 8.967 -6.082 1.00 2.42 H new ATOM 0 HZ3 LYS A 232 9.654 8.202 -4.597 1.00 2.42 H new ATOM 1098 N SER A 233 4.086 8.234 -3.795 1.00 21.31 N ATOM 1099 CA SER A 233 2.867 8.969 -4.082 1.00 33.34 C ATOM 1100 C SER A 233 2.054 9.158 -2.800 1.00 31.54 C ATOM 1101 O SER A 233 1.679 10.278 -2.457 1.00 55.11 O ATOM 1102 CB SER A 233 2.028 8.251 -5.142 1.00 54.14 C ATOM 1103 OG SER A 233 2.249 8.781 -6.447 1.00 61.15 O ATOM 0 H SER A 233 4.246 7.423 -4.393 1.00 21.31 H new ATOM 0 HA SER A 233 3.143 9.947 -4.476 1.00 33.34 H new ATOM 0 HB2 SER A 233 2.269 7.188 -5.137 1.00 54.14 H new ATOM 0 HB3 SER A 233 0.971 8.339 -4.889 1.00 54.14 H new ATOM 0 HG SER A 233 2.856 8.191 -6.941 1.00 61.15 H new ATOM 1108 N VAL A 234 1.805 8.044 -2.127 1.00 11.43 N ATOM 1109 CA VAL A 234 1.043 8.073 -0.889 1.00 35.52 C ATOM 1110 C VAL A 234 2.007 8.145 0.297 1.00 32.42 C ATOM 1111 O VAL A 234 1.677 7.704 1.396 1.00 22.20 O ATOM 1112 CB VAL A 234 0.105 6.866 -0.825 1.00 65.20 C ATOM 1113 CG1 VAL A 234 -0.494 6.562 -2.200 1.00 12.32 C ATOM 1114 CG2 VAL A 234 0.825 5.641 -0.258 1.00 11.21 C ATOM 0 H VAL A 234 2.117 7.116 -2.415 1.00 11.43 H new ATOM 0 HA VAL A 234 0.412 8.961 -0.849 1.00 35.52 H new ATOM 0 HB VAL A 234 -0.714 7.115 -0.151 1.00 65.20 H new ATOM 0 HG11 VAL A 234 -1.157 5.700 -2.126 1.00 12.32 H new ATOM 0 HG12 VAL A 234 -1.060 7.426 -2.549 1.00 12.32 H new ATOM 0 HG13 VAL A 234 0.307 6.344 -2.906 1.00 12.32 H new ATOM 0 HG21 VAL A 234 0.136 4.797 -0.223 1.00 11.21 H new ATOM 0 HG22 VAL A 234 1.673 5.390 -0.895 1.00 11.21 H new ATOM 0 HG23 VAL A 234 1.180 5.861 0.749 1.00 11.21 H new ATOM 1124 N ASN A 235 3.178 8.705 0.032 1.00 24.40 N ATOM 1125 CA ASN A 235 4.192 8.840 1.064 1.00 41.13 C ATOM 1126 C ASN A 235 4.224 7.567 1.913 1.00 73.40 C ATOM 1127 O ASN A 235 4.410 7.631 3.126 1.00 24.23 O ATOM 1128 CB ASN A 235 3.883 10.017 1.989 1.00 2.53 C ATOM 1129 CG ASN A 235 4.267 11.346 1.334 1.00 23.24 C ATOM 1130 OD1 ASN A 235 4.992 11.397 0.355 1.00 50.30 O ATOM 1131 ND2 ASN A 235 3.741 12.413 1.928 1.00 13.32 N ATOM 0 H ASN A 235 3.447 9.070 -0.882 1.00 24.40 H new ATOM 0 HA ASN A 235 5.151 9.009 0.574 1.00 41.13 H new ATOM 0 HB2 ASN A 235 2.821 10.022 2.234 1.00 2.53 H new ATOM 0 HB3 ASN A 235 4.426 9.899 2.927 1.00 2.53 H new ATOM 0 HD21 ASN A 235 3.937 13.346 1.566 1.00 13.32 H new ATOM 0 HD22 ASN A 235 3.141 12.298 2.745 1.00 13.32 H new ATOM 1137 N LEU A 236 4.039 6.441 1.239 1.00 4.31 N ATOM 1138 CA LEU A 236 4.044 5.155 1.916 1.00 44.50 C ATOM 1139 C LEU A 236 5.475 4.808 2.334 1.00 0.44 C ATOM 1140 O LEU A 236 6.361 4.692 1.489 1.00 23.22 O ATOM 1141 CB LEU A 236 3.383 4.087 1.043 1.00 10.13 C ATOM 1142 CG LEU A 236 3.653 2.634 1.440 1.00 2.12 C ATOM 1143 CD1 LEU A 236 2.616 2.141 2.452 1.00 41.35 C ATOM 1144 CD2 LEU A 236 3.723 1.733 0.206 1.00 3.12 C ATOM 0 H LEU A 236 3.885 6.393 0.232 1.00 4.31 H new ATOM 0 HA LEU A 236 3.448 5.203 2.827 1.00 44.50 H new ATOM 0 HB2 LEU A 236 2.306 4.252 1.055 1.00 10.13 H new ATOM 0 HB3 LEU A 236 3.716 4.230 0.015 1.00 10.13 H new ATOM 0 HG LEU A 236 4.627 2.588 1.928 1.00 2.12 H new ATOM 0 HD11 LEU A 236 2.830 1.106 2.718 1.00 41.35 H new ATOM 0 HD12 LEU A 236 2.658 2.761 3.347 1.00 41.35 H new ATOM 0 HD13 LEU A 236 1.620 2.204 2.013 1.00 41.35 H new ATOM 0 HD21 LEU A 236 3.916 0.706 0.516 1.00 3.12 H new ATOM 0 HD22 LEU A 236 2.776 1.778 -0.332 1.00 3.12 H new ATOM 0 HD23 LEU A 236 4.527 2.072 -0.447 1.00 3.12 H new ATOM 1155 N PRO A 237 5.660 4.650 3.672 1.00 45.52 N ATOM 1156 CA PRO A 237 6.968 4.320 4.213 1.00 11.00 C ATOM 1157 C PRO A 237 7.312 2.851 3.956 1.00 10.13 C ATOM 1158 O PRO A 237 6.448 2.066 3.568 1.00 0.32 O ATOM 1159 CB PRO A 237 6.880 4.660 5.691 1.00 13.32 C ATOM 1160 CG PRO A 237 5.397 4.729 6.016 1.00 22.43 C ATOM 1161 CD PRO A 237 4.634 4.781 4.703 1.00 15.42 C ATOM 0 HA PRO A 237 7.774 4.879 3.737 1.00 11.00 H new ATOM 0 HB2 PRO A 237 7.377 3.902 6.296 1.00 13.32 H new ATOM 0 HB3 PRO A 237 7.371 5.610 5.903 1.00 13.32 H new ATOM 0 HG2 PRO A 237 5.093 3.860 6.600 1.00 22.43 H new ATOM 0 HG3 PRO A 237 5.179 5.610 6.619 1.00 22.43 H new ATOM 0 HD2 PRO A 237 3.902 3.976 4.638 1.00 15.42 H new ATOM 0 HD3 PRO A 237 4.087 5.718 4.600 1.00 15.42 H new ATOM 1166 N THR A 238 8.576 2.524 4.183 1.00 5.44 N ATOM 1167 CA THR A 238 9.044 1.164 3.982 1.00 73.32 C ATOM 1168 C THR A 238 8.446 0.232 5.037 1.00 20.13 C ATOM 1169 O THR A 238 7.712 0.676 5.919 1.00 11.31 O ATOM 1170 CB THR A 238 10.574 1.186 3.988 1.00 70.52 C ATOM 1171 OG1 THR A 238 10.905 2.468 3.462 1.00 3.23 O ATOM 1172 CG2 THR A 238 11.178 0.203 2.981 1.00 32.03 C ATOM 0 H THR A 238 9.290 3.178 4.504 1.00 5.44 H new ATOM 0 HA THR A 238 8.713 0.770 3.021 1.00 73.32 H new ATOM 0 HB THR A 238 10.936 0.950 4.989 1.00 70.52 H new ATOM 0 HG1 THR A 238 11.273 3.029 4.176 1.00 3.23 H new ATOM 0 HG21 THR A 238 12.266 0.259 3.026 1.00 32.03 H new ATOM 0 HG22 THR A 238 10.856 -0.810 3.223 1.00 32.03 H new ATOM 0 HG23 THR A 238 10.843 0.460 1.976 1.00 32.03 H new ATOM 1180 N VAL A 239 8.781 -1.044 4.912 1.00 10.13 N ATOM 1181 CA VAL A 239 8.286 -2.042 5.844 1.00 25.22 C ATOM 1182 C VAL A 239 8.984 -1.865 7.194 1.00 40.02 C ATOM 1183 O VAL A 239 8.327 -1.732 8.225 1.00 34.21 O ATOM 1184 CB VAL A 239 8.467 -3.443 5.256 1.00 42.12 C ATOM 1185 CG1 VAL A 239 9.951 -3.783 5.098 1.00 32.12 C ATOM 1186 CG2 VAL A 239 7.753 -4.493 6.109 1.00 3.43 C ATOM 0 H VAL A 239 9.389 -1.409 4.179 1.00 10.13 H new ATOM 0 HA VAL A 239 7.217 -1.910 6.012 1.00 25.22 H new ATOM 0 HB VAL A 239 8.013 -3.451 4.265 1.00 42.12 H new ATOM 0 HG11 VAL A 239 10.052 -4.784 4.678 1.00 32.12 H new ATOM 0 HG12 VAL A 239 10.421 -3.060 4.431 1.00 32.12 H new ATOM 0 HG13 VAL A 239 10.438 -3.747 6.072 1.00 32.12 H new ATOM 0 HG21 VAL A 239 7.898 -5.479 5.668 1.00 3.43 H new ATOM 0 HG22 VAL A 239 8.164 -4.482 7.118 1.00 3.43 H new ATOM 0 HG23 VAL A 239 6.688 -4.266 6.149 1.00 3.43 H new ATOM 1196 N GLN A 240 10.309 -1.870 7.144 1.00 12.12 N ATOM 1197 CA GLN A 240 11.104 -1.711 8.350 1.00 72.51 C ATOM 1198 C GLN A 240 10.950 -0.293 8.904 1.00 3.03 C ATOM 1199 O GLN A 240 11.311 -0.029 10.049 1.00 61.13 O ATOM 1200 CB GLN A 240 12.575 -2.039 8.083 1.00 30.35 C ATOM 1201 CG GLN A 240 13.158 -1.112 7.015 1.00 61.21 C ATOM 1202 CD GLN A 240 13.184 -1.798 5.648 1.00 52.34 C ATOM 1203 OE1 GLN A 240 12.516 -2.790 5.410 1.00 34.31 O ATOM 1204 NE2 GLN A 240 13.992 -1.215 4.766 1.00 13.25 N ATOM 0 H GLN A 240 10.851 -1.982 6.287 1.00 12.12 H new ATOM 0 HA GLN A 240 10.739 -2.414 9.099 1.00 72.51 H new ATOM 0 HB2 GLN A 240 13.146 -1.941 9.006 1.00 30.35 H new ATOM 0 HB3 GLN A 240 12.667 -3.076 7.759 1.00 30.35 H new ATOM 0 HG2 GLN A 240 12.564 -0.200 6.957 1.00 61.21 H new ATOM 0 HG3 GLN A 240 14.169 -0.817 7.297 1.00 61.21 H new ATOM 0 HE21 GLN A 240 14.523 -0.386 5.031 1.00 13.25 H new ATOM 0 HE22 GLN A 240 14.080 -1.597 3.824 1.00 13.25 H new ATOM 1211 N GLU A 241 10.413 0.581 8.066 1.00 71.41 N ATOM 1212 CA GLU A 241 10.207 1.964 8.458 1.00 44.31 C ATOM 1213 C GLU A 241 8.804 2.148 9.040 1.00 62.41 C ATOM 1214 O GLU A 241 8.616 2.910 9.987 1.00 43.31 O ATOM 1215 CB GLU A 241 10.439 2.910 7.277 1.00 32.32 C ATOM 1216 CG GLU A 241 11.932 3.161 7.061 1.00 13.20 C ATOM 1217 CD GLU A 241 12.160 4.430 6.237 1.00 42.13 C ATOM 1218 OE1 GLU A 241 12.939 5.304 6.647 1.00 32.03 O ATOM 1219 OE2 GLU A 241 11.496 4.490 5.133 1.00 1.12 O ATOM 0 H GLU A 241 10.114 0.358 7.117 1.00 71.41 H new ATOM 0 HA GLU A 241 10.935 2.214 9.230 1.00 44.31 H new ATOM 0 HB2 GLU A 241 10.004 2.483 6.373 1.00 32.32 H new ATOM 0 HB3 GLU A 241 9.930 3.857 7.459 1.00 32.32 H new ATOM 0 HG2 GLU A 241 12.432 3.254 8.025 1.00 13.20 H new ATOM 0 HG3 GLU A 241 12.378 2.307 6.552 1.00 13.20 H new ATOM 1225 N TRP A 242 7.855 1.437 8.450 1.00 71.52 N ATOM 1226 CA TRP A 242 6.475 1.511 8.898 1.00 41.33 C ATOM 1227 C TRP A 242 6.336 0.639 10.147 1.00 53.51 C ATOM 1228 O TRP A 242 5.971 1.131 11.214 1.00 32.21 O ATOM 1229 CB TRP A 242 5.513 1.110 7.778 1.00 12.01 C ATOM 1230 CG TRP A 242 4.137 0.657 8.272 1.00 43.31 C ATOM 1231 CD1 TRP A 242 3.395 1.192 9.251 1.00 24.32 C ATOM 1232 CD2 TRP A 242 3.365 -0.453 7.767 1.00 43.44 C ATOM 1233 NE1 TRP A 242 2.207 0.510 9.414 1.00 22.05 N ATOM 1234 CE2 TRP A 242 2.188 -0.521 8.483 1.00 2.15 C ATOM 1235 CE3 TRP A 242 3.653 -1.369 6.740 1.00 53.11 C ATOM 1236 CZ2 TRP A 242 1.203 -1.489 8.248 1.00 42.33 C ATOM 1237 CZ3 TRP A 242 2.659 -2.330 6.519 1.00 13.02 C ATOM 1238 CH2 TRP A 242 1.468 -2.412 7.230 1.00 71.44 C ATOM 0 H TRP A 242 8.015 0.806 7.665 1.00 71.52 H new ATOM 0 HA TRP A 242 6.208 2.535 9.158 1.00 41.33 H new ATOM 0 HB2 TRP A 242 5.385 1.956 7.103 1.00 12.01 H new ATOM 0 HB3 TRP A 242 5.963 0.304 7.198 1.00 12.01 H new ATOM 0 HD1 TRP A 242 3.690 2.049 9.838 1.00 24.32 H new ATOM 0 HE1 TRP A 242 1.477 0.723 10.093 1.00 22.05 H new ATOM 0 HE3 TRP A 242 4.568 -1.334 6.167 1.00 53.11 H new ATOM 0 HZ2 TRP A 242 0.288 -1.521 8.822 1.00 42.33 H new ATOM 0 HZ3 TRP A 242 2.830 -3.059 5.741 1.00 13.02 H new ATOM 0 HH2 TRP A 242 0.750 -3.185 6.998 1.00 71.44 H new ATOM 1248 N LYS A 243 6.634 -0.640 9.972 1.00 1.40 N ATOM 1249 CA LYS A 243 6.547 -1.585 11.073 1.00 35.03 C ATOM 1250 C LYS A 243 7.391 -1.079 12.243 1.00 42.42 C ATOM 1251 O LYS A 243 7.192 -1.494 13.384 1.00 33.33 O ATOM 1252 CB LYS A 243 6.926 -2.991 10.602 1.00 42.32 C ATOM 1253 CG LYS A 243 5.892 -3.539 9.618 1.00 1.42 C ATOM 1254 CD LYS A 243 5.933 -5.067 9.572 1.00 64.20 C ATOM 1255 CE LYS A 243 7.373 -5.579 9.652 1.00 30.12 C ATOM 1256 NZ LYS A 243 7.767 -5.801 11.061 1.00 34.41 N ATOM 0 H LYS A 243 6.936 -1.044 9.085 1.00 1.40 H new ATOM 0 HA LYS A 243 5.520 -1.660 11.431 1.00 35.03 H new ATOM 0 HB2 LYS A 243 7.907 -2.967 10.128 1.00 42.32 H new ATOM 0 HB3 LYS A 243 7.004 -3.657 11.461 1.00 42.32 H new ATOM 0 HG2 LYS A 243 4.896 -3.207 9.910 1.00 1.42 H new ATOM 0 HG3 LYS A 243 6.083 -3.137 8.623 1.00 1.42 H new ATOM 0 HD2 LYS A 243 5.352 -5.475 10.399 1.00 64.20 H new ATOM 0 HD3 LYS A 243 5.468 -5.419 8.651 1.00 64.20 H new ATOM 0 HE2 LYS A 243 7.466 -6.509 9.091 1.00 30.12 H new ATOM 0 HE3 LYS A 243 8.047 -4.859 9.189 1.00 30.12 H new ATOM 0 HZ1 LYS A 243 8.529 -5.141 11.316 1.00 34.41 H new ATOM 0 HZ2 LYS A 243 6.947 -5.640 11.680 1.00 34.41 H new ATOM 0 HZ3 LYS A 243 8.102 -6.779 11.178 1.00 34.41 H new ATOM 1265 N SER A 244 8.318 -0.188 11.920 1.00 44.52 N ATOM 1266 CA SER A 244 9.194 0.380 12.931 1.00 65.53 C ATOM 1267 C SER A 244 8.405 0.654 14.214 1.00 70.00 C ATOM 1268 O SER A 244 8.625 0.000 15.233 1.00 1.03 O ATOM 1269 CB SER A 244 9.853 1.666 12.429 1.00 20.30 C ATOM 1270 OG SER A 244 10.857 2.136 13.324 1.00 42.33 O ATOM 0 H SER A 244 8.481 0.154 10.973 1.00 44.52 H new ATOM 0 HA SER A 244 9.983 -0.342 13.144 1.00 65.53 H new ATOM 0 HB2 SER A 244 10.296 1.488 11.449 1.00 20.30 H new ATOM 0 HB3 SER A 244 9.093 2.436 12.300 1.00 20.30 H new ATOM 0 HG SER A 244 11.255 2.957 12.967 1.00 42.33 H new ATOM 1577 N PHE B 470 10.988 -8.464 8.541 1.00 5.13 N ATOM 1578 CA PHE B 470 10.132 -8.870 7.440 1.00 0.22 C ATOM 1579 C PHE B 470 10.791 -8.571 6.093 1.00 40.32 C ATOM 1580 O PHE B 470 10.105 -8.317 5.104 1.00 72.45 O ATOM 1581 CB PHE B 470 8.841 -8.056 7.554 1.00 25.41 C ATOM 1582 CG PHE B 470 7.722 -8.769 8.316 1.00 20.05 C ATOM 1583 CD1 PHE B 470 8.019 -9.790 9.165 1.00 41.42 C ATOM 1584 CD2 PHE B 470 6.429 -8.382 8.145 1.00 63.12 C ATOM 1585 CE1 PHE B 470 6.980 -10.450 9.872 1.00 72.32 C ATOM 1586 CE2 PHE B 470 5.390 -9.044 8.852 1.00 50.11 C ATOM 1587 CZ PHE B 470 5.688 -10.063 9.701 1.00 21.42 C ATOM 0 HA PHE B 470 9.944 -9.942 7.492 1.00 0.22 H new ATOM 0 HB2 PHE B 470 9.062 -7.112 8.052 1.00 25.41 H new ATOM 0 HB3 PHE B 470 8.487 -7.813 6.552 1.00 25.41 H new ATOM 0 HD1 PHE B 470 9.045 -10.098 9.301 1.00 41.42 H new ATOM 0 HD2 PHE B 470 6.193 -7.571 7.472 1.00 63.12 H new ATOM 0 HE1 PHE B 470 7.216 -11.260 10.546 1.00 72.32 H new ATOM 0 HE2 PHE B 470 4.363 -8.738 8.715 1.00 50.11 H new ATOM 0 HZ PHE B 470 4.898 -10.565 10.240 1.00 21.42 H new ATOM 1596 N ILE B 471 12.116 -8.610 6.097 1.00 22.14 N ATOM 1597 CA ILE B 471 12.876 -8.346 4.887 1.00 20.20 C ATOM 1598 C ILE B 471 13.075 -9.655 4.120 1.00 53.13 C ATOM 1599 O ILE B 471 13.360 -10.692 4.717 1.00 51.44 O ATOM 1600 CB ILE B 471 14.183 -7.625 5.223 1.00 61.42 C ATOM 1601 CG1 ILE B 471 13.954 -6.533 6.270 1.00 31.44 C ATOM 1602 CG2 ILE B 471 14.846 -7.076 3.958 1.00 73.10 C ATOM 1603 CD1 ILE B 471 12.922 -5.514 5.782 1.00 70.24 C ATOM 0 H ILE B 471 12.682 -8.820 6.919 1.00 22.14 H new ATOM 0 HA ILE B 471 12.326 -7.672 4.230 1.00 20.20 H new ATOM 0 HB ILE B 471 14.871 -8.350 5.659 1.00 61.42 H new ATOM 0 HG12 ILE B 471 13.613 -6.984 7.202 1.00 31.44 H new ATOM 0 HG13 ILE B 471 14.895 -6.028 6.486 1.00 31.44 H new ATOM 0 HG21 ILE B 471 15.773 -6.568 4.224 1.00 73.10 H new ATOM 0 HG22 ILE B 471 15.065 -7.898 3.276 1.00 73.10 H new ATOM 0 HG23 ILE B 471 14.173 -6.370 3.471 1.00 73.10 H new ATOM 0 HD11 ILE B 471 12.778 -4.749 6.545 1.00 70.24 H new ATOM 0 HD12 ILE B 471 13.277 -5.048 4.863 1.00 70.24 H new ATOM 0 HD13 ILE B 471 11.975 -6.019 5.590 1.00 70.24 H new ATOM 1614 N PRO B 472 12.913 -9.563 2.773 1.00 54.41 N ATOM 1615 CA PRO B 472 13.072 -10.726 1.918 1.00 31.23 C ATOM 1616 C PRO B 472 14.550 -11.085 1.750 1.00 31.23 C ATOM 1617 O PRO B 472 15.307 -10.340 1.129 1.00 34.23 O ATOM 1618 CB PRO B 472 12.400 -10.347 0.608 1.00 41.44 C ATOM 1619 CG PRO B 472 12.301 -8.829 0.615 1.00 32.31 C ATOM 1620 CD PRO B 472 12.575 -8.351 2.031 1.00 10.52 C ATOM 0 HA PRO B 472 12.617 -11.622 2.339 1.00 31.23 H new ATOM 0 HB2 PRO B 472 12.982 -10.697 -0.245 1.00 41.44 H new ATOM 0 HB3 PRO B 472 11.413 -10.803 0.529 1.00 41.44 H new ATOM 0 HG2 PRO B 472 13.021 -8.396 -0.080 1.00 32.31 H new ATOM 0 HG3 PRO B 472 11.311 -8.509 0.289 1.00 32.31 H new ATOM 0 HD2 PRO B 472 13.393 -7.631 2.055 1.00 10.52 H new ATOM 0 HD3 PRO B 472 11.703 -7.856 2.458 1.00 10.52 H new ATOM 1625 N SER B 473 14.916 -12.227 2.313 1.00 44.30 N ATOM 1626 CA SER B 473 16.290 -12.694 2.234 1.00 33.20 C ATOM 1627 C SER B 473 16.733 -12.768 0.772 1.00 74.45 C ATOM 1628 O SER B 473 17.832 -12.335 0.430 1.00 52.33 O ATOM 1629 CB SER B 473 16.447 -14.059 2.906 1.00 21.41 C ATOM 1630 OG SER B 473 17.776 -14.560 2.792 1.00 23.54 O ATOM 0 H SER B 473 14.285 -12.843 2.826 1.00 44.30 H new ATOM 0 HA SER B 473 16.924 -11.984 2.764 1.00 33.20 H new ATOM 0 HB2 SER B 473 16.179 -13.977 3.959 1.00 21.41 H new ATOM 0 HB3 SER B 473 15.752 -14.767 2.455 1.00 21.41 H new ATOM 0 HG SER B 473 17.836 -15.432 3.235 1.00 23.54 H new ATOM 1635 N ARG B 474 15.855 -13.321 -0.052 1.00 33.00 N ATOM 1636 CA ARG B 474 16.142 -13.457 -1.471 1.00 64.41 C ATOM 1637 C ARG B 474 15.791 -12.165 -2.210 1.00 3.43 C ATOM 1638 O ARG B 474 14.755 -11.556 -1.947 1.00 63.11 O ATOM 1639 CB ARG B 474 15.354 -14.617 -2.083 1.00 71.02 C ATOM 1640 CG ARG B 474 15.559 -14.680 -3.597 1.00 13.21 C ATOM 1641 CD ARG B 474 16.720 -15.610 -3.956 1.00 3.02 C ATOM 1642 NE ARG B 474 16.243 -17.010 -4.026 1.00 44.34 N ATOM 1643 CZ ARG B 474 16.860 -17.985 -4.727 1.00 14.33 C ATOM 1644 NH1 ARG B 474 17.984 -17.721 -5.425 1.00 51.34 N ATOM 1645 NH2 ARG B 474 16.347 -19.200 -4.720 1.00 25.34 N ATOM 0 H ARG B 474 14.945 -13.680 0.235 1.00 33.00 H new ATOM 0 HA ARG B 474 17.208 -13.661 -1.576 1.00 64.41 H new ATOM 0 HB2 ARG B 474 15.672 -15.556 -1.630 1.00 71.02 H new ATOM 0 HB3 ARG B 474 14.294 -14.498 -1.861 1.00 71.02 H new ATOM 0 HG2 ARG B 474 14.645 -15.031 -4.077 1.00 13.21 H new ATOM 0 HG3 ARG B 474 15.757 -13.680 -3.982 1.00 13.21 H new ATOM 0 HD2 ARG B 474 17.150 -15.315 -4.913 1.00 3.02 H new ATOM 0 HD3 ARG B 474 17.511 -15.523 -3.211 1.00 3.02 H new ATOM 0 HE ARG B 474 15.396 -17.253 -3.513 1.00 44.34 H new ATOM 0 HH11 ARG B 474 18.374 -16.779 -5.426 1.00 51.34 H new ATOM 0 HH12 ARG B 474 18.444 -18.464 -5.952 1.00 51.34 H new ATOM 0 HH21 ARG B 474 15.497 -19.391 -4.190 1.00 25.34 H new ATOM 0 HH22 ARG B 474 16.801 -19.948 -5.244 1.00 25.34 H new ATOM 1655 N PRO B 475 16.697 -11.773 -3.145 1.00 35.13 N ATOM 1656 CA PRO B 475 16.493 -10.564 -3.925 1.00 44.40 C ATOM 1657 C PRO B 475 15.425 -10.778 -5.000 1.00 3.21 C ATOM 1658 O PRO B 475 14.737 -11.798 -5.001 1.00 13.30 O ATOM 1659 CB PRO B 475 17.859 -10.233 -4.503 1.00 21.40 C ATOM 1660 CG PRO B 475 18.672 -11.515 -4.411 1.00 25.15 C ATOM 1661 CD PRO B 475 17.936 -12.468 -3.484 1.00 31.25 C ATOM 0 HA PRO B 475 16.118 -9.735 -3.325 1.00 44.40 H new ATOM 0 HB2 PRO B 475 17.775 -9.897 -5.537 1.00 21.40 H new ATOM 0 HB3 PRO B 475 18.335 -9.428 -3.944 1.00 21.40 H new ATOM 0 HG2 PRO B 475 18.794 -11.961 -5.398 1.00 25.15 H new ATOM 0 HG3 PRO B 475 19.671 -11.307 -4.029 1.00 25.15 H new ATOM 0 HD2 PRO B 475 17.734 -13.420 -3.974 1.00 31.25 H new ATOM 0 HD3 PRO B 475 18.524 -12.686 -2.593 1.00 31.25 H new ATOM 1666 N ALA B 476 15.320 -9.800 -5.887 1.00 45.22 N ATOM 1667 CA ALA B 476 14.347 -9.868 -6.964 1.00 71.23 C ATOM 1668 C ALA B 476 14.439 -11.236 -7.642 1.00 73.42 C ATOM 1669 O ALA B 476 15.509 -11.638 -8.095 1.00 41.22 O ATOM 1670 CB ALA B 476 14.586 -8.715 -7.941 1.00 74.34 C ATOM 0 H ALA B 476 15.893 -8.956 -5.882 1.00 45.22 H new ATOM 0 HA ALA B 476 13.335 -9.761 -6.575 1.00 71.23 H new ATOM 0 HB1 ALA B 476 13.856 -8.766 -8.749 1.00 74.34 H new ATOM 0 HB2 ALA B 476 14.481 -7.766 -7.416 1.00 74.34 H new ATOM 0 HB3 ALA B 476 15.592 -8.791 -8.355 1.00 74.34 H new ATOM 1676 N PRO B 477 13.272 -11.933 -7.692 1.00 0.25 N ATOM 1677 CA PRO B 477 13.210 -13.247 -8.308 1.00 4.23 C ATOM 1678 C PRO B 477 13.253 -13.141 -9.833 1.00 72.31 C ATOM 1679 O PRO B 477 13.647 -12.111 -10.377 1.00 2.44 O ATOM 1680 CB PRO B 477 11.920 -13.864 -7.790 1.00 55.40 C ATOM 1681 CG PRO B 477 11.080 -12.704 -7.279 1.00 60.51 C ATOM 1682 CD PRO B 477 11.985 -11.488 -7.166 1.00 13.33 C ATOM 0 HA PRO B 477 14.065 -13.872 -8.052 1.00 4.23 H new ATOM 0 HB2 PRO B 477 11.400 -14.404 -8.581 1.00 55.40 H new ATOM 0 HB3 PRO B 477 12.122 -14.581 -6.994 1.00 55.40 H new ATOM 0 HG2 PRO B 477 10.253 -12.502 -7.960 1.00 60.51 H new ATOM 0 HG3 PRO B 477 10.643 -12.946 -6.310 1.00 60.51 H new ATOM 0 HD2 PRO B 477 11.592 -10.648 -7.739 1.00 13.33 H new ATOM 0 HD3 PRO B 477 12.074 -11.155 -6.132 1.00 13.33 H new ATOM 1687 N LYS B 478 12.841 -14.222 -10.481 1.00 55.14 N ATOM 1688 CA LYS B 478 12.827 -14.263 -11.933 1.00 54.33 C ATOM 1689 C LYS B 478 11.497 -14.850 -12.410 1.00 4.03 C ATOM 1690 O LYS B 478 11.373 -16.062 -12.575 1.00 55.03 O ATOM 1691 CB LYS B 478 14.053 -15.011 -12.460 1.00 71.52 C ATOM 1692 CG LYS B 478 14.189 -16.380 -11.791 1.00 24.42 C ATOM 1693 CD LYS B 478 14.992 -16.279 -10.492 1.00 70.41 C ATOM 1694 CE LYS B 478 14.558 -17.355 -9.495 1.00 40.13 C ATOM 1695 NZ LYS B 478 14.755 -18.705 -10.071 1.00 63.13 N ATOM 0 H LYS B 478 12.515 -15.075 -10.027 1.00 55.14 H new ATOM 0 HA LYS B 478 12.896 -13.255 -12.343 1.00 54.33 H new ATOM 0 HB2 LYS B 478 13.971 -15.136 -13.540 1.00 71.52 H new ATOM 0 HB3 LYS B 478 14.951 -14.421 -12.275 1.00 71.52 H new ATOM 0 HG2 LYS B 478 13.199 -16.786 -11.580 1.00 24.42 H new ATOM 0 HG3 LYS B 478 14.680 -17.075 -12.473 1.00 24.42 H new ATOM 0 HD2 LYS B 478 16.055 -16.386 -10.708 1.00 70.41 H new ATOM 0 HD3 LYS B 478 14.854 -15.292 -10.051 1.00 70.41 H new ATOM 0 HE2 LYS B 478 15.133 -17.259 -8.574 1.00 40.13 H new ATOM 0 HE3 LYS B 478 13.509 -17.214 -9.233 1.00 40.13 H new ATOM 0 HZ1 LYS B 478 14.652 -19.420 -9.323 1.00 63.13 H new ATOM 0 HZ2 LYS B 478 14.044 -18.874 -10.811 1.00 63.13 H new ATOM 0 HZ3 LYS B 478 15.707 -18.771 -10.484 1.00 63.13 H new ATOM 1704 N PRO B 479 10.510 -13.938 -12.622 1.00 73.22 N ATOM 1705 CA PRO B 479 9.193 -14.354 -13.076 1.00 41.25 C ATOM 1706 C PRO B 479 9.217 -14.725 -14.560 1.00 33.31 C ATOM 1707 O PRO B 479 10.140 -14.352 -15.283 1.00 63.21 O ATOM 1708 CB PRO B 479 8.283 -13.174 -12.773 1.00 20.22 C ATOM 1709 CG PRO B 479 9.200 -11.976 -12.591 1.00 21.21 C ATOM 1710 CD PRO B 479 10.620 -12.495 -12.435 1.00 14.21 C ATOM 0 HA PRO B 479 8.838 -15.254 -12.573 1.00 41.25 H new ATOM 0 HB2 PRO B 479 7.578 -13.006 -13.587 1.00 20.22 H new ATOM 0 HB3 PRO B 479 7.695 -13.356 -11.874 1.00 20.22 H new ATOM 0 HG2 PRO B 479 9.130 -11.308 -13.449 1.00 21.21 H new ATOM 0 HG3 PRO B 479 8.906 -11.400 -11.714 1.00 21.21 H new ATOM 0 HD2 PRO B 479 11.288 -12.050 -13.173 1.00 14.21 H new ATOM 0 HD3 PRO B 479 11.024 -12.253 -11.452 1.00 14.21 H new ATOM 1715 N PRO B 480 8.163 -15.474 -14.981 1.00 54.34 N ATOM 1716 CA PRO B 480 8.054 -15.900 -16.367 1.00 1.11 C ATOM 1717 C PRO B 480 7.631 -14.736 -17.266 1.00 71.43 C ATOM 1718 O PRO B 480 8.478 -14.034 -17.817 1.00 24.20 O ATOM 1719 CB PRO B 480 7.044 -17.035 -16.351 1.00 62.13 C ATOM 1720 CG PRO B 480 6.281 -16.897 -15.043 1.00 63.34 C ATOM 1721 CD PRO B 480 7.052 -15.934 -14.155 1.00 5.34 C ATOM 0 HA PRO B 480 9.005 -16.237 -16.780 1.00 1.11 H new ATOM 0 HB2 PRO B 480 6.370 -16.970 -17.205 1.00 62.13 H new ATOM 0 HB3 PRO B 480 7.543 -18.002 -16.412 1.00 62.13 H new ATOM 0 HG2 PRO B 480 5.273 -16.524 -15.226 1.00 63.34 H new ATOM 0 HG3 PRO B 480 6.179 -17.867 -14.556 1.00 63.34 H new ATOM 0 HD2 PRO B 480 6.425 -15.101 -13.836 1.00 5.34 H new ATOM 0 HD3 PRO B 480 7.409 -16.428 -13.252 1.00 5.34 H new