USER MOD reduce.3.24.130724 H: found=0, std=0, add=591, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 593 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 175 TYR OH : rot 13:sc= 1.05 USER MOD Single : A 176 LYS NZ :NH3+ -134:sc= 0.517 (180deg=-0.537) USER MOD Single : A 191 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 194 TYR OH : rot 180:sc= 0 USER MOD Single : A 196 THR OG1 : rot 180:sc= 0 USER MOD Single : A 209 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.062) USER MOD Single : A 213 MET CE :methyl 155:sc= -0.275 (180deg=-1.38!) USER MOD Single : A 214 THR OG1 : rot -14:sc= 0.716 USER MOD Single : A 227 THR OG1 : rot 80:sc= 0.69 USER MOD Single : A 228 GLN : amide:sc= -0.707 K(o=-0.71,f=-8!) USER MOD Single : A 232 LYS NZ :NH3+ 152:sc= -0.684 (180deg=-1.52) USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 238 LYS NZ :NH3+ 139:sc= 0.856 (180deg=-0.0761) USER MOD Single : A 250 TYR OH : rot 180:sc= -0.306 USER MOD Single : A 256 THR OG1 : rot 150:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 169 -7.085 12.874 -0.412 1.00 21.31 N ATOM 33 CA ASP A 169 -5.647 13.158 -0.577 1.00 21.25 C ATOM 34 C ASP A 169 -5.007 11.961 -1.285 1.00 71.52 C ATOM 35 O ASP A 169 -4.724 12.000 -2.491 1.00 55.40 O ATOM 36 CB ASP A 169 -4.964 13.449 0.795 1.00 4.55 C ATOM 37 CG ASP A 169 -3.440 13.626 0.664 1.00 1.14 C ATOM 38 OD1 ASP A 169 -2.999 14.643 0.102 1.00 24.12 O ATOM 39 OD2 ASP A 169 -2.670 12.726 1.083 1.00 34.45 O ATOM 0 HA ASP A 169 -5.511 14.056 -1.180 1.00 21.25 H new ATOM 0 HB2 ASP A 169 -5.396 14.351 1.229 1.00 4.55 H new ATOM 0 HB3 ASP A 169 -5.175 12.631 1.484 1.00 4.55 H new ATOM 44 N VAL A 170 -4.780 10.901 -0.514 1.00 1.54 N ATOM 45 CA VAL A 170 -4.429 9.584 -1.026 1.00 3.22 C ATOM 46 C VAL A 170 -5.736 8.837 -1.356 1.00 25.12 C ATOM 47 O VAL A 170 -6.748 9.010 -0.652 1.00 4.22 O ATOM 48 CB VAL A 170 -3.596 8.792 0.049 1.00 63.21 C ATOM 49 CG1 VAL A 170 -2.198 9.405 0.256 1.00 34.34 C ATOM 50 CG2 VAL A 170 -4.332 8.740 1.396 1.00 11.32 C ATOM 0 H VAL A 170 -4.837 10.937 0.504 1.00 1.54 H new ATOM 0 HA VAL A 170 -3.817 9.675 -1.923 1.00 3.22 H new ATOM 0 HB VAL A 170 -3.478 7.779 -0.335 1.00 63.21 H new ATOM 0 HG11 VAL A 170 -1.656 8.829 1.006 1.00 34.34 H new ATOM 0 HG12 VAL A 170 -1.649 9.384 -0.685 1.00 34.34 H new ATOM 0 HG13 VAL A 170 -2.299 10.436 0.594 1.00 34.34 H new ATOM 0 HG21 VAL A 170 -3.731 8.186 2.118 1.00 11.32 H new ATOM 0 HG22 VAL A 170 -4.495 9.754 1.761 1.00 11.32 H new ATOM 0 HG23 VAL A 170 -5.293 8.243 1.266 1.00 11.32 H new ATOM 60 N ILE A 171 -5.731 8.052 -2.436 1.00 20.11 N ATOM 61 CA ILE A 171 -6.876 7.192 -2.775 1.00 2.30 C ATOM 62 C ILE A 171 -6.902 5.994 -1.799 1.00 15.14 C ATOM 63 O ILE A 171 -5.836 5.481 -1.409 1.00 34.33 O ATOM 64 CB ILE A 171 -6.844 6.730 -4.282 1.00 4.34 C ATOM 65 CG1 ILE A 171 -8.103 5.877 -4.638 1.00 31.41 C ATOM 66 CG2 ILE A 171 -5.545 5.971 -4.612 1.00 14.25 C ATOM 67 CD1 ILE A 171 -8.208 5.479 -6.099 1.00 41.32 C ATOM 0 H ILE A 171 -4.951 7.991 -3.091 1.00 20.11 H new ATOM 0 HA ILE A 171 -7.798 7.763 -2.664 1.00 2.30 H new ATOM 0 HB ILE A 171 -6.864 7.628 -4.900 1.00 4.34 H new ATOM 0 HG12 ILE A 171 -8.096 4.973 -4.029 1.00 31.41 H new ATOM 0 HG13 ILE A 171 -8.995 6.440 -4.364 1.00 31.41 H new ATOM 0 HG21 ILE A 171 -5.557 5.667 -5.659 1.00 14.25 H new ATOM 0 HG22 ILE A 171 -4.688 6.621 -4.432 1.00 14.25 H new ATOM 0 HG23 ILE A 171 -5.469 5.087 -3.979 1.00 14.25 H new ATOM 0 HD11 ILE A 171 -9.112 4.890 -6.252 1.00 41.32 H new ATOM 0 HD12 ILE A 171 -8.250 6.375 -6.718 1.00 41.32 H new ATOM 0 HD13 ILE A 171 -7.337 4.886 -6.378 1.00 41.32 H new ATOM 79 N ASP A 172 -8.123 5.599 -1.384 1.00 72.12 N ATOM 80 CA ASP A 172 -8.338 4.579 -0.350 1.00 53.43 C ATOM 81 C ASP A 172 -7.807 3.215 -0.808 1.00 23.01 C ATOM 82 O ASP A 172 -8.261 2.659 -1.816 1.00 14.33 O ATOM 83 CB ASP A 172 -9.839 4.495 0.032 1.00 44.33 C ATOM 84 CG ASP A 172 -10.126 3.553 1.215 1.00 21.41 C ATOM 85 OD1 ASP A 172 -9.423 3.650 2.250 1.00 2.12 O ATOM 86 OD2 ASP A 172 -11.072 2.733 1.143 1.00 73.13 O ATOM 0 H ASP A 172 -8.989 5.984 -1.762 1.00 72.12 H new ATOM 0 HA ASP A 172 -7.780 4.871 0.539 1.00 53.43 H new ATOM 0 HB2 ASP A 172 -10.198 5.494 0.279 1.00 44.33 H new ATOM 0 HB3 ASP A 172 -10.407 4.158 -0.835 1.00 44.33 H new ATOM 91 N ALA A 173 -6.830 2.706 -0.053 1.00 14.04 N ATOM 92 CA ALA A 173 -6.102 1.470 -0.366 1.00 62.13 C ATOM 93 C ALA A 173 -6.209 0.488 0.815 1.00 72.45 C ATOM 94 O ALA A 173 -6.499 0.894 1.945 1.00 14.02 O ATOM 95 CB ALA A 173 -4.641 1.827 -0.692 1.00 52.53 C ATOM 0 H ALA A 173 -6.515 3.149 0.810 1.00 14.04 H new ATOM 0 HA ALA A 173 -6.537 0.977 -1.235 1.00 62.13 H new ATOM 0 HB1 ALA A 173 -4.088 0.918 -0.927 1.00 52.53 H new ATOM 0 HB2 ALA A 173 -4.613 2.500 -1.549 1.00 52.53 H new ATOM 0 HB3 ALA A 173 -4.185 2.317 0.169 1.00 52.53 H new ATOM 101 N ASP A 174 -5.957 -0.800 0.552 1.00 3.31 N ATOM 102 CA ASP A 174 -6.058 -1.879 1.568 1.00 74.35 C ATOM 103 C ASP A 174 -5.039 -2.994 1.248 1.00 55.24 C ATOM 104 O ASP A 174 -4.488 -3.019 0.145 1.00 25.32 O ATOM 105 CB ASP A 174 -7.521 -2.408 1.592 1.00 35.10 C ATOM 106 CG ASP A 174 -7.773 -3.559 2.580 1.00 31.41 C ATOM 107 OD1 ASP A 174 -7.284 -3.501 3.729 1.00 74.14 O ATOM 108 OD2 ASP A 174 -8.467 -4.526 2.219 1.00 23.04 O ATOM 0 H ASP A 174 -5.676 -1.134 -0.370 1.00 3.31 H new ATOM 0 HA ASP A 174 -5.817 -1.498 2.561 1.00 74.35 H new ATOM 0 HB2 ASP A 174 -8.187 -1.582 1.840 1.00 35.10 H new ATOM 0 HB3 ASP A 174 -7.788 -2.743 0.590 1.00 35.10 H new ATOM 113 N TYR A 175 -4.753 -3.879 2.229 1.00 4.42 N ATOM 114 CA TYR A 175 -3.888 -5.054 2.020 1.00 62.04 C ATOM 115 C TYR A 175 -4.300 -6.206 2.949 1.00 33.21 C ATOM 116 O TYR A 175 -5.205 -6.055 3.787 1.00 30.32 O ATOM 117 CB TYR A 175 -2.378 -4.691 2.206 1.00 14.21 C ATOM 118 CG TYR A 175 -1.853 -4.563 3.650 1.00 34.52 C ATOM 119 CD1 TYR A 175 -1.673 -3.337 4.258 1.00 45.34 C ATOM 120 CD2 TYR A 175 -1.479 -5.690 4.383 1.00 74.22 C ATOM 121 CE1 TYR A 175 -1.154 -3.242 5.529 1.00 0.41 C ATOM 122 CE2 TYR A 175 -0.979 -5.604 5.655 1.00 1.43 C ATOM 123 CZ TYR A 175 -0.807 -4.382 6.225 1.00 62.11 C ATOM 124 OH TYR A 175 -0.281 -4.296 7.504 1.00 31.44 O ATOM 0 H TYR A 175 -5.114 -3.797 3.180 1.00 4.42 H new ATOM 0 HA TYR A 175 -4.019 -5.386 0.990 1.00 62.04 H new ATOM 0 HB2 TYR A 175 -1.784 -5.450 1.697 1.00 14.21 H new ATOM 0 HB3 TYR A 175 -2.193 -3.746 1.695 1.00 14.21 H new ATOM 0 HD1 TYR A 175 -1.944 -2.437 3.727 1.00 45.34 H new ATOM 0 HD2 TYR A 175 -1.588 -6.665 3.931 1.00 74.22 H new ATOM 0 HE1 TYR A 175 -1.018 -2.272 5.983 1.00 0.41 H new ATOM 0 HE2 TYR A 175 -0.723 -6.500 6.201 1.00 1.43 H new ATOM 0 HH TYR A 175 -0.408 -3.388 7.850 1.00 31.44 H new ATOM 134 N LYS A 176 -3.576 -7.346 2.812 1.00 61.31 N ATOM 135 CA LYS A 176 -3.722 -8.548 3.669 1.00 4.14 C ATOM 136 C LYS A 176 -2.323 -9.155 3.928 1.00 34.43 C ATOM 137 O LYS A 176 -1.549 -9.314 2.977 1.00 41.44 O ATOM 138 CB LYS A 176 -4.661 -9.609 3.018 1.00 64.31 C ATOM 139 CG LYS A 176 -6.136 -9.169 2.899 1.00 21.20 C ATOM 140 CD LYS A 176 -6.804 -8.952 4.283 1.00 62.23 C ATOM 141 CE LYS A 176 -8.161 -8.239 4.184 1.00 65.32 C ATOM 142 NZ LYS A 176 -8.015 -6.859 3.649 1.00 75.04 N ATOM 0 H LYS A 176 -2.863 -7.456 2.091 1.00 61.31 H new ATOM 0 HA LYS A 176 -4.179 -8.249 4.612 1.00 4.14 H new ATOM 0 HB2 LYS A 176 -4.285 -9.848 2.023 1.00 64.31 H new ATOM 0 HB3 LYS A 176 -4.615 -10.526 3.605 1.00 64.31 H new ATOM 0 HG2 LYS A 176 -6.191 -8.245 2.324 1.00 21.20 H new ATOM 0 HG3 LYS A 176 -6.693 -9.924 2.344 1.00 21.20 H new ATOM 0 HD2 LYS A 176 -6.941 -9.917 4.771 1.00 62.23 H new ATOM 0 HD3 LYS A 176 -6.137 -8.367 4.916 1.00 62.23 H new ATOM 0 HE2 LYS A 176 -8.828 -8.812 3.539 1.00 65.32 H new ATOM 0 HE3 LYS A 176 -8.626 -8.201 5.169 1.00 65.32 H new ATOM 0 HZ1 LYS A 176 -8.573 -6.201 4.230 1.00 75.04 H new ATOM 0 HZ2 LYS A 176 -7.013 -6.581 3.675 1.00 75.04 H new ATOM 0 HZ3 LYS A 176 -8.357 -6.829 2.667 1.00 75.04 H new ATOM 156 N PRO A 177 -1.973 -9.495 5.223 1.00 70.12 N ATOM 157 CA PRO A 177 -0.635 -10.035 5.584 1.00 31.11 C ATOM 158 C PRO A 177 -0.405 -11.447 4.994 1.00 33.31 C ATOM 159 O PRO A 177 -0.991 -12.438 5.458 1.00 32.13 O ATOM 160 CB PRO A 177 -0.653 -10.050 7.138 1.00 70.14 C ATOM 161 CG PRO A 177 -2.107 -10.152 7.506 1.00 21.02 C ATOM 162 CD PRO A 177 -2.853 -9.383 6.428 1.00 12.42 C ATOM 0 HA PRO A 177 0.182 -9.436 5.181 1.00 31.11 H new ATOM 0 HB2 PRO A 177 -0.086 -10.893 7.532 1.00 70.14 H new ATOM 0 HB3 PRO A 177 -0.204 -9.145 7.547 1.00 70.14 H new ATOM 0 HG2 PRO A 177 -2.431 -11.192 7.542 1.00 21.02 H new ATOM 0 HG3 PRO A 177 -2.293 -9.726 8.492 1.00 21.02 H new ATOM 0 HD2 PRO A 177 -3.838 -9.811 6.243 1.00 12.42 H new ATOM 0 HD3 PRO A 177 -3.006 -8.342 6.714 1.00 12.42 H new ATOM 170 N ALA A 178 0.424 -11.513 3.948 1.00 20.34 N ATOM 171 CA ALA A 178 0.791 -12.770 3.284 1.00 13.20 C ATOM 172 C ALA A 178 1.838 -13.506 4.136 1.00 50.15 C ATOM 173 O ALA A 178 3.040 -13.303 3.960 1.00 50.02 O ATOM 174 CB ALA A 178 1.297 -12.483 1.860 1.00 4.13 C ATOM 0 H ALA A 178 0.863 -10.691 3.534 1.00 20.34 H new ATOM 0 HA ALA A 178 -0.081 -13.417 3.191 1.00 13.20 H new ATOM 0 HB1 ALA A 178 1.567 -13.421 1.374 1.00 4.13 H new ATOM 0 HB2 ALA A 178 0.511 -11.991 1.287 1.00 4.13 H new ATOM 0 HB3 ALA A 178 2.172 -11.834 1.908 1.00 4.13 H new ATOM 285 N GLN A 191 3.767 4.115 14.696 1.00 31.21 N ATOM 286 CA GLN A 191 2.408 3.668 14.292 1.00 4.31 C ATOM 287 C GLN A 191 2.264 3.714 12.764 1.00 11.31 C ATOM 288 O GLN A 191 1.720 2.798 12.134 1.00 20.14 O ATOM 289 CB GLN A 191 1.319 4.552 14.950 1.00 12.34 C ATOM 290 CG GLN A 191 1.326 4.552 16.492 1.00 32.14 C ATOM 291 CD GLN A 191 0.330 5.551 17.092 1.00 34.01 C ATOM 292 OE1 GLN A 191 -0.711 5.843 16.498 1.00 20.04 O ATOM 293 NE2 GLN A 191 0.634 6.095 18.259 1.00 24.12 N ATOM 0 HA GLN A 191 2.274 2.641 14.632 1.00 4.31 H new ATOM 0 HB2 GLN A 191 1.444 5.577 14.601 1.00 12.34 H new ATOM 0 HB3 GLN A 191 0.341 4.215 14.606 1.00 12.34 H new ATOM 0 HG2 GLN A 191 1.090 3.550 16.852 1.00 32.14 H new ATOM 0 HG3 GLN A 191 2.329 4.789 16.846 1.00 32.14 H new ATOM 0 HE21 GLN A 191 1.501 5.838 18.731 1.00 24.12 H new ATOM 0 HE22 GLN A 191 0.002 6.772 18.686 1.00 24.12 H new ATOM 302 N ASP A 192 2.750 4.815 12.193 1.00 53.13 N ATOM 303 CA ASP A 192 2.887 4.977 10.745 1.00 14.44 C ATOM 304 C ASP A 192 4.245 4.441 10.280 1.00 55.32 C ATOM 305 O ASP A 192 5.234 4.520 11.016 1.00 61.31 O ATOM 306 CB ASP A 192 2.700 6.458 10.330 1.00 54.40 C ATOM 307 CG ASP A 192 3.552 7.448 11.135 1.00 22.32 C ATOM 308 OD1 ASP A 192 4.648 7.834 10.682 1.00 44.32 O ATOM 309 OD2 ASP A 192 3.126 7.835 12.249 1.00 11.15 O ATOM 0 H ASP A 192 3.062 5.627 12.726 1.00 53.13 H new ATOM 0 HA ASP A 192 2.103 4.399 10.257 1.00 14.44 H new ATOM 0 HB2 ASP A 192 2.944 6.561 9.273 1.00 54.40 H new ATOM 0 HB3 ASP A 192 1.649 6.725 10.442 1.00 54.40 H new ATOM 314 N LEU A 193 4.268 3.863 9.068 1.00 41.20 N ATOM 315 CA LEU A 193 5.509 3.437 8.386 1.00 63.45 C ATOM 316 C LEU A 193 5.541 4.049 6.985 1.00 30.44 C ATOM 317 O LEU A 193 4.509 4.120 6.316 1.00 45.12 O ATOM 318 CB LEU A 193 5.619 1.883 8.289 1.00 22.00 C ATOM 319 CG LEU A 193 5.871 1.107 9.619 1.00 2.24 C ATOM 320 CD1 LEU A 193 5.945 -0.410 9.355 1.00 34.21 C ATOM 321 CD2 LEU A 193 7.153 1.596 10.319 1.00 1.01 C ATOM 0 H LEU A 193 3.423 3.675 8.528 1.00 41.20 H new ATOM 0 HA LEU A 193 6.358 3.786 8.973 1.00 63.45 H new ATOM 0 HB2 LEU A 193 4.698 1.505 7.845 1.00 22.00 H new ATOM 0 HB3 LEU A 193 6.427 1.643 7.598 1.00 22.00 H new ATOM 0 HG LEU A 193 5.031 1.305 10.284 1.00 2.24 H new ATOM 0 HD11 LEU A 193 6.121 -0.935 10.294 1.00 34.21 H new ATOM 0 HD12 LEU A 193 5.005 -0.750 8.920 1.00 34.21 H new ATOM 0 HD13 LEU A 193 6.761 -0.620 8.664 1.00 34.21 H new ATOM 0 HD21 LEU A 193 7.300 1.035 11.242 1.00 1.01 H new ATOM 0 HD22 LEU A 193 8.008 1.442 9.661 1.00 1.01 H new ATOM 0 HD23 LEU A 193 7.059 2.657 10.550 1.00 1.01 H new ATOM 333 N TYR A 194 6.726 4.492 6.554 1.00 41.41 N ATOM 334 CA TYR A 194 6.937 5.026 5.201 1.00 64.40 C ATOM 335 C TYR A 194 7.732 4.004 4.382 1.00 14.31 C ATOM 336 O TYR A 194 8.862 3.651 4.746 1.00 42.13 O ATOM 337 CB TYR A 194 7.679 6.387 5.268 1.00 75.32 C ATOM 338 CG TYR A 194 6.804 7.543 5.788 1.00 10.41 C ATOM 339 CD1 TYR A 194 6.560 7.711 7.152 1.00 22.20 C ATOM 340 CD2 TYR A 194 6.215 8.457 4.910 1.00 43.25 C ATOM 341 CE1 TYR A 194 5.763 8.739 7.619 1.00 23.34 C ATOM 342 CE2 TYR A 194 5.423 9.487 5.375 1.00 74.23 C ATOM 343 CZ TYR A 194 5.198 9.625 6.729 1.00 5.21 C ATOM 344 OH TYR A 194 4.397 10.655 7.187 1.00 14.11 O ATOM 0 H TYR A 194 7.567 4.491 7.131 1.00 41.41 H new ATOM 0 HA TYR A 194 5.975 5.199 4.718 1.00 64.40 H new ATOM 0 HB2 TYR A 194 8.551 6.284 5.914 1.00 75.32 H new ATOM 0 HB3 TYR A 194 8.047 6.640 4.274 1.00 75.32 H new ATOM 0 HD1 TYR A 194 7.003 7.023 7.857 1.00 22.20 H new ATOM 0 HD2 TYR A 194 6.383 8.355 3.848 1.00 43.25 H new ATOM 0 HE1 TYR A 194 5.584 8.847 8.679 1.00 23.34 H new ATOM 0 HE2 TYR A 194 4.980 10.184 4.680 1.00 74.23 H new ATOM 0 HH TYR A 194 4.081 11.187 6.427 1.00 14.11 H new ATOM 354 N ALA A 195 7.140 3.554 3.273 1.00 43.55 N ATOM 355 CA ALA A 195 7.722 2.534 2.392 1.00 71.34 C ATOM 356 C ALA A 195 7.377 2.861 0.935 1.00 74.35 C ATOM 357 O ALA A 195 6.464 3.645 0.663 1.00 43.15 O ATOM 358 CB ALA A 195 7.230 1.129 2.796 1.00 35.14 C ATOM 0 H ALA A 195 6.231 3.891 2.956 1.00 43.55 H new ATOM 0 HA ALA A 195 8.807 2.537 2.494 1.00 71.34 H new ATOM 0 HB1 ALA A 195 7.671 0.385 2.133 1.00 35.14 H new ATOM 0 HB2 ALA A 195 7.527 0.921 3.824 1.00 35.14 H new ATOM 0 HB3 ALA A 195 6.144 1.087 2.717 1.00 35.14 H new ATOM 364 N THR A 196 8.126 2.271 -0.005 1.00 23.42 N ATOM 365 CA THR A 196 7.948 2.513 -1.446 1.00 22.23 C ATOM 366 C THR A 196 7.435 1.220 -2.115 1.00 25.05 C ATOM 367 O THR A 196 7.873 0.120 -1.756 1.00 4.14 O ATOM 368 CB THR A 196 9.299 2.992 -2.084 1.00 21.32 C ATOM 369 OG1 THR A 196 9.980 3.892 -1.185 1.00 74.54 O ATOM 370 CG2 THR A 196 9.073 3.718 -3.411 1.00 3.12 C ATOM 0 H THR A 196 8.874 1.611 0.210 1.00 23.42 H new ATOM 0 HA THR A 196 7.212 3.302 -1.603 1.00 22.23 H new ATOM 0 HB THR A 196 9.901 2.102 -2.266 1.00 21.32 H new ATOM 0 HG1 THR A 196 10.823 4.184 -1.591 1.00 74.54 H new ATOM 0 HG21 THR A 196 10.032 4.034 -3.821 1.00 3.12 H new ATOM 0 HG22 THR A 196 8.581 3.046 -4.114 1.00 3.12 H new ATOM 0 HG23 THR A 196 8.444 4.592 -3.245 1.00 3.12 H new ATOM 378 N LEU A 197 6.512 1.358 -3.085 1.00 64.11 N ATOM 379 CA LEU A 197 5.754 0.225 -3.648 1.00 34.42 C ATOM 380 C LEU A 197 6.132 -0.016 -5.119 1.00 11.30 C ATOM 381 O LEU A 197 5.956 0.870 -5.962 1.00 21.32 O ATOM 382 CB LEU A 197 4.227 0.508 -3.534 1.00 40.23 C ATOM 383 CG LEU A 197 3.284 -0.672 -3.939 1.00 42.10 C ATOM 384 CD1 LEU A 197 3.545 -1.906 -3.053 1.00 52.14 C ATOM 385 CD2 LEU A 197 1.802 -0.244 -3.888 1.00 74.25 C ATOM 0 H LEU A 197 6.271 2.258 -3.500 1.00 64.11 H new ATOM 0 HA LEU A 197 6.004 -0.672 -3.081 1.00 34.42 H new ATOM 0 HB2 LEU A 197 4.005 0.789 -2.505 1.00 40.23 H new ATOM 0 HB3 LEU A 197 3.989 1.369 -4.158 1.00 40.23 H new ATOM 0 HG LEU A 197 3.507 -0.947 -4.970 1.00 42.10 H new ATOM 0 HD11 LEU A 197 2.879 -2.715 -3.351 1.00 52.14 H new ATOM 0 HD12 LEU A 197 4.580 -2.226 -3.171 1.00 52.14 H new ATOM 0 HD13 LEU A 197 3.361 -1.650 -2.010 1.00 52.14 H new ATOM 0 HD21 LEU A 197 1.170 -1.085 -4.175 1.00 74.25 H new ATOM 0 HD22 LEU A 197 1.549 0.072 -2.876 1.00 74.25 H new ATOM 0 HD23 LEU A 197 1.638 0.584 -4.578 1.00 74.25 H new ATOM 397 N ASP A 198 6.684 -1.207 -5.405 1.00 65.33 N ATOM 398 CA ASP A 198 6.886 -1.699 -6.780 1.00 44.13 C ATOM 399 C ASP A 198 5.570 -2.314 -7.288 1.00 11.25 C ATOM 400 O ASP A 198 5.211 -3.438 -6.901 1.00 44.24 O ATOM 401 CB ASP A 198 8.030 -2.760 -6.833 1.00 64.34 C ATOM 402 CG ASP A 198 9.418 -2.173 -6.535 1.00 4.35 C ATOM 403 OD1 ASP A 198 9.817 -2.130 -5.350 1.00 43.24 O ATOM 404 OD2 ASP A 198 10.117 -1.746 -7.481 1.00 74.32 O ATOM 0 H ASP A 198 7.004 -1.858 -4.688 1.00 65.33 H new ATOM 0 HA ASP A 198 7.177 -0.864 -7.417 1.00 44.13 H new ATOM 0 HB2 ASP A 198 7.816 -3.551 -6.114 1.00 64.34 H new ATOM 0 HB3 ASP A 198 8.043 -3.221 -7.820 1.00 64.34 H new ATOM 409 N VAL A 199 4.833 -1.555 -8.112 1.00 63.53 N ATOM 410 CA VAL A 199 3.623 -2.042 -8.796 1.00 71.02 C ATOM 411 C VAL A 199 3.868 -2.046 -10.322 1.00 42.50 C ATOM 412 O VAL A 199 4.041 -0.983 -10.912 1.00 62.54 O ATOM 413 CB VAL A 199 2.327 -1.204 -8.426 1.00 40.23 C ATOM 414 CG1 VAL A 199 2.543 0.318 -8.554 1.00 74.11 C ATOM 415 CG2 VAL A 199 1.103 -1.672 -9.263 1.00 42.01 C ATOM 0 H VAL A 199 5.059 -0.583 -8.324 1.00 63.53 H new ATOM 0 HA VAL A 199 3.429 -3.058 -8.452 1.00 71.02 H new ATOM 0 HB VAL A 199 2.118 -1.398 -7.374 1.00 40.23 H new ATOM 0 HG11 VAL A 199 1.623 0.840 -8.289 1.00 74.11 H new ATOM 0 HG12 VAL A 199 3.344 0.630 -7.883 1.00 74.11 H new ATOM 0 HG13 VAL A 199 2.815 0.562 -9.581 1.00 74.11 H new ATOM 0 HG21 VAL A 199 0.228 -1.082 -8.990 1.00 42.01 H new ATOM 0 HG22 VAL A 199 1.315 -1.538 -10.324 1.00 42.01 H new ATOM 0 HG23 VAL A 199 0.907 -2.725 -9.063 1.00 42.01 H new ATOM 425 N PRO A 200 3.925 -3.256 -10.979 1.00 52.24 N ATOM 426 CA PRO A 200 4.055 -3.379 -12.451 1.00 32.04 C ATOM 427 C PRO A 200 2.971 -2.599 -13.219 1.00 31.13 C ATOM 428 O PRO A 200 1.825 -2.507 -12.753 1.00 44.52 O ATOM 429 CB PRO A 200 3.922 -4.902 -12.696 1.00 23.30 C ATOM 430 CG PRO A 200 4.384 -5.525 -11.415 1.00 55.15 C ATOM 431 CD PRO A 200 3.891 -4.598 -10.334 1.00 24.31 C ATOM 0 HA PRO A 200 4.994 -2.957 -12.810 1.00 32.04 H new ATOM 0 HB2 PRO A 200 2.893 -5.180 -12.925 1.00 23.30 H new ATOM 0 HB3 PRO A 200 4.534 -5.224 -13.538 1.00 23.30 H new ATOM 0 HG2 PRO A 200 3.974 -6.528 -11.293 1.00 55.15 H new ATOM 0 HG3 PRO A 200 5.470 -5.619 -11.390 1.00 55.15 H new ATOM 0 HD2 PRO A 200 2.884 -4.861 -10.009 1.00 24.31 H new ATOM 0 HD3 PRO A 200 4.530 -4.635 -9.452 1.00 24.31 H new ATOM 439 N ALA A 201 3.361 -2.063 -14.399 1.00 13.23 N ATOM 440 CA ALA A 201 2.470 -1.286 -15.295 1.00 3.23 C ATOM 441 C ALA A 201 1.107 -1.991 -15.581 1.00 25.30 C ATOM 442 O ALA A 201 0.063 -1.344 -15.400 1.00 14.30 O ATOM 443 CB ALA A 201 3.199 -0.921 -16.607 1.00 20.22 C ATOM 0 H ALA A 201 4.310 -2.158 -14.760 1.00 13.23 H new ATOM 0 HA ALA A 201 2.222 -0.368 -14.763 1.00 3.23 H new ATOM 0 HB1 ALA A 201 2.528 -0.351 -17.250 1.00 20.22 H new ATOM 0 HB2 ALA A 201 4.080 -0.320 -16.379 1.00 20.22 H new ATOM 0 HB3 ALA A 201 3.505 -1.833 -17.119 1.00 20.22 H new ATOM 449 N PRO A 202 1.066 -3.325 -15.981 1.00 22.41 N ATOM 450 CA PRO A 202 -0.223 -4.043 -16.202 1.00 34.10 C ATOM 451 C PRO A 202 -1.099 -4.096 -14.926 1.00 12.12 C ATOM 452 O PRO A 202 -2.302 -3.844 -14.997 1.00 31.33 O ATOM 453 CB PRO A 202 0.210 -5.461 -16.672 1.00 51.12 C ATOM 454 CG PRO A 202 1.626 -5.613 -16.200 1.00 61.20 C ATOM 455 CD PRO A 202 2.227 -4.231 -16.288 1.00 54.44 C ATOM 0 HA PRO A 202 -0.852 -3.536 -16.933 1.00 34.10 H new ATOM 0 HB2 PRO A 202 -0.433 -6.231 -16.245 1.00 51.12 H new ATOM 0 HB3 PRO A 202 0.143 -5.555 -17.756 1.00 51.12 H new ATOM 0 HG2 PRO A 202 1.661 -5.993 -15.179 1.00 61.20 H new ATOM 0 HG3 PRO A 202 2.174 -6.320 -16.822 1.00 61.20 H new ATOM 0 HD2 PRO A 202 3.039 -4.100 -15.573 1.00 54.44 H new ATOM 0 HD3 PRO A 202 2.639 -4.034 -17.278 1.00 54.44 H new ATOM 463 N ILE A 203 -0.462 -4.361 -13.761 1.00 31.31 N ATOM 464 CA ILE A 203 -1.157 -4.507 -12.462 1.00 1.44 C ATOM 465 C ILE A 203 -1.689 -3.140 -11.962 1.00 61.31 C ATOM 466 O ILE A 203 -2.694 -3.080 -11.240 1.00 33.21 O ATOM 467 CB ILE A 203 -0.222 -5.179 -11.379 1.00 22.34 C ATOM 468 CG1 ILE A 203 0.295 -6.563 -11.903 1.00 0.32 C ATOM 469 CG2 ILE A 203 -0.944 -5.334 -10.010 1.00 54.22 C ATOM 470 CD1 ILE A 203 1.148 -7.354 -10.924 1.00 62.15 C ATOM 0 H ILE A 203 0.549 -4.479 -13.696 1.00 31.31 H new ATOM 0 HA ILE A 203 -2.010 -5.167 -12.617 1.00 1.44 H new ATOM 0 HB ILE A 203 0.633 -4.523 -11.215 1.00 22.34 H new ATOM 0 HG12 ILE A 203 -0.565 -7.171 -12.182 1.00 0.32 H new ATOM 0 HG13 ILE A 203 0.875 -6.395 -12.811 1.00 0.32 H new ATOM 0 HG21 ILE A 203 -0.268 -5.800 -9.293 1.00 54.22 H new ATOM 0 HG22 ILE A 203 -1.242 -4.352 -9.643 1.00 54.22 H new ATOM 0 HG23 ILE A 203 -1.828 -5.959 -10.134 1.00 54.22 H new ATOM 0 HD11 ILE A 203 1.453 -8.294 -11.384 1.00 62.15 H new ATOM 0 HD12 ILE A 203 2.033 -6.774 -10.661 1.00 62.15 H new ATOM 0 HD13 ILE A 203 0.570 -7.562 -10.024 1.00 62.15 H new ATOM 482 N ALA A 204 -1.020 -2.052 -12.377 1.00 33.55 N ATOM 483 CA ALA A 204 -1.451 -0.680 -12.071 1.00 35.15 C ATOM 484 C ALA A 204 -2.748 -0.336 -12.825 1.00 20.50 C ATOM 485 O ALA A 204 -3.717 0.151 -12.229 1.00 44.55 O ATOM 486 CB ALA A 204 -0.328 0.310 -12.419 1.00 52.22 C ATOM 0 H ALA A 204 -0.166 -2.100 -12.933 1.00 33.55 H new ATOM 0 HA ALA A 204 -1.660 -0.604 -11.004 1.00 35.15 H new ATOM 0 HB1 ALA A 204 -0.654 1.325 -12.190 1.00 52.22 H new ATOM 0 HB2 ALA A 204 0.560 0.073 -11.833 1.00 52.22 H new ATOM 0 HB3 ALA A 204 -0.093 0.235 -13.481 1.00 52.22 H new ATOM 492 N VAL A 205 -2.759 -0.636 -14.136 1.00 63.53 N ATOM 493 CA VAL A 205 -3.882 -0.316 -15.042 1.00 63.13 C ATOM 494 C VAL A 205 -5.133 -1.148 -14.709 1.00 0.34 C ATOM 495 O VAL A 205 -6.241 -0.607 -14.636 1.00 3.41 O ATOM 496 CB VAL A 205 -3.456 -0.538 -16.539 1.00 12.54 C ATOM 497 CG1 VAL A 205 -4.617 -0.284 -17.533 1.00 3.45 C ATOM 498 CG2 VAL A 205 -2.232 0.337 -16.884 1.00 40.31 C ATOM 0 H VAL A 205 -1.985 -1.110 -14.602 1.00 63.53 H new ATOM 0 HA VAL A 205 -4.137 0.734 -14.898 1.00 63.13 H new ATOM 0 HB VAL A 205 -3.182 -1.588 -16.644 1.00 12.54 H new ATOM 0 HG11 VAL A 205 -4.267 -0.452 -18.552 1.00 3.45 H new ATOM 0 HG12 VAL A 205 -5.439 -0.966 -17.315 1.00 3.45 H new ATOM 0 HG13 VAL A 205 -4.963 0.745 -17.433 1.00 3.45 H new ATOM 0 HG21 VAL A 205 -1.949 0.173 -17.924 1.00 40.31 H new ATOM 0 HG22 VAL A 205 -2.483 1.388 -16.738 1.00 40.31 H new ATOM 0 HG23 VAL A 205 -1.399 0.070 -16.234 1.00 40.31 H new ATOM 508 N VAL A 206 -4.947 -2.461 -14.506 1.00 11.33 N ATOM 509 CA VAL A 206 -6.065 -3.368 -14.151 1.00 23.31 C ATOM 510 C VAL A 206 -6.511 -3.155 -12.687 1.00 21.44 C ATOM 511 O VAL A 206 -7.703 -3.271 -12.370 1.00 35.23 O ATOM 512 CB VAL A 206 -5.717 -4.890 -14.394 1.00 73.55 C ATOM 513 CG1 VAL A 206 -5.256 -5.130 -15.849 1.00 34.13 C ATOM 514 CG2 VAL A 206 -4.675 -5.423 -13.383 1.00 43.12 C ATOM 0 H VAL A 206 -4.041 -2.923 -14.579 1.00 11.33 H new ATOM 0 HA VAL A 206 -6.889 -3.111 -14.817 1.00 23.31 H new ATOM 0 HB VAL A 206 -6.634 -5.455 -14.230 1.00 73.55 H new ATOM 0 HG11 VAL A 206 -5.023 -6.186 -15.987 1.00 34.13 H new ATOM 0 HG12 VAL A 206 -6.052 -4.841 -16.535 1.00 34.13 H new ATOM 0 HG13 VAL A 206 -4.367 -4.533 -16.052 1.00 34.13 H new ATOM 0 HG21 VAL A 206 -4.469 -6.473 -13.592 1.00 43.12 H new ATOM 0 HG22 VAL A 206 -3.753 -4.848 -13.473 1.00 43.12 H new ATOM 0 HG23 VAL A 206 -5.067 -5.324 -12.371 1.00 43.12 H new ATOM 524 N GLY A 207 -5.539 -2.812 -11.817 1.00 72.14 N ATOM 525 CA GLY A 207 -5.771 -2.711 -10.382 1.00 2.54 C ATOM 526 C GLY A 207 -5.888 -4.080 -9.718 1.00 3.42 C ATOM 527 O GLY A 207 -6.997 -4.546 -9.427 1.00 5.11 O ATOM 0 H GLY A 207 -4.581 -2.601 -12.098 1.00 72.14 H new ATOM 0 HA2 GLY A 207 -4.954 -2.155 -9.922 1.00 2.54 H new ATOM 0 HA3 GLY A 207 -6.684 -2.143 -10.203 1.00 2.54 H new ATOM 531 N GLY A 208 -4.737 -4.742 -9.507 1.00 21.23 N ATOM 532 CA GLY A 208 -4.691 -6.058 -8.857 1.00 63.14 C ATOM 533 C GLY A 208 -4.123 -5.966 -7.444 1.00 12.40 C ATOM 534 O GLY A 208 -4.536 -5.104 -6.669 1.00 75.50 O ATOM 0 H GLY A 208 -3.822 -4.382 -9.780 1.00 21.23 H new ATOM 0 HA2 GLY A 208 -5.695 -6.481 -8.820 1.00 63.14 H new ATOM 0 HA3 GLY A 208 -4.080 -6.737 -9.452 1.00 63.14 H new ATOM 538 N LYS A 209 -3.189 -6.874 -7.100 1.00 10.03 N ATOM 539 CA LYS A 209 -2.411 -6.821 -5.841 1.00 14.12 C ATOM 540 C LYS A 209 -0.921 -7.009 -6.148 1.00 55.13 C ATOM 541 O LYS A 209 -0.560 -7.715 -7.098 1.00 15.42 O ATOM 542 CB LYS A 209 -2.886 -7.891 -4.794 1.00 5.24 C ATOM 543 CG LYS A 209 -4.169 -7.504 -4.018 1.00 60.43 C ATOM 544 CD LYS A 209 -4.545 -8.505 -2.898 1.00 42.21 C ATOM 545 CE LYS A 209 -4.939 -9.894 -3.427 1.00 4.23 C ATOM 546 NZ LYS A 209 -6.157 -9.845 -4.283 1.00 70.04 N ATOM 0 H LYS A 209 -2.950 -7.671 -7.690 1.00 10.03 H new ATOM 0 HA LYS A 209 -2.579 -5.842 -5.393 1.00 14.12 H new ATOM 0 HB2 LYS A 209 -3.060 -8.835 -5.311 1.00 5.24 H new ATOM 0 HB3 LYS A 209 -2.082 -8.063 -4.079 1.00 5.24 H new ATOM 0 HG2 LYS A 209 -4.033 -6.516 -3.579 1.00 60.43 H new ATOM 0 HG3 LYS A 209 -4.999 -7.430 -4.720 1.00 60.43 H new ATOM 0 HD2 LYS A 209 -3.701 -8.610 -2.216 1.00 42.21 H new ATOM 0 HD3 LYS A 209 -5.373 -8.097 -2.319 1.00 42.21 H new ATOM 0 HE2 LYS A 209 -4.111 -10.311 -4.000 1.00 4.23 H new ATOM 0 HE3 LYS A 209 -5.115 -10.565 -2.586 1.00 4.23 H new ATOM 0 HZ1 LYS A 209 -6.454 -10.813 -4.520 1.00 70.04 H new ATOM 0 HZ2 LYS A 209 -6.923 -9.363 -3.770 1.00 70.04 H new ATOM 0 HZ3 LYS A 209 -5.946 -9.324 -5.158 1.00 70.04 H new ATOM 560 N VAL A 210 -0.070 -6.350 -5.343 1.00 22.43 N ATOM 561 CA VAL A 210 1.404 -6.480 -5.398 1.00 55.42 C ATOM 562 C VAL A 210 1.950 -6.658 -3.976 1.00 70.01 C ATOM 563 O VAL A 210 1.438 -6.046 -3.030 1.00 44.53 O ATOM 564 CB VAL A 210 2.082 -5.230 -6.075 1.00 12.13 C ATOM 565 CG1 VAL A 210 1.755 -5.163 -7.570 1.00 74.34 C ATOM 566 CG2 VAL A 210 1.680 -3.912 -5.375 1.00 71.14 C ATOM 0 H VAL A 210 -0.388 -5.701 -4.623 1.00 22.43 H new ATOM 0 HA VAL A 210 1.642 -7.352 -6.007 1.00 55.42 H new ATOM 0 HB VAL A 210 3.159 -5.353 -5.964 1.00 12.13 H new ATOM 0 HG11 VAL A 210 2.237 -4.290 -8.009 1.00 74.34 H new ATOM 0 HG12 VAL A 210 2.119 -6.065 -8.063 1.00 74.34 H new ATOM 0 HG13 VAL A 210 0.676 -5.087 -7.703 1.00 74.34 H new ATOM 0 HG21 VAL A 210 2.168 -3.073 -5.871 1.00 71.14 H new ATOM 0 HG22 VAL A 210 0.599 -3.786 -5.429 1.00 71.14 H new ATOM 0 HG23 VAL A 210 1.989 -3.946 -4.330 1.00 71.14 H new ATOM 576 N ARG A 211 2.992 -7.479 -3.823 1.00 4.21 N ATOM 577 CA ARG A 211 3.548 -7.806 -2.511 1.00 31.10 C ATOM 578 C ARG A 211 4.577 -6.745 -2.070 1.00 2.35 C ATOM 579 O ARG A 211 5.612 -6.563 -2.721 1.00 24.12 O ATOM 580 CB ARG A 211 4.154 -9.228 -2.533 1.00 44.41 C ATOM 581 CG ARG A 211 4.582 -9.767 -1.152 1.00 4.13 C ATOM 582 CD ARG A 211 4.906 -11.266 -1.187 1.00 34.31 C ATOM 583 NE ARG A 211 3.700 -12.079 -1.438 1.00 53.03 N ATOM 584 CZ ARG A 211 3.404 -13.242 -0.830 1.00 73.45 C ATOM 585 NH1 ARG A 211 4.223 -13.780 0.077 1.00 3.41 N ATOM 586 NH2 ARG A 211 2.268 -13.848 -1.129 1.00 73.12 N ATOM 0 H ARG A 211 3.471 -7.933 -4.601 1.00 4.21 H new ATOM 0 HA ARG A 211 2.747 -7.796 -1.772 1.00 31.10 H new ATOM 0 HB2 ARG A 211 3.424 -9.913 -2.965 1.00 44.41 H new ATOM 0 HB3 ARG A 211 5.021 -9.229 -3.193 1.00 44.41 H new ATOM 0 HG2 ARG A 211 5.456 -9.217 -0.805 1.00 4.13 H new ATOM 0 HG3 ARG A 211 3.785 -9.587 -0.431 1.00 4.13 H new ATOM 0 HD2 ARG A 211 5.645 -11.461 -1.965 1.00 34.31 H new ATOM 0 HD3 ARG A 211 5.355 -11.564 -0.239 1.00 34.31 H new ATOM 0 HE ARG A 211 3.036 -11.730 -2.130 1.00 53.03 H new ATOM 0 HH11 ARG A 211 5.094 -13.308 0.322 1.00 3.41 H new ATOM 0 HH12 ARG A 211 3.978 -14.663 0.525 1.00 3.41 H new ATOM 0 HH21 ARG A 211 1.633 -13.433 -1.811 1.00 73.12 H new ATOM 0 HH22 ARG A 211 2.027 -14.731 -0.678 1.00 73.12 H new ATOM 600 N ALA A 212 4.258 -6.042 -0.968 1.00 43.45 N ATOM 601 CA ALA A 212 5.119 -5.021 -0.355 1.00 53.12 C ATOM 602 C ALA A 212 5.849 -5.608 0.866 1.00 73.32 C ATOM 603 O ALA A 212 5.280 -6.409 1.620 1.00 63.10 O ATOM 604 CB ALA A 212 4.274 -3.805 0.062 1.00 42.33 C ATOM 0 H ALA A 212 3.377 -6.172 -0.471 1.00 43.45 H new ATOM 0 HA ALA A 212 5.863 -4.699 -1.084 1.00 53.12 H new ATOM 0 HB1 ALA A 212 4.919 -3.052 0.516 1.00 42.33 H new ATOM 0 HB2 ALA A 212 3.786 -3.383 -0.816 1.00 42.33 H new ATOM 0 HB3 ALA A 212 3.518 -4.117 0.783 1.00 42.33 H new ATOM 610 N MET A 213 7.120 -5.213 1.026 1.00 64.53 N ATOM 611 CA MET A 213 7.964 -5.608 2.163 1.00 33.32 C ATOM 612 C MET A 213 7.781 -4.618 3.324 1.00 70.14 C ATOM 613 O MET A 213 7.944 -3.402 3.144 1.00 31.40 O ATOM 614 CB MET A 213 9.457 -5.656 1.726 1.00 51.21 C ATOM 615 CG MET A 213 9.812 -6.732 0.672 1.00 1.42 C ATOM 616 SD MET A 213 10.346 -8.316 1.378 1.00 32.00 S ATOM 617 CE MET A 213 8.854 -8.995 2.100 1.00 40.12 C ATOM 0 H MET A 213 7.597 -4.603 0.362 1.00 64.53 H new ATOM 0 HA MET A 213 7.665 -6.601 2.499 1.00 33.32 H new ATOM 0 HB2 MET A 213 9.732 -4.679 1.328 1.00 51.21 H new ATOM 0 HB3 MET A 213 10.071 -5.824 2.611 1.00 51.21 H new ATOM 0 HG2 MET A 213 8.942 -6.904 0.038 1.00 1.42 H new ATOM 0 HG3 MET A 213 10.604 -6.348 0.029 1.00 1.42 H new ATOM 0 HE1 MET A 213 8.936 -10.081 2.151 1.00 40.12 H new ATOM 0 HE2 MET A 213 8.721 -8.594 3.105 1.00 40.12 H new ATOM 0 HE3 MET A 213 7.996 -8.724 1.484 1.00 40.12 H new ATOM 627 N THR A 214 7.426 -5.147 4.509 1.00 13.31 N ATOM 628 CA THR A 214 7.243 -4.351 5.745 1.00 33.32 C ATOM 629 C THR A 214 7.929 -5.035 6.934 1.00 24.20 C ATOM 630 O THR A 214 8.471 -6.133 6.797 1.00 54.13 O ATOM 631 CB THR A 214 5.725 -4.125 6.070 1.00 51.04 C ATOM 632 OG1 THR A 214 5.031 -5.378 6.123 1.00 11.22 O ATOM 633 CG2 THR A 214 5.050 -3.205 5.059 1.00 1.14 C ATOM 0 H THR A 214 7.256 -6.144 4.641 1.00 13.31 H new ATOM 0 HA THR A 214 7.703 -3.378 5.573 1.00 33.32 H new ATOM 0 HB THR A 214 5.677 -3.640 7.045 1.00 51.04 H new ATOM 0 HG1 THR A 214 5.590 -6.078 5.726 1.00 11.22 H new ATOM 0 HG21 THR A 214 4.001 -3.079 5.326 1.00 1.14 H new ATOM 0 HG22 THR A 214 5.545 -2.234 5.064 1.00 1.14 H new ATOM 0 HG23 THR A 214 5.121 -3.644 4.064 1.00 1.14 H new ATOM 641 N LEU A 215 7.873 -4.381 8.111 1.00 20.42 N ATOM 642 CA LEU A 215 8.487 -4.904 9.346 1.00 73.44 C ATOM 643 C LEU A 215 7.726 -6.147 9.842 1.00 54.03 C ATOM 644 O LEU A 215 8.300 -7.011 10.503 1.00 62.51 O ATOM 645 CB LEU A 215 8.534 -3.803 10.449 1.00 3.33 C ATOM 646 CG LEU A 215 9.141 -2.424 10.016 1.00 21.23 C ATOM 647 CD1 LEU A 215 9.366 -1.487 11.221 1.00 5.31 C ATOM 648 CD2 LEU A 215 10.433 -2.596 9.197 1.00 20.24 C ATOM 0 H LEU A 215 7.405 -3.483 8.232 1.00 20.42 H new ATOM 0 HA LEU A 215 9.512 -5.199 9.122 1.00 73.44 H new ATOM 0 HB2 LEU A 215 7.519 -3.634 10.810 1.00 3.33 H new ATOM 0 HB3 LEU A 215 9.112 -4.184 11.291 1.00 3.33 H new ATOM 0 HG LEU A 215 8.403 -1.950 9.368 1.00 21.23 H new ATOM 0 HD11 LEU A 215 9.788 -0.543 10.874 1.00 5.31 H new ATOM 0 HD12 LEU A 215 8.414 -1.298 11.718 1.00 5.31 H new ATOM 0 HD13 LEU A 215 10.055 -1.956 11.923 1.00 5.31 H new ATOM 0 HD21 LEU A 215 10.820 -1.616 8.918 1.00 20.24 H new ATOM 0 HD22 LEU A 215 11.176 -3.122 9.796 1.00 20.24 H new ATOM 0 HD23 LEU A 215 10.219 -3.172 8.297 1.00 20.24 H new ATOM 660 N GLU A 216 6.427 -6.228 9.485 1.00 64.22 N ATOM 661 CA GLU A 216 5.556 -7.359 9.842 1.00 73.21 C ATOM 662 C GLU A 216 5.794 -8.560 8.898 1.00 22.15 C ATOM 663 O GLU A 216 5.457 -9.698 9.238 1.00 15.24 O ATOM 664 CB GLU A 216 4.063 -6.919 9.780 1.00 24.13 C ATOM 665 CG GLU A 216 3.092 -7.902 10.465 1.00 43.02 C ATOM 666 CD GLU A 216 1.624 -7.455 10.471 1.00 11.31 C ATOM 667 OE1 GLU A 216 0.748 -8.252 10.062 1.00 34.14 O ATOM 668 OE2 GLU A 216 1.338 -6.315 10.904 1.00 4.54 O ATOM 0 H GLU A 216 5.955 -5.507 8.940 1.00 64.22 H new ATOM 0 HA GLU A 216 5.798 -7.671 10.858 1.00 73.21 H new ATOM 0 HB2 GLU A 216 3.963 -5.940 10.248 1.00 24.13 H new ATOM 0 HB3 GLU A 216 3.771 -6.804 8.736 1.00 24.13 H new ATOM 0 HG2 GLU A 216 3.161 -8.868 9.964 1.00 43.02 H new ATOM 0 HG3 GLU A 216 3.416 -8.053 11.495 1.00 43.02 H new ATOM 675 N GLY A 217 6.395 -8.288 7.718 1.00 0.40 N ATOM 676 CA GLY A 217 6.716 -9.317 6.724 1.00 71.41 C ATOM 677 C GLY A 217 6.176 -8.982 5.335 1.00 52.23 C ATOM 678 O GLY A 217 5.967 -7.801 5.024 1.00 24.53 O ATOM 0 H GLY A 217 6.668 -7.347 7.435 1.00 0.40 H new ATOM 0 HA2 GLY A 217 7.798 -9.439 6.669 1.00 71.41 H new ATOM 0 HA3 GLY A 217 6.304 -10.272 7.049 1.00 71.41 H new ATOM 682 N PRO A 218 5.977 -10.008 4.450 1.00 25.23 N ATOM 683 CA PRO A 218 5.363 -9.809 3.120 1.00 32.24 C ATOM 684 C PRO A 218 3.832 -9.630 3.220 1.00 21.11 C ATOM 685 O PRO A 218 3.155 -10.356 3.950 1.00 11.13 O ATOM 686 CB PRO A 218 5.764 -11.095 2.354 1.00 55.14 C ATOM 687 CG PRO A 218 5.955 -12.151 3.406 1.00 34.52 C ATOM 688 CD PRO A 218 6.362 -11.430 4.682 1.00 41.11 C ATOM 0 HA PRO A 218 5.702 -8.903 2.618 1.00 32.24 H new ATOM 0 HB2 PRO A 218 4.990 -11.385 1.644 1.00 55.14 H new ATOM 0 HB3 PRO A 218 6.679 -10.941 1.783 1.00 55.14 H new ATOM 0 HG2 PRO A 218 5.036 -12.717 3.558 1.00 34.52 H new ATOM 0 HG3 PRO A 218 6.722 -12.864 3.103 1.00 34.52 H new ATOM 0 HD2 PRO A 218 5.850 -11.843 5.551 1.00 41.11 H new ATOM 0 HD3 PRO A 218 7.432 -11.526 4.867 1.00 41.11 H new ATOM 696 N VAL A 219 3.301 -8.623 2.506 1.00 74.34 N ATOM 697 CA VAL A 219 1.860 -8.290 2.502 1.00 64.20 C ATOM 698 C VAL A 219 1.406 -8.035 1.054 1.00 72.55 C ATOM 699 O VAL A 219 2.185 -7.527 0.267 1.00 42.23 O ATOM 700 CB VAL A 219 1.550 -7.034 3.409 1.00 22.45 C ATOM 701 CG1 VAL A 219 2.042 -7.231 4.865 1.00 72.15 C ATOM 702 CG2 VAL A 219 2.100 -5.710 2.817 1.00 3.34 C ATOM 0 H VAL A 219 3.860 -8.012 1.911 1.00 74.34 H new ATOM 0 HA VAL A 219 1.307 -9.132 2.919 1.00 64.20 H new ATOM 0 HB VAL A 219 0.464 -6.948 3.429 1.00 22.45 H new ATOM 0 HG11 VAL A 219 1.808 -6.343 5.452 1.00 72.15 H new ATOM 0 HG12 VAL A 219 1.545 -8.097 5.303 1.00 72.15 H new ATOM 0 HG13 VAL A 219 3.120 -7.392 4.866 1.00 72.15 H new ATOM 0 HG21 VAL A 219 1.856 -4.884 3.485 1.00 3.34 H new ATOM 0 HG22 VAL A 219 3.182 -5.782 2.709 1.00 3.34 H new ATOM 0 HG23 VAL A 219 1.649 -5.533 1.841 1.00 3.34 H new ATOM 712 N GLU A 220 0.163 -8.400 0.687 1.00 53.51 N ATOM 713 CA GLU A 220 -0.353 -8.200 -0.689 1.00 41.42 C ATOM 714 C GLU A 220 -1.345 -7.023 -0.701 1.00 30.50 C ATOM 715 O GLU A 220 -2.442 -7.126 -0.143 1.00 73.30 O ATOM 716 CB GLU A 220 -1.004 -9.504 -1.219 1.00 11.32 C ATOM 717 CG GLU A 220 -0.046 -10.722 -1.219 1.00 4.21 C ATOM 718 CD GLU A 220 -0.618 -11.995 -1.873 1.00 10.22 C ATOM 719 OE1 GLU A 220 -1.743 -12.404 -1.529 1.00 40.34 O ATOM 720 OE2 GLU A 220 0.071 -12.613 -2.716 1.00 0.31 O ATOM 0 H GLU A 220 -0.506 -8.836 1.322 1.00 53.51 H new ATOM 0 HA GLU A 220 0.474 -7.956 -1.356 1.00 41.42 H new ATOM 0 HB2 GLU A 220 -1.876 -9.739 -0.609 1.00 11.32 H new ATOM 0 HB3 GLU A 220 -1.362 -9.334 -2.234 1.00 11.32 H new ATOM 0 HG2 GLU A 220 0.871 -10.445 -1.738 1.00 4.21 H new ATOM 0 HG3 GLU A 220 0.227 -10.951 -0.189 1.00 4.21 H new ATOM 727 N VAL A 221 -0.929 -5.915 -1.341 1.00 61.43 N ATOM 728 CA VAL A 221 -1.620 -4.615 -1.314 1.00 22.32 C ATOM 729 C VAL A 221 -2.510 -4.438 -2.554 1.00 65.45 C ATOM 730 O VAL A 221 -2.015 -4.517 -3.684 1.00 61.41 O ATOM 731 CB VAL A 221 -0.570 -3.435 -1.253 1.00 12.12 C ATOM 732 CG1 VAL A 221 -1.262 -2.054 -1.132 1.00 24.04 C ATOM 733 CG2 VAL A 221 0.442 -3.660 -0.103 1.00 20.51 C ATOM 0 H VAL A 221 -0.080 -5.900 -1.906 1.00 61.43 H new ATOM 0 HA VAL A 221 -2.248 -4.591 -0.423 1.00 22.32 H new ATOM 0 HB VAL A 221 -0.020 -3.434 -2.194 1.00 12.12 H new ATOM 0 HG11 VAL A 221 -0.506 -1.270 -1.093 1.00 24.04 H new ATOM 0 HG12 VAL A 221 -1.907 -1.893 -1.996 1.00 24.04 H new ATOM 0 HG13 VAL A 221 -1.861 -2.026 -0.222 1.00 24.04 H new ATOM 0 HG21 VAL A 221 1.155 -2.836 -0.080 1.00 20.51 H new ATOM 0 HG22 VAL A 221 -0.091 -3.706 0.847 1.00 20.51 H new ATOM 0 HG23 VAL A 221 0.975 -4.597 -0.266 1.00 20.51 H new ATOM 743 N ALA A 222 -3.815 -4.211 -2.318 1.00 53.04 N ATOM 744 CA ALA A 222 -4.804 -3.920 -3.360 1.00 23.20 C ATOM 745 C ALA A 222 -4.501 -2.576 -4.046 1.00 54.41 C ATOM 746 O ALA A 222 -4.684 -1.500 -3.455 1.00 51.01 O ATOM 747 CB ALA A 222 -6.214 -3.923 -2.751 1.00 31.04 C ATOM 0 H ALA A 222 -4.214 -4.226 -1.379 1.00 53.04 H new ATOM 0 HA ALA A 222 -4.750 -4.696 -4.123 1.00 23.20 H new ATOM 0 HB1 ALA A 222 -6.947 -3.706 -3.528 1.00 31.04 H new ATOM 0 HB2 ALA A 222 -6.422 -4.902 -2.319 1.00 31.04 H new ATOM 0 HB3 ALA A 222 -6.276 -3.163 -1.972 1.00 31.04 H new ATOM 753 N VAL A 223 -3.979 -2.679 -5.273 1.00 5.51 N ATOM 754 CA VAL A 223 -3.730 -1.544 -6.163 1.00 64.41 C ATOM 755 C VAL A 223 -5.072 -1.085 -6.782 1.00 54.21 C ATOM 756 O VAL A 223 -5.812 -1.925 -7.299 1.00 65.21 O ATOM 757 CB VAL A 223 -2.730 -1.942 -7.319 1.00 4.20 C ATOM 758 CG1 VAL A 223 -2.410 -0.735 -8.238 1.00 50.41 C ATOM 759 CG2 VAL A 223 -1.441 -2.564 -6.741 1.00 14.01 C ATOM 0 H VAL A 223 -3.713 -3.574 -5.682 1.00 5.51 H new ATOM 0 HA VAL A 223 -3.283 -0.736 -5.584 1.00 64.41 H new ATOM 0 HB VAL A 223 -3.220 -2.695 -7.936 1.00 4.20 H new ATOM 0 HG11 VAL A 223 -1.719 -1.047 -9.021 1.00 50.41 H new ATOM 0 HG12 VAL A 223 -3.331 -0.369 -8.691 1.00 50.41 H new ATOM 0 HG13 VAL A 223 -1.954 0.061 -7.648 1.00 50.41 H new ATOM 0 HG21 VAL A 223 -0.768 -2.830 -7.556 1.00 14.01 H new ATOM 0 HG22 VAL A 223 -0.951 -1.843 -6.086 1.00 14.01 H new ATOM 0 HG23 VAL A 223 -1.692 -3.459 -6.172 1.00 14.01 H new ATOM 769 N PRO A 224 -5.429 0.237 -6.704 1.00 60.43 N ATOM 770 CA PRO A 224 -6.638 0.781 -7.383 1.00 14.14 C ATOM 771 C PRO A 224 -6.585 0.597 -8.932 1.00 4.21 C ATOM 772 O PRO A 224 -5.508 0.675 -9.523 1.00 3.03 O ATOM 773 CB PRO A 224 -6.631 2.288 -6.982 1.00 22.43 C ATOM 774 CG PRO A 224 -5.237 2.576 -6.496 1.00 3.20 C ATOM 775 CD PRO A 224 -4.726 1.280 -5.909 1.00 53.01 C ATOM 0 HA PRO A 224 -7.549 0.263 -7.083 1.00 14.14 H new ATOM 0 HB2 PRO A 224 -6.887 2.920 -7.832 1.00 22.43 H new ATOM 0 HB3 PRO A 224 -7.366 2.489 -6.203 1.00 22.43 H new ATOM 0 HG2 PRO A 224 -4.600 2.912 -7.314 1.00 3.20 H new ATOM 0 HG3 PRO A 224 -5.240 3.369 -5.748 1.00 3.20 H new ATOM 0 HD2 PRO A 224 -3.643 1.196 -6.004 1.00 53.01 H new ATOM 0 HD3 PRO A 224 -4.960 1.201 -4.847 1.00 53.01 H new ATOM 783 N PRO A 225 -7.741 0.281 -9.607 1.00 34.23 N ATOM 784 CA PRO A 225 -7.815 0.225 -11.094 1.00 50.13 C ATOM 785 C PRO A 225 -7.451 1.570 -11.762 1.00 2.41 C ATOM 786 O PRO A 225 -8.032 2.611 -11.418 1.00 31.11 O ATOM 787 CB PRO A 225 -9.293 -0.170 -11.367 1.00 33.14 C ATOM 788 CG PRO A 225 -9.747 -0.850 -10.108 1.00 23.22 C ATOM 789 CD PRO A 225 -9.035 -0.116 -8.990 1.00 44.35 C ATOM 0 HA PRO A 225 -7.097 -0.480 -11.514 1.00 50.13 H new ATOM 0 HB2 PRO A 225 -9.903 0.707 -11.585 1.00 33.14 H new ATOM 0 HB3 PRO A 225 -9.372 -0.835 -12.227 1.00 33.14 H new ATOM 0 HG2 PRO A 225 -10.829 -0.789 -9.994 1.00 23.22 H new ATOM 0 HG3 PRO A 225 -9.486 -1.908 -10.115 1.00 23.22 H new ATOM 0 HD2 PRO A 225 -9.603 0.752 -8.654 1.00 44.35 H new ATOM 0 HD3 PRO A 225 -8.886 -0.756 -8.120 1.00 44.35 H new ATOM 797 N ARG A 226 -6.487 1.505 -12.703 1.00 44.21 N ATOM 798 CA ARG A 226 -5.978 2.645 -13.495 1.00 64.44 C ATOM 799 C ARG A 226 -5.150 3.585 -12.597 1.00 73.11 C ATOM 800 O ARG A 226 -5.588 4.675 -12.219 1.00 22.03 O ATOM 801 CB ARG A 226 -7.113 3.387 -14.276 1.00 0.43 C ATOM 802 CG ARG A 226 -7.982 2.457 -15.159 1.00 15.44 C ATOM 803 CD ARG A 226 -9.083 3.213 -15.938 1.00 12.42 C ATOM 804 NE ARG A 226 -10.042 2.294 -16.587 1.00 0.11 N ATOM 805 CZ ARG A 226 -9.915 1.761 -17.815 1.00 63.04 C ATOM 806 NH1 ARG A 226 -8.858 2.023 -18.576 1.00 25.41 N ATOM 807 NH2 ARG A 226 -10.861 0.962 -18.279 1.00 40.01 N ATOM 0 H ARG A 226 -6.025 0.627 -12.941 1.00 44.21 H new ATOM 0 HA ARG A 226 -5.314 2.255 -14.267 1.00 64.44 H new ATOM 0 HB2 ARG A 226 -7.757 3.898 -13.561 1.00 0.43 H new ATOM 0 HB3 ARG A 226 -6.664 4.155 -14.907 1.00 0.43 H new ATOM 0 HG2 ARG A 226 -7.339 1.933 -15.867 1.00 15.44 H new ATOM 0 HG3 ARG A 226 -8.447 1.699 -14.529 1.00 15.44 H new ATOM 0 HD2 ARG A 226 -9.620 3.873 -15.256 1.00 12.42 H new ATOM 0 HD3 ARG A 226 -8.620 3.846 -16.695 1.00 12.42 H new ATOM 0 HE ARG A 226 -10.875 2.041 -16.055 1.00 0.11 H new ATOM 0 HH11 ARG A 226 -8.122 2.640 -18.232 1.00 25.41 H new ATOM 0 HH12 ARG A 226 -8.782 1.608 -19.504 1.00 25.41 H new ATOM 0 HH21 ARG A 226 -11.679 0.754 -17.706 1.00 40.01 H new ATOM 0 HH22 ARG A 226 -10.773 0.554 -19.209 1.00 40.01 H new ATOM 821 N THR A 227 -3.960 3.085 -12.223 1.00 65.51 N ATOM 822 CA THR A 227 -3.011 3.754 -11.320 1.00 52.34 C ATOM 823 C THR A 227 -1.848 4.362 -12.113 1.00 44.25 C ATOM 824 O THR A 227 -1.325 3.738 -13.042 1.00 25.55 O ATOM 825 CB THR A 227 -2.481 2.736 -10.245 1.00 43.42 C ATOM 826 OG1 THR A 227 -3.517 2.454 -9.310 1.00 33.21 O ATOM 827 CG2 THR A 227 -1.244 3.212 -9.471 1.00 43.32 C ATOM 0 H THR A 227 -3.623 2.179 -12.550 1.00 65.51 H new ATOM 0 HA THR A 227 -3.528 4.564 -10.806 1.00 52.34 H new ATOM 0 HB THR A 227 -2.179 1.849 -10.802 1.00 43.42 H new ATOM 0 HG1 THR A 227 -4.136 1.799 -9.695 1.00 33.21 H new ATOM 0 HG21 THR A 227 -0.948 2.448 -8.752 1.00 43.32 H new ATOM 0 HG22 THR A 227 -0.425 3.391 -10.168 1.00 43.32 H new ATOM 0 HG23 THR A 227 -1.479 4.136 -8.943 1.00 43.32 H new ATOM 835 N GLN A 228 -1.476 5.600 -11.739 1.00 52.23 N ATOM 836 CA GLN A 228 -0.342 6.341 -12.330 1.00 32.23 C ATOM 837 C GLN A 228 0.857 6.320 -11.360 1.00 64.33 C ATOM 838 O GLN A 228 0.680 6.123 -10.151 1.00 63.21 O ATOM 839 CB GLN A 228 -0.739 7.819 -12.632 1.00 12.35 C ATOM 840 CG GLN A 228 -1.949 7.995 -13.588 1.00 64.23 C ATOM 841 CD GLN A 228 -3.310 7.661 -12.963 1.00 34.12 C ATOM 842 OE1 GLN A 228 -3.504 7.825 -11.764 1.00 0.33 O ATOM 843 NE2 GLN A 228 -4.271 7.206 -13.760 1.00 4.35 N ATOM 0 H GLN A 228 -1.960 6.122 -11.008 1.00 52.23 H new ATOM 0 HA GLN A 228 -0.068 5.856 -13.267 1.00 32.23 H new ATOM 0 HB2 GLN A 228 -0.965 8.318 -11.690 1.00 12.35 H new ATOM 0 HB3 GLN A 228 0.122 8.329 -13.064 1.00 12.35 H new ATOM 0 HG2 GLN A 228 -1.969 9.026 -13.941 1.00 64.23 H new ATOM 0 HG3 GLN A 228 -1.800 7.361 -14.462 1.00 64.23 H new ATOM 0 HE21 GLN A 228 -4.089 7.076 -14.755 1.00 4.35 H new ATOM 0 HE22 GLN A 228 -5.190 6.986 -13.376 1.00 4.35 H new ATOM 852 N ALA A 229 2.070 6.533 -11.904 1.00 31.41 N ATOM 853 CA ALA A 229 3.297 6.674 -11.099 1.00 3.40 C ATOM 854 C ALA A 229 3.307 8.052 -10.420 1.00 53.44 C ATOM 855 O ALA A 229 2.813 9.035 -10.992 1.00 41.33 O ATOM 856 CB ALA A 229 4.539 6.475 -11.981 1.00 63.43 C ATOM 0 H ALA A 229 2.226 6.612 -12.909 1.00 31.41 H new ATOM 0 HA ALA A 229 3.317 5.907 -10.325 1.00 3.40 H new ATOM 0 HB1 ALA A 229 5.438 6.582 -11.373 1.00 63.43 H new ATOM 0 HB2 ALA A 229 4.516 5.479 -12.423 1.00 63.43 H new ATOM 0 HB3 ALA A 229 4.546 7.223 -12.774 1.00 63.43 H new ATOM 862 N GLY A 230 3.847 8.122 -9.194 1.00 75.05 N ATOM 863 CA GLY A 230 3.828 9.360 -8.406 1.00 52.54 C ATOM 864 C GLY A 230 2.590 9.479 -7.530 1.00 51.44 C ATOM 865 O GLY A 230 2.405 10.497 -6.852 1.00 41.22 O ATOM 0 H GLY A 230 4.301 7.336 -8.729 1.00 75.05 H new ATOM 0 HA2 GLY A 230 4.718 9.400 -7.778 1.00 52.54 H new ATOM 0 HA3 GLY A 230 3.875 10.216 -9.080 1.00 52.54 H new ATOM 869 N ARG A 231 1.720 8.440 -7.561 1.00 11.22 N ATOM 870 CA ARG A 231 0.598 8.319 -6.621 1.00 23.24 C ATOM 871 C ARG A 231 1.120 8.006 -5.210 1.00 60.34 C ATOM 872 O ARG A 231 2.259 7.551 -5.026 1.00 15.11 O ATOM 873 CB ARG A 231 -0.430 7.219 -7.039 1.00 41.41 C ATOM 874 CG ARG A 231 -1.462 7.625 -8.114 1.00 33.24 C ATOM 875 CD ARG A 231 -2.607 6.596 -8.204 1.00 1.03 C ATOM 876 NE ARG A 231 -3.687 7.018 -9.103 1.00 41.20 N ATOM 877 CZ ARG A 231 -4.803 6.307 -9.347 1.00 54.32 C ATOM 878 NH1 ARG A 231 -5.008 5.127 -8.763 1.00 1.33 N ATOM 879 NH2 ARG A 231 -5.699 6.779 -10.207 1.00 53.34 N ATOM 0 H ARG A 231 1.782 7.675 -8.233 1.00 11.22 H new ATOM 0 HA ARG A 231 0.080 9.278 -6.633 1.00 23.24 H new ATOM 0 HB2 ARG A 231 0.123 6.354 -7.404 1.00 41.41 H new ATOM 0 HB3 ARG A 231 -0.971 6.899 -6.148 1.00 41.41 H new ATOM 0 HG2 ARG A 231 -1.870 8.608 -7.877 1.00 33.24 H new ATOM 0 HG3 ARG A 231 -0.969 7.710 -9.082 1.00 33.24 H new ATOM 0 HD2 ARG A 231 -2.206 5.643 -8.549 1.00 1.03 H new ATOM 0 HD3 ARG A 231 -3.016 6.427 -7.208 1.00 1.03 H new ATOM 0 HE ARG A 231 -3.584 7.915 -9.577 1.00 41.20 H new ATOM 0 HH11 ARG A 231 -4.313 4.749 -8.119 1.00 1.33 H new ATOM 0 HH12 ARG A 231 -5.860 4.602 -8.960 1.00 1.33 H new ATOM 0 HH21 ARG A 231 -5.537 7.671 -10.674 1.00 53.34 H new ATOM 0 HH22 ARG A 231 -6.549 6.249 -10.400 1.00 53.34 H new ATOM 893 N LYS A 232 0.267 8.264 -4.231 1.00 30.42 N ATOM 894 CA LYS A 232 0.518 7.963 -2.824 1.00 74.14 C ATOM 895 C LYS A 232 -0.696 7.217 -2.251 1.00 71.04 C ATOM 896 O LYS A 232 -1.850 7.545 -2.568 1.00 35.10 O ATOM 897 CB LYS A 232 0.833 9.278 -2.051 1.00 52.33 C ATOM 898 CG LYS A 232 -0.049 10.489 -2.441 1.00 22.14 C ATOM 899 CD LYS A 232 0.224 11.734 -1.573 1.00 13.44 C ATOM 900 CE LYS A 232 -0.606 12.953 -1.974 1.00 23.03 C ATOM 901 NZ LYS A 232 -2.053 12.667 -1.931 1.00 64.42 N ATOM 0 H LYS A 232 -0.641 8.699 -4.393 1.00 30.42 H new ATOM 0 HA LYS A 232 1.389 7.316 -2.716 1.00 74.14 H new ATOM 0 HB2 LYS A 232 0.717 9.091 -0.983 1.00 52.33 H new ATOM 0 HB3 LYS A 232 1.878 9.539 -2.218 1.00 52.33 H new ATOM 0 HG2 LYS A 232 0.125 10.737 -3.488 1.00 22.14 H new ATOM 0 HG3 LYS A 232 -1.099 10.212 -2.350 1.00 22.14 H new ATOM 0 HD2 LYS A 232 0.018 11.492 -0.530 1.00 13.44 H new ATOM 0 HD3 LYS A 232 1.282 11.988 -1.639 1.00 13.44 H new ATOM 0 HE2 LYS A 232 -0.379 13.783 -1.305 1.00 23.03 H new ATOM 0 HE3 LYS A 232 -0.327 13.268 -2.980 1.00 23.03 H new ATOM 0 HZ1 LYS A 232 -2.575 13.545 -1.736 1.00 64.42 H new ATOM 0 HZ2 LYS A 232 -2.358 12.280 -2.847 1.00 64.42 H new ATOM 0 HZ3 LYS A 232 -2.248 11.974 -1.180 1.00 64.42 H new ATOM 915 N LEU A 233 -0.417 6.192 -1.441 1.00 4.24 N ATOM 916 CA LEU A 233 -1.427 5.370 -0.757 1.00 33.42 C ATOM 917 C LEU A 233 -1.196 5.497 0.748 1.00 74.23 C ATOM 918 O LEU A 233 -0.045 5.557 1.181 1.00 70.23 O ATOM 919 CB LEU A 233 -1.289 3.873 -1.177 1.00 61.24 C ATOM 920 CG LEU A 233 -1.380 3.570 -2.704 1.00 72.03 C ATOM 921 CD1 LEU A 233 -1.062 2.090 -2.993 1.00 33.11 C ATOM 922 CD2 LEU A 233 -2.754 3.974 -3.284 1.00 64.14 C ATOM 0 H LEU A 233 0.539 5.901 -1.236 1.00 4.24 H new ATOM 0 HA LEU A 233 -2.426 5.712 -1.028 1.00 33.42 H new ATOM 0 HB2 LEU A 233 -0.331 3.503 -0.812 1.00 61.24 H new ATOM 0 HB3 LEU A 233 -2.066 3.302 -0.669 1.00 61.24 H new ATOM 0 HG LEU A 233 -0.627 4.178 -3.206 1.00 72.03 H new ATOM 0 HD11 LEU A 233 -1.133 1.905 -4.065 1.00 33.11 H new ATOM 0 HD12 LEU A 233 -0.053 1.861 -2.651 1.00 33.11 H new ATOM 0 HD13 LEU A 233 -1.776 1.455 -2.468 1.00 33.11 H new ATOM 0 HD21 LEU A 233 -2.780 3.748 -4.350 1.00 64.14 H new ATOM 0 HD22 LEU A 233 -3.541 3.417 -2.776 1.00 64.14 H new ATOM 0 HD23 LEU A 233 -2.912 5.042 -3.136 1.00 64.14 H new ATOM 934 N ARG A 234 -2.267 5.560 1.542 1.00 74.22 N ATOM 935 CA ARG A 234 -2.154 5.489 3.008 1.00 25.45 C ATOM 936 C ARG A 234 -3.131 4.434 3.517 1.00 62.44 C ATOM 937 O ARG A 234 -4.349 4.616 3.472 1.00 42.35 O ATOM 938 CB ARG A 234 -2.408 6.882 3.640 1.00 60.14 C ATOM 939 CG ARG A 234 -1.932 7.042 5.089 1.00 2.14 C ATOM 940 CD ARG A 234 -1.999 8.504 5.573 1.00 25.03 C ATOM 941 NE ARG A 234 -1.292 8.647 6.849 1.00 54.33 N ATOM 942 CZ ARG A 234 -0.680 9.744 7.301 1.00 23.23 C ATOM 943 NH1 ARG A 234 -0.680 10.872 6.597 1.00 2.34 N ATOM 944 NH2 ARG A 234 0.015 9.671 8.433 1.00 15.54 N ATOM 0 H ARG A 234 -3.223 5.660 1.199 1.00 74.22 H new ATOM 0 HA ARG A 234 -1.145 5.197 3.300 1.00 25.45 H new ATOM 0 HB2 ARG A 234 -1.914 7.636 3.027 1.00 60.14 H new ATOM 0 HB3 ARG A 234 -3.477 7.091 3.601 1.00 60.14 H new ATOM 0 HG2 ARG A 234 -2.544 6.418 5.740 1.00 2.14 H new ATOM 0 HG3 ARG A 234 -0.907 6.681 5.174 1.00 2.14 H new ATOM 0 HD2 ARG A 234 -1.555 9.163 4.827 1.00 25.03 H new ATOM 0 HD3 ARG A 234 -3.039 8.809 5.689 1.00 25.03 H new ATOM 0 HE ARG A 234 -1.265 7.825 7.453 1.00 54.33 H new ATOM 0 HH11 ARG A 234 -1.153 10.910 5.694 1.00 2.34 H new ATOM 0 HH12 ARG A 234 -0.207 11.700 6.960 1.00 2.34 H new ATOM 0 HH21 ARG A 234 0.073 8.788 8.940 1.00 15.54 H new ATOM 0 HH22 ARG A 234 0.490 10.498 8.794 1.00 15.54 H new ATOM 958 N LEU A 235 -2.557 3.314 3.950 1.00 71.31 N ATOM 959 CA LEU A 235 -3.280 2.139 4.439 1.00 13.14 C ATOM 960 C LEU A 235 -3.689 2.373 5.901 1.00 15.02 C ATOM 961 O LEU A 235 -2.976 1.984 6.830 1.00 65.31 O ATOM 962 CB LEU A 235 -2.352 0.904 4.268 1.00 61.44 C ATOM 963 CG LEU A 235 -1.836 0.667 2.804 1.00 62.11 C ATOM 964 CD1 LEU A 235 -0.612 -0.242 2.767 1.00 62.11 C ATOM 965 CD2 LEU A 235 -2.938 0.110 1.904 1.00 13.23 C ATOM 0 H LEU A 235 -1.544 3.194 3.972 1.00 71.31 H new ATOM 0 HA LEU A 235 -4.196 1.961 3.875 1.00 13.14 H new ATOM 0 HB2 LEU A 235 -1.492 1.019 4.927 1.00 61.44 H new ATOM 0 HB3 LEU A 235 -2.889 0.015 4.597 1.00 61.44 H new ATOM 0 HG LEU A 235 -1.538 1.642 2.420 1.00 62.11 H new ATOM 0 HD11 LEU A 235 -0.291 -0.378 1.734 1.00 62.11 H new ATOM 0 HD12 LEU A 235 0.195 0.211 3.342 1.00 62.11 H new ATOM 0 HD13 LEU A 235 -0.865 -1.211 3.198 1.00 62.11 H new ATOM 0 HD21 LEU A 235 -2.545 -0.041 0.899 1.00 13.23 H new ATOM 0 HD22 LEU A 235 -3.288 -0.842 2.304 1.00 13.23 H new ATOM 0 HD23 LEU A 235 -3.768 0.815 1.866 1.00 13.23 H new ATOM 977 N LYS A 236 -4.828 3.062 6.073 1.00 54.10 N ATOM 978 CA LYS A 236 -5.347 3.488 7.387 1.00 61.35 C ATOM 979 C LYS A 236 -5.833 2.285 8.206 1.00 51.25 C ATOM 980 O LYS A 236 -6.543 1.416 7.673 1.00 54.21 O ATOM 981 CB LYS A 236 -6.512 4.478 7.179 1.00 21.35 C ATOM 982 CG LYS A 236 -6.131 5.746 6.395 1.00 42.52 C ATOM 983 CD LYS A 236 -7.310 6.734 6.299 1.00 31.32 C ATOM 984 CE LYS A 236 -6.982 7.974 5.454 1.00 5.13 C ATOM 985 NZ LYS A 236 -8.205 8.755 5.116 1.00 14.42 N ATOM 0 H LYS A 236 -5.424 3.344 5.295 1.00 54.10 H new ATOM 0 HA LYS A 236 -4.540 3.971 7.938 1.00 61.35 H new ATOM 0 HB2 LYS A 236 -7.318 3.967 6.652 1.00 21.35 H new ATOM 0 HB3 LYS A 236 -6.903 4.771 8.153 1.00 21.35 H new ATOM 0 HG2 LYS A 236 -5.286 6.234 6.881 1.00 42.52 H new ATOM 0 HG3 LYS A 236 -5.806 5.470 5.392 1.00 42.52 H new ATOM 0 HD2 LYS A 236 -8.171 6.224 5.868 1.00 31.32 H new ATOM 0 HD3 LYS A 236 -7.596 7.049 7.302 1.00 31.32 H new ATOM 0 HE2 LYS A 236 -6.284 8.610 5.998 1.00 5.13 H new ATOM 0 HE3 LYS A 236 -6.483 7.666 4.535 1.00 5.13 H new ATOM 0 HZ1 LYS A 236 -7.941 9.583 4.545 1.00 14.42 H new ATOM 0 HZ2 LYS A 236 -8.861 8.156 4.575 1.00 14.42 H new ATOM 0 HZ3 LYS A 236 -8.668 9.071 5.992 1.00 14.42 H new ATOM 999 N GLY A 237 -5.446 2.252 9.499 1.00 70.31 N ATOM 1000 CA GLY A 237 -5.760 1.131 10.391 1.00 5.04 C ATOM 1001 C GLY A 237 -5.084 -0.164 9.971 1.00 55.51 C ATOM 1002 O GLY A 237 -5.525 -1.254 10.348 1.00 45.24 O ATOM 0 H GLY A 237 -4.912 2.998 9.945 1.00 70.31 H new ATOM 0 HA2 GLY A 237 -5.453 1.383 11.406 1.00 5.04 H new ATOM 0 HA3 GLY A 237 -6.839 0.981 10.413 1.00 5.04 H new ATOM 1006 N LYS A 238 -3.993 -0.029 9.193 1.00 21.12 N ATOM 1007 CA LYS A 238 -3.267 -1.159 8.588 1.00 15.45 C ATOM 1008 C LYS A 238 -1.742 -0.949 8.686 1.00 43.23 C ATOM 1009 O LYS A 238 -0.979 -1.583 7.971 1.00 74.20 O ATOM 1010 CB LYS A 238 -3.701 -1.366 7.100 1.00 52.10 C ATOM 1011 CG LYS A 238 -5.196 -1.698 6.900 1.00 52.21 C ATOM 1012 CD LYS A 238 -5.584 -3.079 7.482 1.00 43.24 C ATOM 1013 CE LYS A 238 -7.102 -3.250 7.653 1.00 22.14 C ATOM 1014 NZ LYS A 238 -7.845 -3.184 6.369 1.00 64.30 N ATOM 0 H LYS A 238 -3.587 0.879 8.965 1.00 21.12 H new ATOM 0 HA LYS A 238 -3.522 -2.060 9.146 1.00 15.45 H new ATOM 0 HB2 LYS A 238 -3.466 -0.461 6.539 1.00 52.10 H new ATOM 0 HB3 LYS A 238 -3.104 -2.171 6.671 1.00 52.10 H new ATOM 0 HG2 LYS A 238 -5.802 -0.925 7.373 1.00 52.21 H new ATOM 0 HG3 LYS A 238 -5.429 -1.678 5.835 1.00 52.21 H new ATOM 0 HD2 LYS A 238 -5.207 -3.863 6.826 1.00 43.24 H new ATOM 0 HD3 LYS A 238 -5.097 -3.210 8.448 1.00 43.24 H new ATOM 0 HE2 LYS A 238 -7.302 -4.208 8.132 1.00 22.14 H new ATOM 0 HE3 LYS A 238 -7.476 -2.475 8.322 1.00 22.14 H new ATOM 0 HZ1 LYS A 238 -8.591 -3.908 6.362 1.00 64.30 H new ATOM 0 HZ2 LYS A 238 -8.275 -2.243 6.265 1.00 64.30 H new ATOM 0 HZ3 LYS A 238 -7.190 -3.355 5.580 1.00 64.30 H new ATOM 1028 N GLY A 239 -1.302 -0.083 9.596 1.00 72.15 N ATOM 1029 CA GLY A 239 0.128 0.106 9.857 1.00 40.50 C ATOM 1030 C GLY A 239 0.619 -0.779 10.985 1.00 40.41 C ATOM 1031 O GLY A 239 0.304 -1.972 11.012 1.00 35.42 O ATOM 0 H GLY A 239 -1.914 0.501 10.167 1.00 72.15 H new ATOM 0 HA2 GLY A 239 0.694 -0.113 8.952 1.00 40.50 H new ATOM 0 HA3 GLY A 239 0.316 1.150 10.107 1.00 40.50 H new ATOM 1035 N PHE A 240 1.383 -0.182 11.916 1.00 13.31 N ATOM 1036 CA PHE A 240 1.912 -0.869 13.111 1.00 35.40 C ATOM 1037 C PHE A 240 0.744 -1.383 13.992 1.00 4.34 C ATOM 1038 O PHE A 240 -0.258 -0.669 14.129 1.00 2.11 O ATOM 1039 CB PHE A 240 2.835 0.100 13.927 1.00 11.30 C ATOM 1040 CG PHE A 240 4.236 -0.422 14.211 1.00 71.04 C ATOM 1041 CD1 PHE A 240 5.048 -0.876 13.168 1.00 74.11 C ATOM 1042 CD2 PHE A 240 4.763 -0.417 15.504 1.00 33.51 C ATOM 1043 CE1 PHE A 240 6.330 -1.308 13.410 1.00 64.10 C ATOM 1044 CE2 PHE A 240 6.048 -0.857 15.745 1.00 12.04 C ATOM 1045 CZ PHE A 240 6.834 -1.298 14.698 1.00 63.43 C ATOM 0 H PHE A 240 1.654 0.800 11.861 1.00 13.31 H new ATOM 0 HA PHE A 240 2.507 -1.725 12.793 1.00 35.40 H new ATOM 0 HB2 PHE A 240 2.919 1.040 13.382 1.00 11.30 H new ATOM 0 HB3 PHE A 240 2.349 0.324 14.877 1.00 11.30 H new ATOM 0 HD1 PHE A 240 4.663 -0.887 12.159 1.00 74.11 H new ATOM 0 HD2 PHE A 240 4.157 -0.064 16.326 1.00 33.51 H new ATOM 0 HE1 PHE A 240 6.945 -1.656 12.593 1.00 64.10 H new ATOM 0 HE2 PHE A 240 6.439 -0.857 16.752 1.00 12.04 H new ATOM 0 HZ PHE A 240 7.843 -1.635 14.885 1.00 63.43 H new ATOM 1055 N PRO A 241 0.848 -2.632 14.562 1.00 32.30 N ATOM 1056 CA PRO A 241 -0.172 -3.215 15.476 1.00 63.02 C ATOM 1057 C PRO A 241 -0.643 -2.278 16.621 1.00 34.20 C ATOM 1058 O PRO A 241 0.143 -1.467 17.135 1.00 20.43 O ATOM 1059 CB PRO A 241 0.539 -4.473 16.027 1.00 74.23 C ATOM 1060 CG PRO A 241 1.442 -4.901 14.916 1.00 40.22 C ATOM 1061 CD PRO A 241 1.951 -3.608 14.312 1.00 12.22 C ATOM 0 HA PRO A 241 -1.103 -3.416 14.946 1.00 63.02 H new ATOM 0 HB2 PRO A 241 1.102 -4.248 16.933 1.00 74.23 H new ATOM 0 HB3 PRO A 241 -0.176 -5.255 16.282 1.00 74.23 H new ATOM 0 HG2 PRO A 241 2.263 -5.514 15.287 1.00 40.22 H new ATOM 0 HG3 PRO A 241 0.906 -5.498 14.178 1.00 40.22 H new ATOM 0 HD2 PRO A 241 2.881 -3.288 14.781 1.00 12.22 H new ATOM 0 HD3 PRO A 241 2.153 -3.718 13.246 1.00 12.22 H new ATOM 1069 N GLY A 242 -1.933 -2.409 16.990 1.00 72.50 N ATOM 1070 CA GLY A 242 -2.551 -1.647 18.077 1.00 61.54 C ATOM 1071 C GLY A 242 -3.821 -2.351 18.571 1.00 12.43 C ATOM 1072 O GLY A 242 -4.590 -2.835 17.736 1.00 52.32 O ATOM 0 H GLY A 242 -2.576 -3.055 16.533 1.00 72.50 H new ATOM 0 HA2 GLY A 242 -1.845 -1.538 18.900 1.00 61.54 H new ATOM 0 HA3 GLY A 242 -2.796 -0.642 17.732 1.00 61.54 H new ATOM 1076 N PRO A 243 -4.086 -2.416 19.922 1.00 11.52 N ATOM 1077 CA PRO A 243 -5.188 -3.240 20.502 1.00 11.40 C ATOM 1078 C PRO A 243 -6.600 -2.755 20.099 1.00 54.11 C ATOM 1079 O PRO A 243 -7.492 -3.569 19.822 1.00 23.13 O ATOM 1080 CB PRO A 243 -4.953 -3.115 22.036 1.00 61.14 C ATOM 1081 CG PRO A 243 -4.231 -1.811 22.203 1.00 51.23 C ATOM 1082 CD PRO A 243 -3.334 -1.691 20.987 1.00 42.52 C ATOM 0 HA PRO A 243 -5.162 -4.267 20.137 1.00 11.40 H new ATOM 0 HB2 PRO A 243 -5.896 -3.119 22.583 1.00 61.14 H new ATOM 0 HB3 PRO A 243 -4.361 -3.948 22.415 1.00 61.14 H new ATOM 0 HG2 PRO A 243 -4.932 -0.978 22.258 1.00 51.23 H new ATOM 0 HG3 PRO A 243 -3.648 -1.799 23.124 1.00 51.23 H new ATOM 0 HD2 PRO A 243 -3.162 -0.649 20.717 1.00 42.52 H new ATOM 0 HD3 PRO A 243 -2.357 -2.140 21.164 1.00 42.52 H new ATOM 1090 N ALA A 244 -6.786 -1.424 20.074 1.00 0.42 N ATOM 1091 CA ALA A 244 -8.084 -0.784 19.761 1.00 32.10 C ATOM 1092 C ALA A 244 -8.156 -0.349 18.287 1.00 25.11 C ATOM 1093 O ALA A 244 -9.248 -0.106 17.752 1.00 24.15 O ATOM 1094 CB ALA A 244 -8.308 0.411 20.701 1.00 11.34 C ATOM 0 H ALA A 244 -6.041 -0.756 20.270 1.00 0.42 H new ATOM 0 HA ALA A 244 -8.879 -1.514 19.918 1.00 32.10 H new ATOM 0 HB1 ALA A 244 -9.264 0.882 20.470 1.00 11.34 H new ATOM 0 HB2 ALA A 244 -8.315 0.065 21.735 1.00 11.34 H new ATOM 0 HB3 ALA A 244 -7.505 1.136 20.566 1.00 11.34 H new ATOM 1100 N GLY A 245 -6.980 -0.248 17.650 1.00 44.30 N ATOM 1101 CA GLY A 245 -6.858 0.156 16.251 1.00 33.41 C ATOM 1102 C GLY A 245 -5.397 0.278 15.851 1.00 71.34 C ATOM 1103 O GLY A 245 -4.556 0.621 16.688 1.00 2.20 O ATOM 0 H GLY A 245 -6.085 -0.446 18.098 1.00 44.30 H new ATOM 0 HA2 GLY A 245 -7.355 -0.574 15.612 1.00 33.41 H new ATOM 0 HA3 GLY A 245 -7.363 1.110 16.098 1.00 33.41 H new ATOM 1107 N ARG A 246 -5.086 -0.001 14.580 1.00 22.35 N ATOM 1108 CA ARG A 246 -3.702 0.014 14.075 1.00 25.22 C ATOM 1109 C ARG A 246 -3.337 1.416 13.547 1.00 75.43 C ATOM 1110 O ARG A 246 -4.198 2.298 13.440 1.00 52.34 O ATOM 1111 CB ARG A 246 -3.526 -1.073 12.965 1.00 52.24 C ATOM 1112 CG ARG A 246 -3.174 -2.481 13.517 1.00 50.33 C ATOM 1113 CD ARG A 246 -2.299 -3.319 12.569 1.00 2.00 C ATOM 1114 NE ARG A 246 -2.953 -3.662 11.303 1.00 5.30 N ATOM 1115 CZ ARG A 246 -2.326 -4.245 10.260 1.00 31.54 C ATOM 1116 NH1 ARG A 246 -1.030 -4.539 10.313 1.00 22.42 N ATOM 1117 NH2 ARG A 246 -3.021 -4.559 9.181 1.00 74.04 N ATOM 0 H ARG A 246 -5.780 -0.243 13.873 1.00 22.35 H new ATOM 0 HA ARG A 246 -3.021 -0.221 14.893 1.00 25.22 H new ATOM 0 HB2 ARG A 246 -4.447 -1.140 12.386 1.00 52.24 H new ATOM 0 HB3 ARG A 246 -2.741 -0.755 12.279 1.00 52.24 H new ATOM 0 HG2 ARG A 246 -2.656 -2.368 14.470 1.00 50.33 H new ATOM 0 HG3 ARG A 246 -4.098 -3.023 13.718 1.00 50.33 H new ATOM 0 HD2 ARG A 246 -1.382 -2.769 12.356 1.00 2.00 H new ATOM 0 HD3 ARG A 246 -2.008 -4.239 13.077 1.00 2.00 H new ATOM 0 HE ARG A 246 -3.945 -3.446 11.204 1.00 5.30 H new ATOM 0 HH11 ARG A 246 -0.492 -4.324 11.153 1.00 22.42 H new ATOM 0 HH12 ARG A 246 -0.574 -4.980 9.514 1.00 22.42 H new ATOM 0 HH21 ARG A 246 -4.021 -4.360 9.143 1.00 74.04 H new ATOM 0 HH22 ARG A 246 -2.558 -5.000 8.386 1.00 74.04 H new ATOM 1131 N GLY A 247 -2.043 1.609 13.243 1.00 42.14 N ATOM 1132 CA GLY A 247 -1.546 2.833 12.599 1.00 45.33 C ATOM 1133 C GLY A 247 -1.825 2.849 11.099 1.00 55.32 C ATOM 1134 O GLY A 247 -2.783 2.230 10.639 1.00 64.41 O ATOM 0 H GLY A 247 -1.315 0.922 13.437 1.00 42.14 H new ATOM 0 HA2 GLY A 247 -2.014 3.701 13.063 1.00 45.33 H new ATOM 0 HA3 GLY A 247 -0.473 2.920 12.768 1.00 45.33 H new ATOM 1138 N ASP A 248 -1.006 3.573 10.322 1.00 15.23 N ATOM 1139 CA ASP A 248 -1.132 3.600 8.846 1.00 61.45 C ATOM 1140 C ASP A 248 0.178 3.162 8.178 1.00 43.32 C ATOM 1141 O ASP A 248 1.245 3.234 8.779 1.00 63.21 O ATOM 1142 CB ASP A 248 -1.556 5.004 8.348 1.00 52.32 C ATOM 1143 CG ASP A 248 -0.523 6.097 8.658 1.00 12.52 C ATOM 1144 OD1 ASP A 248 -0.611 6.719 9.740 1.00 24.11 O ATOM 1145 OD2 ASP A 248 0.354 6.373 7.808 1.00 73.21 O ATOM 0 H ASP A 248 -0.247 4.150 10.685 1.00 15.23 H new ATOM 0 HA ASP A 248 -1.912 2.893 8.565 1.00 61.45 H new ATOM 0 HB2 ASP A 248 -1.721 4.965 7.271 1.00 52.32 H new ATOM 0 HB3 ASP A 248 -2.507 5.273 8.807 1.00 52.32 H new ATOM 1150 N LEU A 249 0.074 2.665 6.938 1.00 64.20 N ATOM 1151 CA LEU A 249 1.246 2.319 6.112 1.00 70.02 C ATOM 1152 C LEU A 249 1.191 3.126 4.808 1.00 10.42 C ATOM 1153 O LEU A 249 0.355 2.884 3.933 1.00 0.31 O ATOM 1154 CB LEU A 249 1.314 0.796 5.836 1.00 74.41 C ATOM 1155 CG LEU A 249 2.436 0.318 4.843 1.00 15.21 C ATOM 1156 CD1 LEU A 249 3.854 0.668 5.346 1.00 34.13 C ATOM 1157 CD2 LEU A 249 2.294 -1.189 4.554 1.00 43.42 C ATOM 0 H LEU A 249 -0.820 2.491 6.478 1.00 64.20 H new ATOM 0 HA LEU A 249 2.156 2.577 6.654 1.00 70.02 H new ATOM 0 HB2 LEU A 249 1.456 0.282 6.787 1.00 74.41 H new ATOM 0 HB3 LEU A 249 0.349 0.476 5.442 1.00 74.41 H new ATOM 0 HG LEU A 249 2.299 0.862 3.908 1.00 15.21 H new ATOM 0 HD11 LEU A 249 4.593 0.317 4.625 1.00 34.13 H new ATOM 0 HD12 LEU A 249 3.943 1.748 5.460 1.00 34.13 H new ATOM 0 HD13 LEU A 249 4.028 0.186 6.308 1.00 34.13 H new ATOM 0 HD21 LEU A 249 3.078 -1.503 3.865 1.00 43.42 H new ATOM 0 HD22 LEU A 249 2.384 -1.748 5.485 1.00 43.42 H new ATOM 0 HD23 LEU A 249 1.319 -1.383 4.107 1.00 43.42 H new ATOM 1169 N TYR A 250 2.089 4.097 4.709 1.00 44.32 N ATOM 1170 CA TYR A 250 2.148 5.041 3.597 1.00 41.34 C ATOM 1171 C TYR A 250 3.071 4.492 2.481 1.00 53.34 C ATOM 1172 O TYR A 250 4.293 4.428 2.656 1.00 14.12 O ATOM 1173 CB TYR A 250 2.662 6.397 4.149 1.00 22.34 C ATOM 1174 CG TYR A 250 2.481 7.576 3.198 1.00 52.14 C ATOM 1175 CD1 TYR A 250 1.234 8.194 3.064 1.00 14.21 C ATOM 1176 CD2 TYR A 250 3.550 8.083 2.454 1.00 43.04 C ATOM 1177 CE1 TYR A 250 1.061 9.274 2.233 1.00 50.32 C ATOM 1178 CE2 TYR A 250 3.379 9.159 1.619 1.00 74.12 C ATOM 1179 CZ TYR A 250 2.139 9.750 1.514 1.00 2.23 C ATOM 1180 OH TYR A 250 1.986 10.832 0.695 1.00 44.42 O ATOM 0 H TYR A 250 2.811 4.255 5.412 1.00 44.32 H new ATOM 0 HA TYR A 250 1.162 5.183 3.155 1.00 41.34 H new ATOM 0 HB2 TYR A 250 2.142 6.616 5.082 1.00 22.34 H new ATOM 0 HB3 TYR A 250 3.721 6.299 4.389 1.00 22.34 H new ATOM 0 HD1 TYR A 250 0.392 7.815 3.624 1.00 14.21 H new ATOM 0 HD2 TYR A 250 4.523 7.622 2.537 1.00 43.04 H new ATOM 0 HE1 TYR A 250 0.093 9.745 2.143 1.00 50.32 H new ATOM 0 HE2 TYR A 250 4.212 9.540 1.047 1.00 74.12 H new ATOM 0 HH TYR A 250 2.841 11.039 0.263 1.00 44.42 H new ATOM 1190 N LEU A 251 2.466 4.078 1.349 1.00 14.03 N ATOM 1191 CA LEU A 251 3.190 3.506 0.193 1.00 62.42 C ATOM 1192 C LEU A 251 3.253 4.522 -0.960 1.00 54.21 C ATOM 1193 O LEU A 251 2.216 4.982 -1.446 1.00 23.25 O ATOM 1194 CB LEU A 251 2.493 2.202 -0.295 1.00 42.34 C ATOM 1195 CG LEU A 251 2.661 0.952 0.621 1.00 52.33 C ATOM 1196 CD1 LEU A 251 1.884 -0.244 0.055 1.00 10.13 C ATOM 1197 CD2 LEU A 251 4.147 0.594 0.824 1.00 62.23 C ATOM 0 H LEU A 251 1.457 4.131 1.209 1.00 14.03 H new ATOM 0 HA LEU A 251 4.205 3.268 0.512 1.00 62.42 H new ATOM 0 HB2 LEU A 251 1.428 2.404 -0.408 1.00 42.34 H new ATOM 0 HB3 LEU A 251 2.878 1.957 -1.285 1.00 42.34 H new ATOM 0 HG LEU A 251 2.247 1.200 1.598 1.00 52.33 H new ATOM 0 HD11 LEU A 251 2.015 -1.106 0.710 1.00 10.13 H new ATOM 0 HD12 LEU A 251 0.825 0.007 -0.007 1.00 10.13 H new ATOM 0 HD13 LEU A 251 2.259 -0.484 -0.940 1.00 10.13 H new ATOM 0 HD21 LEU A 251 4.226 -0.282 1.468 1.00 62.23 H new ATOM 0 HD22 LEU A 251 4.604 0.377 -0.141 1.00 62.23 H new ATOM 0 HD23 LEU A 251 4.663 1.434 1.289 1.00 62.23 H new ATOM 1209 N GLU A 252 4.475 4.864 -1.393 1.00 53.42 N ATOM 1210 CA GLU A 252 4.698 5.689 -2.595 1.00 12.25 C ATOM 1211 C GLU A 252 4.678 4.795 -3.854 1.00 63.50 C ATOM 1212 O GLU A 252 5.588 3.980 -4.059 1.00 71.43 O ATOM 1213 CB GLU A 252 6.052 6.437 -2.493 1.00 54.44 C ATOM 1214 CG GLU A 252 6.161 7.441 -1.328 1.00 35.04 C ATOM 1215 CD GLU A 252 7.528 8.144 -1.287 1.00 33.14 C ATOM 1216 OE1 GLU A 252 7.683 9.212 -1.911 1.00 20.23 O ATOM 1217 OE2 GLU A 252 8.462 7.619 -0.649 1.00 60.34 O ATOM 0 H GLU A 252 5.335 4.579 -0.924 1.00 53.42 H new ATOM 0 HA GLU A 252 3.900 6.427 -2.669 1.00 12.25 H new ATOM 0 HB2 GLU A 252 6.849 5.700 -2.393 1.00 54.44 H new ATOM 0 HB3 GLU A 252 6.226 6.970 -3.428 1.00 54.44 H new ATOM 0 HG2 GLU A 252 5.373 8.189 -1.421 1.00 35.04 H new ATOM 0 HG3 GLU A 252 5.995 6.919 -0.385 1.00 35.04 H new ATOM 1224 N VAL A 253 3.627 4.956 -4.674 1.00 35.30 N ATOM 1225 CA VAL A 253 3.429 4.186 -5.915 1.00 10.44 C ATOM 1226 C VAL A 253 4.528 4.487 -6.957 1.00 13.45 C ATOM 1227 O VAL A 253 4.691 5.638 -7.395 1.00 43.24 O ATOM 1228 CB VAL A 253 2.018 4.488 -6.541 1.00 52.52 C ATOM 1229 CG1 VAL A 253 1.858 3.880 -7.954 1.00 11.23 C ATOM 1230 CG2 VAL A 253 0.890 4.010 -5.604 1.00 13.12 C ATOM 0 H VAL A 253 2.883 5.630 -4.493 1.00 35.30 H new ATOM 0 HA VAL A 253 3.488 3.131 -5.647 1.00 10.44 H new ATOM 0 HB VAL A 253 1.943 5.570 -6.652 1.00 52.52 H new ATOM 0 HG11 VAL A 253 0.867 4.117 -8.342 1.00 11.23 H new ATOM 0 HG12 VAL A 253 2.616 4.296 -8.617 1.00 11.23 H new ATOM 0 HG13 VAL A 253 1.977 2.798 -7.900 1.00 11.23 H new ATOM 0 HG21 VAL A 253 -0.077 4.229 -6.057 1.00 13.12 H new ATOM 0 HG22 VAL A 253 0.981 2.936 -5.444 1.00 13.12 H new ATOM 0 HG23 VAL A 253 0.968 4.527 -4.648 1.00 13.12 H new ATOM 1240 N ARG A 254 5.271 3.431 -7.328 1.00 1.43 N ATOM 1241 CA ARG A 254 6.240 3.448 -8.435 1.00 55.03 C ATOM 1242 C ARG A 254 5.800 2.403 -9.466 1.00 34.24 C ATOM 1243 O ARG A 254 5.744 1.206 -9.143 1.00 24.14 O ATOM 1244 CB ARG A 254 7.676 3.101 -7.942 1.00 24.22 C ATOM 1245 CG ARG A 254 8.191 3.934 -6.755 1.00 55.50 C ATOM 1246 CD ARG A 254 8.178 5.447 -6.999 1.00 33.34 C ATOM 1247 NE ARG A 254 8.732 6.179 -5.851 1.00 13.40 N ATOM 1248 CZ ARG A 254 8.189 7.259 -5.266 1.00 23.23 C ATOM 1249 NH1 ARG A 254 7.040 7.783 -5.701 1.00 41.23 N ATOM 1250 NH2 ARG A 254 8.822 7.810 -4.243 1.00 21.10 N ATOM 0 H ARG A 254 5.214 2.527 -6.859 1.00 1.43 H new ATOM 0 HA ARG A 254 6.266 4.448 -8.867 1.00 55.03 H new ATOM 0 HB2 ARG A 254 7.700 2.048 -7.661 1.00 24.22 H new ATOM 0 HB3 ARG A 254 8.367 3.224 -8.776 1.00 24.22 H new ATOM 0 HG2 ARG A 254 7.582 3.713 -5.879 1.00 55.50 H new ATOM 0 HG3 ARG A 254 9.209 3.623 -6.522 1.00 55.50 H new ATOM 0 HD2 ARG A 254 8.756 5.678 -7.894 1.00 33.34 H new ATOM 0 HD3 ARG A 254 7.157 5.778 -7.186 1.00 33.34 H new ATOM 0 HE ARG A 254 9.610 5.835 -5.463 1.00 13.40 H new ATOM 0 HH11 ARG A 254 6.555 7.362 -6.494 1.00 41.23 H new ATOM 0 HH12 ARG A 254 6.647 8.604 -5.240 1.00 41.23 H new ATOM 0 HH21 ARG A 254 9.703 7.414 -3.915 1.00 21.10 H new ATOM 0 HH22 ARG A 254 8.429 8.631 -3.782 1.00 21.10 H new ATOM 1264 N ILE A 255 5.482 2.845 -10.694 1.00 21.52 N ATOM 1265 CA ILE A 255 5.147 1.929 -11.789 1.00 25.05 C ATOM 1266 C ILE A 255 6.443 1.277 -12.314 1.00 31.12 C ATOM 1267 O ILE A 255 7.359 1.957 -12.797 1.00 43.14 O ATOM 1268 CB ILE A 255 4.332 2.625 -12.946 1.00 42.13 C ATOM 1269 CG1 ILE A 255 2.876 2.944 -12.460 1.00 52.51 C ATOM 1270 CG2 ILE A 255 4.316 1.770 -14.244 1.00 44.43 C ATOM 1271 CD1 ILE A 255 1.937 3.461 -13.537 1.00 54.10 C ATOM 0 H ILE A 255 5.451 3.832 -10.950 1.00 21.52 H new ATOM 0 HA ILE A 255 4.485 1.157 -11.396 1.00 25.05 H new ATOM 0 HB ILE A 255 4.833 3.561 -13.194 1.00 42.13 H new ATOM 0 HG12 ILE A 255 2.447 2.039 -12.029 1.00 52.51 H new ATOM 0 HG13 ILE A 255 2.930 3.683 -11.661 1.00 52.51 H new ATOM 0 HG21 ILE A 255 3.744 2.288 -15.014 1.00 44.43 H new ATOM 0 HG22 ILE A 255 5.338 1.618 -14.592 1.00 44.43 H new ATOM 0 HG23 ILE A 255 3.855 0.804 -14.038 1.00 44.43 H new ATOM 0 HD11 ILE A 255 0.956 3.652 -13.103 1.00 54.10 H new ATOM 0 HD12 ILE A 255 2.336 4.386 -13.954 1.00 54.10 H new ATOM 0 HD13 ILE A 255 1.845 2.716 -14.328 1.00 54.10 H new ATOM 1283 N THR A 256 6.492 -0.044 -12.169 1.00 13.13 N ATOM 1284 CA THR A 256 7.633 -0.872 -12.497 1.00 74.44 C ATOM 1285 C THR A 256 7.519 -1.318 -13.976 1.00 4.43 C ATOM 1286 O THR A 256 6.505 -1.959 -14.328 1.00 4.40 O ATOM 1287 CB THR A 256 7.653 -2.098 -11.526 1.00 12.43 C ATOM 1288 OG1 THR A 256 7.568 -1.643 -10.161 1.00 3.11 O ATOM 1289 CG2 THR A 256 8.910 -2.955 -11.687 1.00 52.45 C ATOM 1290 OXT THR A 256 8.420 -1.010 -14.782 1.00 36.99 O ATOM 0 H THR A 256 5.705 -0.581 -11.806 1.00 13.13 H new ATOM 0 HA THR A 256 8.567 -0.322 -12.379 1.00 74.44 H new ATOM 0 HB THR A 256 6.792 -2.717 -11.780 1.00 12.43 H new ATOM 0 HG1 THR A 256 7.114 -2.321 -9.618 1.00 3.11 H new ATOM 0 HG21 THR A 256 8.872 -3.792 -10.989 1.00 52.45 H new ATOM 0 HG22 THR A 256 8.963 -3.335 -12.707 1.00 52.45 H new ATOM 0 HG23 THR A 256 9.792 -2.349 -11.479 1.00 52.45 H new