USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 555 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 310 HIS : no HD1:sc= -3.6 K(o=-6.4,f=-8.4!) USER MOD Set 1.2: A 312 CYS SG : rot 39:sc= -2.77! USER MOD Set 2.1: A 290 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 294 MET CE :methyl 157:sc= 0 (180deg=-0.342) USER MOD Single : A 293 THR OG1 : rot 179:sc= 1.66 USER MOD Single : A 295 LYS NZ :NH3+ 150:sc= -0.171 (180deg=-0.93) USER MOD Single : A 301 THR OG1 : rot 180:sc= -0.0122 USER MOD Single : A 305 GLN :FLIP amide:sc= 0 F(o=-0.52,f=0) USER MOD Single : A 306 THR OG1 : rot 180:sc= 0 USER MOD Single : A 311 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 313 GLN : amide:sc= -0.0498 K(o=-0.05,f=-1.8!) USER MOD Single : A 318 TYR OH : rot 180:sc= 0 USER MOD Single : A 321 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 323 SER OG : rot 170:sc= -1.43 USER MOD Single : A 325 THR OG1 : rot 180:sc=-0.00762 USER MOD Single : A 330 THR OG1 : rot 46:sc= 0.088 USER MOD Single : A 331 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 334 HIS : +bothHN:sc= 0.889 K(o=0.89,f=-3.4!) USER MOD Single : A 336 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 337 THR OG1 : rot 82:sc= 0.125 USER MOD Single : A 338 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0257) USER MOD Single : A 340 THR OG1 : rot 85:sc= 0.46 USER MOD Single : A 341 GLN : amide:sc= -1.32 K(o=-1.3,f=-4.2!) USER MOD Single : A 342 TYR OH : rot 30:sc= 0 USER MOD Single : A 344 SER OG : rot -37:sc= 0.808 USER MOD Single : A 345 THR OG1 : rot -30:sc= 0.413 USER MOD Single : A 346 ASN : amide:sc= -0.0513 X(o=-0.051,f=-0.51) USER MOD Single : A 350 GLN : amide:sc= -0.666 X(o=-0.67,f=-0.63) USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 289 -19.603 2.208 3.073 1.00 0.00 N ATOM 2 CA PHE A 289 -18.218 1.866 2.642 1.00 0.00 C ATOM 3 C PHE A 289 -17.985 2.415 1.233 1.00 0.00 C ATOM 4 O PHE A 289 -17.075 2.012 0.538 1.00 0.00 O ATOM 5 CB PHE A 289 -18.055 0.338 2.623 1.00 0.00 C ATOM 6 CG PHE A 289 -17.628 -0.176 3.983 1.00 0.00 C ATOM 7 CD1 PHE A 289 -18.043 0.470 5.161 1.00 0.00 C ATOM 8 CD2 PHE A 289 -16.808 -1.305 4.061 1.00 0.00 C ATOM 9 CE1 PHE A 289 -17.633 -0.019 6.406 1.00 0.00 C ATOM 10 CE2 PHE A 289 -16.398 -1.792 5.306 1.00 0.00 C ATOM 11 CZ PHE A 289 -16.810 -1.148 6.480 1.00 0.00 C ATOM 0 HA PHE A 289 -17.497 2.302 3.334 1.00 0.00 H new ATOM 0 HB2 PHE A 289 -18.996 -0.129 2.332 1.00 0.00 H new ATOM 0 HB3 PHE A 289 -17.315 0.056 1.874 1.00 0.00 H new ATOM 0 HD1 PHE A 289 -18.677 1.342 5.105 1.00 0.00 H new ATOM 0 HD2 PHE A 289 -16.490 -1.803 3.157 1.00 0.00 H new ATOM 0 HE1 PHE A 289 -17.952 0.476 7.311 1.00 0.00 H new ATOM 0 HE2 PHE A 289 -15.764 -2.664 5.363 1.00 0.00 H new ATOM 0 HZ PHE A 289 -16.492 -1.523 7.442 1.00 0.00 H new ATOM 21 N SER A 290 -18.812 3.321 0.805 1.00 0.00 N ATOM 22 CA SER A 290 -18.663 3.894 -0.566 1.00 0.00 C ATOM 23 C SER A 290 -17.819 5.175 -0.525 1.00 0.00 C ATOM 24 O SER A 290 -16.954 5.377 -1.352 1.00 0.00 O ATOM 25 CB SER A 290 -20.058 4.177 -1.154 1.00 0.00 C ATOM 26 OG SER A 290 -20.226 3.411 -2.340 1.00 0.00 O ATOM 0 H SER A 290 -19.592 3.695 1.346 1.00 0.00 H new ATOM 0 HA SER A 290 -18.147 3.176 -1.203 1.00 0.00 H new ATOM 0 HB2 SER A 290 -20.831 3.922 -0.429 1.00 0.00 H new ATOM 0 HB3 SER A 290 -20.165 5.239 -1.374 1.00 0.00 H new ATOM 0 HG SER A 290 -21.113 3.585 -2.719 1.00 0.00 H new ATOM 32 N PRO A 291 -18.081 6.040 0.412 1.00 0.00 N ATOM 33 CA PRO A 291 -17.351 7.322 0.543 1.00 0.00 C ATOM 34 C PRO A 291 -16.092 7.225 1.415 1.00 0.00 C ATOM 35 O PRO A 291 -15.045 7.725 1.059 1.00 0.00 O ATOM 36 CB PRO A 291 -18.401 8.234 1.184 1.00 0.00 C ATOM 37 CG PRO A 291 -19.238 7.322 2.039 1.00 0.00 C ATOM 38 CD PRO A 291 -19.099 5.898 1.459 1.00 0.00 C ATOM 0 HA PRO A 291 -16.969 7.677 -0.414 1.00 0.00 H new ATOM 0 HB2 PRO A 291 -17.933 9.016 1.782 1.00 0.00 H new ATOM 0 HB3 PRO A 291 -19.007 8.732 0.427 1.00 0.00 H new ATOM 0 HG2 PRO A 291 -18.901 7.350 3.075 1.00 0.00 H new ATOM 0 HG3 PRO A 291 -20.281 7.639 2.034 1.00 0.00 H new ATOM 0 HD2 PRO A 291 -18.790 5.184 2.223 1.00 0.00 H new ATOM 0 HD3 PRO A 291 -20.044 5.539 1.051 1.00 0.00 H new ATOM 46 N GLU A 292 -16.187 6.615 2.565 1.00 0.00 N ATOM 47 CA GLU A 292 -14.993 6.530 3.469 1.00 0.00 C ATOM 48 C GLU A 292 -14.129 5.302 3.159 1.00 0.00 C ATOM 49 O GLU A 292 -12.928 5.404 2.984 1.00 0.00 O ATOM 50 CB GLU A 292 -15.466 6.467 4.929 1.00 0.00 C ATOM 51 CG GLU A 292 -16.288 5.192 5.170 1.00 0.00 C ATOM 52 CD GLU A 292 -17.167 5.366 6.414 1.00 0.00 C ATOM 53 OE1 GLU A 292 -16.618 5.621 7.473 1.00 0.00 O ATOM 54 OE2 GLU A 292 -18.374 5.239 6.285 1.00 0.00 O ATOM 0 H GLU A 292 -17.034 6.172 2.921 1.00 0.00 H new ATOM 0 HA GLU A 292 -14.382 7.418 3.304 1.00 0.00 H new ATOM 0 HB2 GLU A 292 -14.606 6.485 5.598 1.00 0.00 H new ATOM 0 HB3 GLU A 292 -16.068 7.345 5.161 1.00 0.00 H new ATOM 0 HG2 GLU A 292 -16.911 4.980 4.301 1.00 0.00 H new ATOM 0 HG3 GLU A 292 -15.622 4.339 5.301 1.00 0.00 H new ATOM 61 N THR A 293 -14.716 4.145 3.127 1.00 0.00 N ATOM 62 CA THR A 293 -13.919 2.911 2.877 1.00 0.00 C ATOM 63 C THR A 293 -13.379 2.872 1.457 1.00 0.00 C ATOM 64 O THR A 293 -12.208 2.640 1.234 1.00 0.00 O ATOM 65 CB THR A 293 -14.804 1.685 3.068 1.00 0.00 C ATOM 66 OG1 THR A 293 -15.400 1.719 4.357 1.00 0.00 O ATOM 67 CG2 THR A 293 -13.957 0.426 2.918 1.00 0.00 C ATOM 0 H THR A 293 -15.716 3.996 3.263 1.00 0.00 H new ATOM 0 HA THR A 293 -13.086 2.913 3.580 1.00 0.00 H new ATOM 0 HB THR A 293 -15.593 1.682 2.316 1.00 0.00 H new ATOM 0 HG1 THR A 293 -15.976 0.935 4.472 1.00 0.00 H new ATOM 0 HG21 THR A 293 -14.586 -0.454 3.054 1.00 0.00 H new ATOM 0 HG22 THR A 293 -13.511 0.404 1.923 1.00 0.00 H new ATOM 0 HG23 THR A 293 -13.167 0.427 3.669 1.00 0.00 H new ATOM 75 N MET A 294 -14.229 3.039 0.494 1.00 0.00 N ATOM 76 CA MET A 294 -13.763 2.941 -0.909 1.00 0.00 C ATOM 77 C MET A 294 -12.571 3.875 -1.127 1.00 0.00 C ATOM 78 O MET A 294 -11.698 3.589 -1.915 1.00 0.00 O ATOM 79 CB MET A 294 -14.917 3.281 -1.867 1.00 0.00 C ATOM 80 CG MET A 294 -14.783 2.461 -3.159 1.00 0.00 C ATOM 81 SD MET A 294 -16.248 2.720 -4.190 1.00 0.00 S ATOM 82 CE MET A 294 -17.256 1.396 -3.477 1.00 0.00 C ATOM 0 H MET A 294 -15.222 3.238 0.615 1.00 0.00 H new ATOM 0 HA MET A 294 -13.438 1.921 -1.115 1.00 0.00 H new ATOM 0 HB2 MET A 294 -15.873 3.068 -1.389 1.00 0.00 H new ATOM 0 HB3 MET A 294 -14.907 4.346 -2.099 1.00 0.00 H new ATOM 0 HG2 MET A 294 -13.886 2.760 -3.701 1.00 0.00 H new ATOM 0 HG3 MET A 294 -14.674 1.403 -2.922 1.00 0.00 H new ATOM 0 HE1 MET A 294 -18.311 1.608 -3.650 1.00 0.00 H new ATOM 0 HE2 MET A 294 -16.995 0.447 -3.946 1.00 0.00 H new ATOM 0 HE3 MET A 294 -17.070 1.334 -2.405 1.00 0.00 H new ATOM 92 N LYS A 295 -12.510 4.976 -0.431 1.00 0.00 N ATOM 93 CA LYS A 295 -11.345 5.884 -0.613 1.00 0.00 C ATOM 94 C LYS A 295 -10.092 5.144 -0.172 1.00 0.00 C ATOM 95 O LYS A 295 -9.138 5.031 -0.914 1.00 0.00 O ATOM 96 CB LYS A 295 -11.532 7.142 0.231 1.00 0.00 C ATOM 97 CG LYS A 295 -12.565 8.051 -0.446 1.00 0.00 C ATOM 98 CD LYS A 295 -12.958 9.205 0.490 1.00 0.00 C ATOM 99 CE LYS A 295 -11.913 10.325 0.416 1.00 0.00 C ATOM 100 NZ LYS A 295 -11.910 10.911 -0.955 1.00 0.00 N ATOM 0 H LYS A 295 -13.207 5.283 0.247 1.00 0.00 H new ATOM 0 HA LYS A 295 -11.257 6.179 -1.659 1.00 0.00 H new ATOM 0 HB2 LYS A 295 -11.865 6.876 1.234 1.00 0.00 H new ATOM 0 HB3 LYS A 295 -10.583 7.667 0.339 1.00 0.00 H new ATOM 0 HG2 LYS A 295 -12.155 8.450 -1.374 1.00 0.00 H new ATOM 0 HG3 LYS A 295 -13.450 7.472 -0.712 1.00 0.00 H new ATOM 0 HD2 LYS A 295 -13.938 9.592 0.210 1.00 0.00 H new ATOM 0 HD3 LYS A 295 -13.040 8.841 1.514 1.00 0.00 H new ATOM 0 HE2 LYS A 295 -12.138 11.096 1.152 1.00 0.00 H new ATOM 0 HE3 LYS A 295 -10.925 9.932 0.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 -11.636 11.913 -0.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 -11.231 10.396 -1.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 -12.861 10.833 -1.368 1.00 0.00 H new ATOM 114 N ALA A 296 -10.088 4.610 1.016 1.00 0.00 N ATOM 115 CA ALA A 296 -8.889 3.849 1.462 1.00 0.00 C ATOM 116 C ALA A 296 -8.597 2.779 0.405 1.00 0.00 C ATOM 117 O ALA A 296 -7.464 2.538 0.040 1.00 0.00 O ATOM 118 CB ALA A 296 -9.165 3.191 2.816 1.00 0.00 C ATOM 0 H ALA A 296 -10.852 4.666 1.690 1.00 0.00 H new ATOM 0 HA ALA A 296 -8.032 4.514 1.575 1.00 0.00 H new ATOM 0 HB1 ALA A 296 -8.284 2.636 3.137 1.00 0.00 H new ATOM 0 HB2 ALA A 296 -9.398 3.959 3.553 1.00 0.00 H new ATOM 0 HB3 ALA A 296 -10.010 2.509 2.723 1.00 0.00 H new ATOM 124 N ARG A 297 -9.629 2.159 -0.103 1.00 0.00 N ATOM 125 CA ARG A 297 -9.454 1.124 -1.157 1.00 0.00 C ATOM 126 C ARG A 297 -9.043 1.806 -2.465 1.00 0.00 C ATOM 127 O ARG A 297 -8.373 1.229 -3.298 1.00 0.00 O ATOM 128 CB ARG A 297 -10.780 0.390 -1.363 1.00 0.00 C ATOM 129 CG ARG A 297 -10.544 -0.886 -2.166 1.00 0.00 C ATOM 130 CD ARG A 297 -11.893 -1.483 -2.568 1.00 0.00 C ATOM 131 NE ARG A 297 -11.670 -2.748 -3.320 1.00 0.00 N ATOM 132 CZ ARG A 297 -12.657 -3.583 -3.495 1.00 0.00 C ATOM 133 NH1 ARG A 297 -13.839 -3.304 -3.014 1.00 0.00 N ATOM 134 NH2 ARG A 297 -12.465 -4.696 -4.148 1.00 0.00 N ATOM 0 H ARG A 297 -10.596 2.330 0.173 1.00 0.00 H new ATOM 0 HA ARG A 297 -8.684 0.413 -0.856 1.00 0.00 H new ATOM 0 HB2 ARG A 297 -11.225 0.147 -0.398 1.00 0.00 H new ATOM 0 HB3 ARG A 297 -11.486 1.035 -1.886 1.00 0.00 H new ATOM 0 HG2 ARG A 297 -9.951 -0.667 -3.054 1.00 0.00 H new ATOM 0 HG3 ARG A 297 -9.977 -1.604 -1.573 1.00 0.00 H new ATOM 0 HD2 ARG A 297 -12.496 -1.676 -1.681 1.00 0.00 H new ATOM 0 HD3 ARG A 297 -12.448 -0.774 -3.183 1.00 0.00 H new ATOM 0 HE ARG A 297 -10.747 -2.962 -3.698 1.00 0.00 H new ATOM 0 HH11 ARG A 297 -13.989 -2.434 -2.503 1.00 0.00 H new ATOM 0 HH12 ARG A 297 -14.612 -3.956 -3.150 1.00 0.00 H new ATOM 0 HH21 ARG A 297 -11.542 -4.915 -4.523 1.00 0.00 H new ATOM 0 HH22 ARG A 297 -13.238 -5.348 -4.284 1.00 0.00 H new ATOM 148 N ARG A 298 -9.442 3.036 -2.655 1.00 0.00 N ATOM 149 CA ARG A 298 -9.070 3.750 -3.906 1.00 0.00 C ATOM 150 C ARG A 298 -7.594 4.112 -3.825 1.00 0.00 C ATOM 151 O ARG A 298 -6.838 3.898 -4.750 1.00 0.00 O ATOM 152 CB ARG A 298 -9.915 5.019 -4.058 1.00 0.00 C ATOM 153 CG ARG A 298 -9.682 5.655 -5.446 1.00 0.00 C ATOM 154 CD ARG A 298 -10.621 5.026 -6.487 1.00 0.00 C ATOM 155 NE ARG A 298 -10.071 5.254 -7.854 1.00 0.00 N ATOM 156 CZ ARG A 298 -10.525 4.562 -8.865 1.00 0.00 C ATOM 157 NH1 ARG A 298 -11.461 3.671 -8.681 1.00 0.00 N ATOM 158 NH2 ARG A 298 -10.042 4.762 -10.062 1.00 0.00 N ATOM 0 H ARG A 298 -10.008 3.574 -1.998 1.00 0.00 H new ATOM 0 HA ARG A 298 -9.253 3.112 -4.771 1.00 0.00 H new ATOM 0 HB2 ARG A 298 -10.971 4.778 -3.933 1.00 0.00 H new ATOM 0 HB3 ARG A 298 -9.656 5.732 -3.275 1.00 0.00 H new ATOM 0 HG2 ARG A 298 -9.854 6.730 -5.394 1.00 0.00 H new ATOM 0 HG3 ARG A 298 -8.645 5.512 -5.749 1.00 0.00 H new ATOM 0 HD2 ARG A 298 -10.726 3.957 -6.299 1.00 0.00 H new ATOM 0 HD3 ARG A 298 -11.616 5.463 -6.406 1.00 0.00 H new ATOM 0 HE ARG A 298 -9.340 5.950 -8.000 1.00 0.00 H new ATOM 0 HH11 ARG A 298 -11.839 3.514 -7.747 1.00 0.00 H new ATOM 0 HH12 ARG A 298 -11.814 3.132 -9.471 1.00 0.00 H new ATOM 0 HH21 ARG A 298 -9.311 5.458 -10.207 1.00 0.00 H new ATOM 0 HH22 ARG A 298 -10.396 4.222 -10.852 1.00 0.00 H new ATOM 172 N ALA A 299 -7.164 4.631 -2.707 1.00 0.00 N ATOM 173 CA ALA A 299 -5.722 4.969 -2.558 1.00 0.00 C ATOM 174 C ALA A 299 -4.918 3.738 -2.970 1.00 0.00 C ATOM 175 O ALA A 299 -4.035 3.800 -3.800 1.00 0.00 O ATOM 176 CB ALA A 299 -5.426 5.316 -1.098 1.00 0.00 C ATOM 0 H ALA A 299 -7.746 4.834 -1.895 1.00 0.00 H new ATOM 0 HA ALA A 299 -5.458 5.825 -3.179 1.00 0.00 H new ATOM 0 HB1 ALA A 299 -4.370 5.563 -0.990 1.00 0.00 H new ATOM 0 HB2 ALA A 299 -6.032 6.171 -0.797 1.00 0.00 H new ATOM 0 HB3 ALA A 299 -5.665 4.461 -0.465 1.00 0.00 H new ATOM 182 N TRP A 300 -5.262 2.608 -2.415 1.00 0.00 N ATOM 183 CA TRP A 300 -4.575 1.340 -2.775 1.00 0.00 C ATOM 184 C TRP A 300 -4.479 1.232 -4.298 1.00 0.00 C ATOM 185 O TRP A 300 -3.492 0.771 -4.829 1.00 0.00 O ATOM 186 CB TRP A 300 -5.390 0.169 -2.236 1.00 0.00 C ATOM 187 CG TRP A 300 -5.479 0.173 -0.725 1.00 0.00 C ATOM 188 CD1 TRP A 300 -6.317 -0.640 -0.040 1.00 0.00 C ATOM 189 CD2 TRP A 300 -4.762 0.964 0.302 1.00 0.00 C ATOM 190 NE1 TRP A 300 -6.149 -0.443 1.311 1.00 0.00 N ATOM 191 CE2 TRP A 300 -5.213 0.527 1.579 1.00 0.00 C ATOM 192 CE3 TRP A 300 -3.776 1.987 0.282 1.00 0.00 C ATOM 193 CZ2 TRP A 300 -4.715 1.065 2.763 1.00 0.00 C ATOM 194 CZ3 TRP A 300 -3.282 2.526 1.481 1.00 0.00 C ATOM 195 CH2 TRP A 300 -3.748 2.062 2.715 1.00 0.00 C ATOM 0 H TRP A 300 -6.000 2.511 -1.718 1.00 0.00 H new ATOM 0 HA TRP A 300 -3.573 1.324 -2.346 1.00 0.00 H new ATOM 0 HB2 TRP A 300 -6.395 0.206 -2.656 1.00 0.00 H new ATOM 0 HB3 TRP A 300 -4.940 -0.766 -2.568 1.00 0.00 H new ATOM 0 HD1 TRP A 300 -7.011 -1.337 -0.486 1.00 0.00 H new ATOM 0 HE1 TRP A 300 -6.659 -0.957 2.030 1.00 0.00 H new ATOM 0 HE3 TRP A 300 -3.403 2.353 -0.663 1.00 0.00 H new ATOM 0 HZ2 TRP A 300 -5.079 0.709 3.715 1.00 0.00 H new ATOM 0 HZ3 TRP A 300 -2.536 3.306 1.450 1.00 0.00 H new ATOM 0 HH2 TRP A 300 -3.356 2.479 3.631 1.00 0.00 H new ATOM 206 N THR A 301 -5.489 1.655 -5.007 1.00 0.00 N ATOM 207 CA THR A 301 -5.438 1.572 -6.496 1.00 0.00 C ATOM 208 C THR A 301 -4.200 2.309 -7.022 1.00 0.00 C ATOM 209 O THR A 301 -3.389 1.759 -7.739 1.00 0.00 O ATOM 210 CB THR A 301 -6.680 2.232 -7.091 1.00 0.00 C ATOM 211 OG1 THR A 301 -7.836 1.791 -6.394 1.00 0.00 O ATOM 212 CG2 THR A 301 -6.795 1.863 -8.571 1.00 0.00 C ATOM 0 H THR A 301 -6.345 2.054 -4.622 1.00 0.00 H new ATOM 0 HA THR A 301 -5.394 0.522 -6.784 1.00 0.00 H new ATOM 0 HB THR A 301 -6.596 3.315 -6.995 1.00 0.00 H new ATOM 0 HG1 THR A 301 -8.631 2.217 -6.777 1.00 0.00 H new ATOM 0 HG21 THR A 301 -7.682 2.334 -8.996 1.00 0.00 H new ATOM 0 HG22 THR A 301 -5.909 2.211 -9.103 1.00 0.00 H new ATOM 0 HG23 THR A 301 -6.876 0.781 -8.671 1.00 0.00 H new ATOM 220 N ASP A 302 -4.066 3.566 -6.690 1.00 0.00 N ATOM 221 CA ASP A 302 -2.903 4.357 -7.190 1.00 0.00 C ATOM 222 C ASP A 302 -1.585 3.666 -6.832 1.00 0.00 C ATOM 223 O ASP A 302 -0.731 3.471 -7.674 1.00 0.00 O ATOM 224 CB ASP A 302 -2.929 5.756 -6.570 1.00 0.00 C ATOM 225 CG ASP A 302 -4.150 6.521 -7.085 1.00 0.00 C ATOM 226 OD1 ASP A 302 -5.198 5.909 -7.211 1.00 0.00 O ATOM 227 OD2 ASP A 302 -4.016 7.706 -7.345 1.00 0.00 O ATOM 0 H ASP A 302 -4.713 4.080 -6.093 1.00 0.00 H new ATOM 0 HA ASP A 302 -2.975 4.432 -8.275 1.00 0.00 H new ATOM 0 HB2 ASP A 302 -2.965 5.683 -5.483 1.00 0.00 H new ATOM 0 HB3 ASP A 302 -2.016 6.295 -6.824 1.00 0.00 H new ATOM 232 N VAL A 303 -1.392 3.307 -5.596 1.00 0.00 N ATOM 233 CA VAL A 303 -0.111 2.652 -5.220 1.00 0.00 C ATOM 234 C VAL A 303 -0.086 1.209 -5.735 1.00 0.00 C ATOM 235 O VAL A 303 0.965 0.631 -5.920 1.00 0.00 O ATOM 236 CB VAL A 303 0.045 2.664 -3.697 1.00 0.00 C ATOM 237 CG1 VAL A 303 0.326 4.090 -3.218 1.00 0.00 C ATOM 238 CG2 VAL A 303 -1.236 2.151 -3.043 1.00 0.00 C ATOM 0 H VAL A 303 -2.059 3.437 -4.835 1.00 0.00 H new ATOM 0 HA VAL A 303 0.716 3.201 -5.671 1.00 0.00 H new ATOM 0 HB VAL A 303 0.877 2.018 -3.418 1.00 0.00 H new ATOM 0 HG11 VAL A 303 0.436 4.094 -2.134 1.00 0.00 H new ATOM 0 HG12 VAL A 303 1.245 4.454 -3.678 1.00 0.00 H new ATOM 0 HG13 VAL A 303 -0.503 4.739 -3.501 1.00 0.00 H new ATOM 0 HG21 VAL A 303 -1.120 2.161 -1.959 1.00 0.00 H new ATOM 0 HG22 VAL A 303 -2.071 2.793 -3.325 1.00 0.00 H new ATOM 0 HG23 VAL A 303 -1.432 1.132 -3.377 1.00 0.00 H new ATOM 248 N ILE A 304 -1.227 0.617 -5.980 1.00 0.00 N ATOM 249 CA ILE A 304 -1.231 -0.790 -6.485 1.00 0.00 C ATOM 250 C ILE A 304 -0.428 -0.857 -7.794 1.00 0.00 C ATOM 251 O ILE A 304 0.325 -1.783 -8.017 1.00 0.00 O ATOM 252 CB ILE A 304 -2.697 -1.260 -6.690 1.00 0.00 C ATOM 253 CG1 ILE A 304 -3.181 -2.029 -5.447 1.00 0.00 C ATOM 254 CG2 ILE A 304 -2.833 -2.171 -7.919 1.00 0.00 C ATOM 255 CD1 ILE A 304 -4.712 -2.125 -5.449 1.00 0.00 C ATOM 0 H ILE A 304 -2.146 1.041 -5.854 1.00 0.00 H new ATOM 0 HA ILE A 304 -0.762 -1.457 -5.761 1.00 0.00 H new ATOM 0 HB ILE A 304 -3.307 -0.370 -6.847 1.00 0.00 H new ATOM 0 HG12 ILE A 304 -2.746 -3.029 -5.436 1.00 0.00 H new ATOM 0 HG13 ILE A 304 -2.842 -1.524 -4.543 1.00 0.00 H new ATOM 0 HG21 ILE A 304 -3.873 -2.480 -8.030 1.00 0.00 H new ATOM 0 HG22 ILE A 304 -2.518 -1.629 -8.811 1.00 0.00 H new ATOM 0 HG23 ILE A 304 -2.205 -3.052 -7.790 1.00 0.00 H new ATOM 0 HD11 ILE A 304 -5.043 -2.671 -4.566 1.00 0.00 H new ATOM 0 HD12 ILE A 304 -5.139 -1.122 -5.438 1.00 0.00 H new ATOM 0 HD13 ILE A 304 -5.042 -2.650 -6.345 1.00 0.00 H new ATOM 267 N GLN A 305 -0.579 0.107 -8.660 1.00 0.00 N ATOM 268 CA GLN A 305 0.186 0.066 -9.939 1.00 0.00 C ATOM 269 C GLN A 305 1.642 0.463 -9.669 1.00 0.00 C ATOM 270 O GLN A 305 2.556 -0.028 -10.301 1.00 0.00 O ATOM 271 CB GLN A 305 -0.460 1.014 -10.970 1.00 0.00 C ATOM 272 CG GLN A 305 0.021 2.457 -10.761 1.00 0.00 C ATOM 273 CD GLN A 305 -0.932 3.430 -11.457 1.00 0.00 C ATOM 274 OE1 GLN A 305 -1.807 4.088 -10.747 1.00 0.00 O flip ATOM 275 NE2 GLN A 305 -0.877 3.595 -12.659 1.00 0.00 N flip ATOM 0 H GLN A 305 -1.192 0.913 -8.540 1.00 0.00 H new ATOM 0 HA GLN A 305 0.166 -0.944 -10.349 1.00 0.00 H new ATOM 0 HB2 GLN A 305 -0.211 0.685 -11.979 1.00 0.00 H new ATOM 0 HB3 GLN A 305 -1.545 0.971 -10.880 1.00 0.00 H new ATOM 0 HG2 GLN A 305 0.070 2.682 -9.696 1.00 0.00 H new ATOM 0 HG3 GLN A 305 1.029 2.575 -11.159 1.00 0.00 H new ATOM 0 HE21 GLN A 305 -0.193 3.080 -13.214 1.00 0.00 H new ATOM 0 HE22 GLN A 305 -1.515 4.248 -13.114 1.00 0.00 H new ATOM 284 N THR A 306 1.867 1.351 -8.736 1.00 0.00 N ATOM 285 CA THR A 306 3.268 1.764 -8.442 1.00 0.00 C ATOM 286 C THR A 306 4.016 0.620 -7.742 1.00 0.00 C ATOM 287 O THR A 306 5.231 0.597 -7.710 1.00 0.00 O ATOM 288 CB THR A 306 3.281 2.987 -7.539 1.00 0.00 C ATOM 289 OG1 THR A 306 2.610 4.061 -8.183 1.00 0.00 O ATOM 290 CG2 THR A 306 4.729 3.380 -7.242 1.00 0.00 C ATOM 0 H THR A 306 1.148 1.803 -8.171 1.00 0.00 H new ATOM 0 HA THR A 306 3.760 2.005 -9.385 1.00 0.00 H new ATOM 0 HB THR A 306 2.770 2.758 -6.604 1.00 0.00 H new ATOM 0 HG1 THR A 306 2.617 4.848 -7.599 1.00 0.00 H new ATOM 0 HG21 THR A 306 4.743 4.257 -6.595 1.00 0.00 H new ATOM 0 HG22 THR A 306 5.236 2.553 -6.744 1.00 0.00 H new ATOM 0 HG23 THR A 306 5.242 3.610 -8.176 1.00 0.00 H new ATOM 298 N LEU A 307 3.314 -0.326 -7.174 1.00 0.00 N ATOM 299 CA LEU A 307 4.019 -1.447 -6.477 1.00 0.00 C ATOM 300 C LEU A 307 4.553 -2.444 -7.519 1.00 0.00 C ATOM 301 O LEU A 307 5.749 -2.588 -7.690 1.00 0.00 O ATOM 302 CB LEU A 307 3.031 -2.161 -5.521 1.00 0.00 C ATOM 303 CG LEU A 307 3.181 -1.668 -4.061 1.00 0.00 C ATOM 304 CD1 LEU A 307 4.633 -1.855 -3.557 1.00 0.00 C ATOM 305 CD2 LEU A 307 2.766 -0.187 -3.959 1.00 0.00 C ATOM 0 H LEU A 307 2.295 -0.373 -7.161 1.00 0.00 H new ATOM 0 HA LEU A 307 4.855 -1.052 -5.900 1.00 0.00 H new ATOM 0 HB2 LEU A 307 2.009 -1.988 -5.859 1.00 0.00 H new ATOM 0 HB3 LEU A 307 3.202 -3.237 -5.560 1.00 0.00 H new ATOM 0 HG LEU A 307 2.525 -2.266 -3.429 1.00 0.00 H new ATOM 0 HD11 LEU A 307 4.710 -1.501 -2.529 1.00 0.00 H new ATOM 0 HD12 LEU A 307 4.899 -2.911 -3.597 1.00 0.00 H new ATOM 0 HD13 LEU A 307 5.314 -1.285 -4.189 1.00 0.00 H new ATOM 0 HD21 LEU A 307 2.875 0.151 -2.929 1.00 0.00 H new ATOM 0 HD22 LEU A 307 3.403 0.415 -4.608 1.00 0.00 H new ATOM 0 HD23 LEU A 307 1.727 -0.078 -4.269 1.00 0.00 H new ATOM 317 N ARG A 308 3.685 -3.134 -8.214 1.00 0.00 N ATOM 318 CA ARG A 308 4.162 -4.113 -9.236 1.00 0.00 C ATOM 319 C ARG A 308 5.170 -3.410 -10.144 1.00 0.00 C ATOM 320 O ARG A 308 5.945 -4.028 -10.849 1.00 0.00 O ATOM 321 CB ARG A 308 2.970 -4.611 -10.063 1.00 0.00 C ATOM 322 CG ARG A 308 3.346 -5.918 -10.776 1.00 0.00 C ATOM 323 CD ARG A 308 2.395 -6.160 -11.951 1.00 0.00 C ATOM 324 NE ARG A 308 2.743 -7.454 -12.603 1.00 0.00 N ATOM 325 CZ ARG A 308 1.918 -7.996 -13.455 1.00 0.00 C ATOM 326 NH1 ARG A 308 0.801 -7.391 -13.754 1.00 0.00 N ATOM 327 NH2 ARG A 308 2.213 -9.138 -14.011 1.00 0.00 N ATOM 0 H ARG A 308 2.672 -3.062 -8.119 1.00 0.00 H new ATOM 0 HA ARG A 308 4.634 -4.967 -8.751 1.00 0.00 H new ATOM 0 HB2 ARG A 308 2.108 -4.773 -9.416 1.00 0.00 H new ATOM 0 HB3 ARG A 308 2.682 -3.856 -10.795 1.00 0.00 H new ATOM 0 HG2 ARG A 308 4.374 -5.865 -11.134 1.00 0.00 H new ATOM 0 HG3 ARG A 308 3.294 -6.752 -10.077 1.00 0.00 H new ATOM 0 HD2 ARG A 308 1.363 -6.181 -11.601 1.00 0.00 H new ATOM 0 HD3 ARG A 308 2.471 -5.344 -12.670 1.00 0.00 H new ATOM 0 HE ARG A 308 3.626 -7.915 -12.383 1.00 0.00 H new ATOM 0 HH11 ARG A 308 0.574 -6.495 -13.321 1.00 0.00 H new ATOM 0 HH12 ARG A 308 0.155 -7.814 -14.420 1.00 0.00 H new ATOM 0 HH21 ARG A 308 3.089 -9.607 -13.779 1.00 0.00 H new ATOM 0 HH22 ARG A 308 1.568 -9.562 -14.678 1.00 0.00 H new ATOM 341 N GLU A 309 5.157 -2.112 -10.108 1.00 0.00 N ATOM 342 CA GLU A 309 6.093 -1.301 -10.933 1.00 0.00 C ATOM 343 C GLU A 309 7.524 -1.820 -10.743 1.00 0.00 C ATOM 344 O GLU A 309 8.323 -1.794 -11.657 1.00 0.00 O ATOM 345 CB GLU A 309 5.967 0.150 -10.443 1.00 0.00 C ATOM 346 CG GLU A 309 6.170 1.166 -11.567 1.00 0.00 C ATOM 347 CD GLU A 309 5.086 0.994 -12.637 1.00 0.00 C ATOM 348 OE1 GLU A 309 3.919 1.045 -12.284 1.00 0.00 O ATOM 349 OE2 GLU A 309 5.443 0.816 -13.789 1.00 0.00 O ATOM 0 H GLU A 309 4.522 -1.564 -9.528 1.00 0.00 H new ATOM 0 HA GLU A 309 5.857 -1.366 -11.995 1.00 0.00 H new ATOM 0 HB2 GLU A 309 4.982 0.296 -9.999 1.00 0.00 H new ATOM 0 HB3 GLU A 309 6.701 0.330 -9.658 1.00 0.00 H new ATOM 0 HG2 GLU A 309 6.136 2.178 -11.163 1.00 0.00 H new ATOM 0 HG3 GLU A 309 7.156 1.034 -12.013 1.00 0.00 H new ATOM 356 N HIS A 310 7.847 -2.300 -9.561 1.00 0.00 N ATOM 357 CA HIS A 310 9.224 -2.836 -9.303 1.00 0.00 C ATOM 358 C HIS A 310 9.130 -4.220 -8.641 1.00 0.00 C ATOM 359 O HIS A 310 8.209 -4.972 -8.894 1.00 0.00 O ATOM 360 CB HIS A 310 10.008 -1.854 -8.422 1.00 0.00 C ATOM 361 CG HIS A 310 9.513 -1.883 -7.001 1.00 0.00 C ATOM 362 ND1 HIS A 310 10.246 -2.474 -5.985 1.00 0.00 N ATOM 363 CD2 HIS A 310 8.394 -1.356 -6.400 1.00 0.00 C ATOM 364 CE1 HIS A 310 9.575 -2.285 -4.837 1.00 0.00 C ATOM 365 NE2 HIS A 310 8.436 -1.613 -5.032 1.00 0.00 N ATOM 0 H HIS A 310 7.213 -2.343 -8.763 1.00 0.00 H new ATOM 0 HA HIS A 310 9.756 -2.946 -10.248 1.00 0.00 H new ATOM 0 HB2 HIS A 310 11.068 -2.107 -8.446 1.00 0.00 H new ATOM 0 HB3 HIS A 310 9.912 -0.845 -8.823 1.00 0.00 H new ATOM 0 HD2 HIS A 310 7.604 -0.825 -6.910 1.00 0.00 H new ATOM 0 HE1 HIS A 310 9.915 -2.634 -3.873 1.00 0.00 H new ATOM 0 HE2 HIS A 310 7.746 -1.346 -4.330 1.00 0.00 H new ATOM 373 N LYS A 311 10.091 -4.584 -7.831 1.00 0.00 N ATOM 374 CA LYS A 311 10.068 -5.945 -7.201 1.00 0.00 C ATOM 375 C LYS A 311 9.199 -5.981 -5.934 1.00 0.00 C ATOM 376 O LYS A 311 9.695 -6.168 -4.842 1.00 0.00 O ATOM 377 CB LYS A 311 11.501 -6.370 -6.859 1.00 0.00 C ATOM 378 CG LYS A 311 12.262 -5.193 -6.231 1.00 0.00 C ATOM 379 CD LYS A 311 13.514 -5.709 -5.494 1.00 0.00 C ATOM 380 CE LYS A 311 13.158 -6.125 -4.059 1.00 0.00 C ATOM 381 NZ LYS A 311 13.151 -4.919 -3.183 1.00 0.00 N ATOM 0 H LYS A 311 10.889 -4.002 -7.577 1.00 0.00 H new ATOM 0 HA LYS A 311 9.629 -6.638 -7.918 1.00 0.00 H new ATOM 0 HB2 LYS A 311 11.484 -7.213 -6.168 1.00 0.00 H new ATOM 0 HB3 LYS A 311 12.014 -6.706 -7.760 1.00 0.00 H new ATOM 0 HG2 LYS A 311 12.552 -4.482 -7.005 1.00 0.00 H new ATOM 0 HG3 LYS A 311 11.614 -4.660 -5.535 1.00 0.00 H new ATOM 0 HD2 LYS A 311 13.936 -6.558 -6.031 1.00 0.00 H new ATOM 0 HD3 LYS A 311 14.278 -4.932 -5.475 1.00 0.00 H new ATOM 0 HE2 LYS A 311 12.181 -6.608 -4.040 1.00 0.00 H new ATOM 0 HE3 LYS A 311 13.880 -6.853 -3.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 12.910 -5.198 -2.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 14.092 -4.477 -3.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 12.446 -4.240 -3.533 1.00 0.00 H new ATOM 395 N CYS A 312 7.908 -5.857 -6.078 1.00 0.00 N ATOM 396 CA CYS A 312 7.007 -5.939 -4.890 1.00 0.00 C ATOM 397 C CYS A 312 5.581 -6.212 -5.374 1.00 0.00 C ATOM 398 O CYS A 312 4.893 -5.334 -5.859 1.00 0.00 O ATOM 399 CB CYS A 312 7.048 -4.641 -4.082 1.00 0.00 C ATOM 400 SG CYS A 312 8.478 -4.668 -2.971 1.00 0.00 S ATOM 0 H CYS A 312 7.436 -5.702 -6.969 1.00 0.00 H new ATOM 0 HA CYS A 312 7.343 -6.747 -4.240 1.00 0.00 H new ATOM 0 HB2 CYS A 312 7.111 -3.784 -4.753 1.00 0.00 H new ATOM 0 HB3 CYS A 312 6.129 -4.529 -3.507 1.00 0.00 H new ATOM 0 HG CYS A 312 9.489 -5.214 -3.579 1.00 0.00 H new ATOM 406 N GLN A 313 5.146 -7.432 -5.260 1.00 0.00 N ATOM 407 CA GLN A 313 3.777 -7.796 -5.727 1.00 0.00 C ATOM 408 C GLN A 313 2.707 -7.262 -4.745 1.00 0.00 C ATOM 409 O GLN A 313 2.677 -7.660 -3.599 1.00 0.00 O ATOM 410 CB GLN A 313 3.675 -9.321 -5.814 1.00 0.00 C ATOM 411 CG GLN A 313 4.709 -9.838 -6.820 1.00 0.00 C ATOM 412 CD GLN A 313 4.443 -11.313 -7.127 1.00 0.00 C ATOM 413 OE1 GLN A 313 3.338 -11.790 -6.960 1.00 0.00 O ATOM 414 NE2 GLN A 313 5.416 -12.058 -7.575 1.00 0.00 N ATOM 0 H GLN A 313 5.683 -8.202 -4.860 1.00 0.00 H new ATOM 0 HA GLN A 313 3.602 -7.349 -6.706 1.00 0.00 H new ATOM 0 HB2 GLN A 313 3.849 -9.766 -4.834 1.00 0.00 H new ATOM 0 HB3 GLN A 313 2.671 -9.613 -6.123 1.00 0.00 H new ATOM 0 HG2 GLN A 313 4.661 -9.252 -7.738 1.00 0.00 H new ATOM 0 HG3 GLN A 313 5.714 -9.717 -6.416 1.00 0.00 H new ATOM 0 HE21 GLN A 313 6.343 -11.656 -7.715 1.00 0.00 H new ATOM 0 HE22 GLN A 313 5.250 -13.042 -7.785 1.00 0.00 H new ATOM 423 N PRO A 314 1.824 -6.371 -5.174 1.00 0.00 N ATOM 424 CA PRO A 314 0.756 -5.809 -4.288 1.00 0.00 C ATOM 425 C PRO A 314 -0.495 -6.699 -4.222 1.00 0.00 C ATOM 426 O PRO A 314 -0.789 -7.451 -5.129 1.00 0.00 O ATOM 427 CB PRO A 314 0.420 -4.483 -4.966 1.00 0.00 C ATOM 428 CG PRO A 314 0.596 -4.763 -6.424 1.00 0.00 C ATOM 429 CD PRO A 314 1.743 -5.782 -6.529 1.00 0.00 C ATOM 0 HA PRO A 314 1.090 -5.719 -3.254 1.00 0.00 H new ATOM 0 HB2 PRO A 314 -0.599 -4.167 -4.741 1.00 0.00 H new ATOM 0 HB3 PRO A 314 1.082 -3.685 -4.631 1.00 0.00 H new ATOM 0 HG2 PRO A 314 -0.321 -5.163 -6.857 1.00 0.00 H new ATOM 0 HG3 PRO A 314 0.835 -3.850 -6.970 1.00 0.00 H new ATOM 0 HD2 PRO A 314 1.534 -6.541 -7.282 1.00 0.00 H new ATOM 0 HD3 PRO A 314 2.679 -5.301 -6.812 1.00 0.00 H new ATOM 437 N ARG A 315 -1.234 -6.601 -3.148 1.00 0.00 N ATOM 438 CA ARG A 315 -2.477 -7.417 -2.996 1.00 0.00 C ATOM 439 C ARG A 315 -3.484 -6.631 -2.145 1.00 0.00 C ATOM 440 O ARG A 315 -3.138 -6.086 -1.116 1.00 0.00 O ATOM 441 CB ARG A 315 -2.137 -8.737 -2.289 1.00 0.00 C ATOM 442 CG ARG A 315 -1.133 -8.475 -1.140 1.00 0.00 C ATOM 443 CD ARG A 315 0.330 -8.643 -1.617 1.00 0.00 C ATOM 444 NE ARG A 315 0.830 -9.973 -1.164 1.00 0.00 N ATOM 445 CZ ARG A 315 1.934 -10.466 -1.656 1.00 0.00 C ATOM 446 NH1 ARG A 315 2.598 -9.811 -2.567 1.00 0.00 N ATOM 447 NH2 ARG A 315 2.368 -11.624 -1.241 1.00 0.00 N ATOM 0 H ARG A 315 -1.028 -5.985 -2.362 1.00 0.00 H new ATOM 0 HA ARG A 315 -2.903 -7.630 -3.976 1.00 0.00 H new ATOM 0 HB2 ARG A 315 -3.045 -9.192 -1.894 1.00 0.00 H new ATOM 0 HB3 ARG A 315 -1.711 -9.443 -3.002 1.00 0.00 H new ATOM 0 HG2 ARG A 315 -1.277 -7.467 -0.752 1.00 0.00 H new ATOM 0 HG3 ARG A 315 -1.331 -9.164 -0.318 1.00 0.00 H new ATOM 0 HD2 ARG A 315 0.384 -8.569 -2.703 1.00 0.00 H new ATOM 0 HD3 ARG A 315 0.954 -7.846 -1.211 1.00 0.00 H new ATOM 0 HE ARG A 315 0.306 -10.501 -0.466 1.00 0.00 H new ATOM 0 HH11 ARG A 315 2.255 -8.909 -2.898 1.00 0.00 H new ATOM 0 HH12 ARG A 315 3.460 -10.200 -2.948 1.00 0.00 H new ATOM 0 HH21 ARG A 315 1.845 -12.141 -0.534 1.00 0.00 H new ATOM 0 HH22 ARG A 315 3.230 -12.012 -1.623 1.00 0.00 H new ATOM 461 N LEU A 316 -4.727 -6.572 -2.562 1.00 0.00 N ATOM 462 CA LEU A 316 -5.760 -5.832 -1.785 1.00 0.00 C ATOM 463 C LEU A 316 -6.608 -6.837 -1.011 1.00 0.00 C ATOM 464 O LEU A 316 -7.241 -7.708 -1.576 1.00 0.00 O ATOM 465 CB LEU A 316 -6.643 -5.043 -2.758 1.00 0.00 C ATOM 466 CG LEU A 316 -7.208 -3.793 -2.074 1.00 0.00 C ATOM 467 CD1 LEU A 316 -7.984 -2.948 -3.093 1.00 0.00 C ATOM 468 CD2 LEU A 316 -8.145 -4.208 -0.935 1.00 0.00 C ATOM 0 H LEU A 316 -5.068 -7.011 -3.417 1.00 0.00 H new ATOM 0 HA LEU A 316 -5.288 -5.142 -1.086 1.00 0.00 H new ATOM 0 HB2 LEU A 316 -6.062 -4.755 -3.634 1.00 0.00 H new ATOM 0 HB3 LEU A 316 -7.460 -5.673 -3.110 1.00 0.00 H new ATOM 0 HG LEU A 316 -6.385 -3.204 -1.670 1.00 0.00 H new ATOM 0 HD11 LEU A 316 -8.383 -2.061 -2.601 1.00 0.00 H new ATOM 0 HD12 LEU A 316 -7.316 -2.646 -3.899 1.00 0.00 H new ATOM 0 HD13 LEU A 316 -8.805 -3.536 -3.503 1.00 0.00 H new ATOM 0 HD21 LEU A 316 -8.545 -3.317 -0.450 1.00 0.00 H new ATOM 0 HD22 LEU A 316 -8.966 -4.802 -1.337 1.00 0.00 H new ATOM 0 HD23 LEU A 316 -7.592 -4.800 -0.206 1.00 0.00 H new ATOM 480 N LEU A 317 -6.620 -6.710 0.278 1.00 0.00 N ATOM 481 CA LEU A 317 -7.416 -7.636 1.144 1.00 0.00 C ATOM 482 C LEU A 317 -8.636 -6.874 1.647 1.00 0.00 C ATOM 483 O LEU A 317 -9.119 -6.011 0.954 1.00 0.00 O ATOM 484 CB LEU A 317 -6.552 -8.103 2.325 1.00 0.00 C ATOM 485 CG LEU A 317 -5.114 -8.324 1.848 1.00 0.00 C ATOM 486 CD1 LEU A 317 -4.253 -8.790 3.014 1.00 0.00 C ATOM 487 CD2 LEU A 317 -5.102 -9.390 0.753 1.00 0.00 C ATOM 0 H LEU A 317 -6.104 -5.992 0.787 1.00 0.00 H new ATOM 0 HA LEU A 317 -7.733 -8.515 0.582 1.00 0.00 H new ATOM 0 HB2 LEU A 317 -6.572 -7.359 3.121 1.00 0.00 H new ATOM 0 HB3 LEU A 317 -6.955 -9.026 2.741 1.00 0.00 H new ATOM 0 HG LEU A 317 -4.716 -7.389 1.455 1.00 0.00 H new ATOM 0 HD11 LEU A 317 -3.230 -8.946 2.671 1.00 0.00 H new ATOM 0 HD12 LEU A 317 -4.261 -8.033 3.798 1.00 0.00 H new ATOM 0 HD13 LEU A 317 -4.650 -9.725 3.409 1.00 0.00 H new ATOM 0 HD21 LEU A 317 -4.079 -9.549 0.412 1.00 0.00 H new ATOM 0 HD22 LEU A 317 -5.502 -10.323 1.149 1.00 0.00 H new ATOM 0 HD23 LEU A 317 -5.717 -9.059 -0.084 1.00 0.00 H new ATOM 499 N TYR A 318 -9.104 -7.200 2.843 1.00 0.00 N ATOM 500 CA TYR A 318 -10.303 -6.527 3.493 1.00 0.00 C ATOM 501 C TYR A 318 -10.808 -5.318 2.663 1.00 0.00 C ATOM 502 O TYR A 318 -10.014 -4.627 2.079 1.00 0.00 O ATOM 503 CB TYR A 318 -9.851 -6.041 4.891 1.00 0.00 C ATOM 504 CG TYR A 318 -10.966 -6.175 5.904 1.00 0.00 C ATOM 505 CD1 TYR A 318 -11.298 -7.435 6.417 1.00 0.00 C ATOM 506 CD2 TYR A 318 -11.667 -5.039 6.326 1.00 0.00 C ATOM 507 CE1 TYR A 318 -12.333 -7.558 7.352 1.00 0.00 C ATOM 508 CE2 TYR A 318 -12.702 -5.162 7.259 1.00 0.00 C ATOM 509 CZ TYR A 318 -13.037 -6.422 7.772 1.00 0.00 C ATOM 510 OH TYR A 318 -14.058 -6.542 8.690 1.00 0.00 O ATOM 0 H TYR A 318 -8.689 -7.933 3.419 1.00 0.00 H new ATOM 0 HA TYR A 318 -11.127 -7.238 3.558 1.00 0.00 H new ATOM 0 HB2 TYR A 318 -8.987 -6.620 5.218 1.00 0.00 H new ATOM 0 HB3 TYR A 318 -9.533 -5.000 4.832 1.00 0.00 H new ATOM 0 HD1 TYR A 318 -10.756 -8.311 6.092 1.00 0.00 H new ATOM 0 HD2 TYR A 318 -11.409 -4.068 5.931 1.00 0.00 H new ATOM 0 HE1 TYR A 318 -12.589 -8.529 7.750 1.00 0.00 H new ATOM 0 HE2 TYR A 318 -13.243 -4.286 7.584 1.00 0.00 H new ATOM 0 HH TYR A 318 -14.440 -5.658 8.872 1.00 0.00 H new ATOM 520 N PRO A 319 -12.111 -5.056 2.619 1.00 0.00 N ATOM 521 CA PRO A 319 -12.703 -3.925 1.844 1.00 0.00 C ATOM 522 C PRO A 319 -11.725 -2.780 1.540 1.00 0.00 C ATOM 523 O PRO A 319 -11.866 -2.084 0.555 1.00 0.00 O ATOM 524 CB PRO A 319 -13.835 -3.486 2.761 1.00 0.00 C ATOM 525 CG PRO A 319 -14.370 -4.779 3.316 1.00 0.00 C ATOM 526 CD PRO A 319 -13.195 -5.791 3.300 1.00 0.00 C ATOM 0 HA PRO A 319 -13.016 -4.224 0.844 1.00 0.00 H new ATOM 0 HB2 PRO A 319 -13.476 -2.829 3.553 1.00 0.00 H new ATOM 0 HB3 PRO A 319 -14.602 -2.937 2.215 1.00 0.00 H new ATOM 0 HG2 PRO A 319 -14.746 -4.639 4.329 1.00 0.00 H new ATOM 0 HG3 PRO A 319 -15.203 -5.143 2.714 1.00 0.00 H new ATOM 0 HD2 PRO A 319 -12.907 -6.086 4.309 1.00 0.00 H new ATOM 0 HD3 PRO A 319 -13.459 -6.703 2.764 1.00 0.00 H new ATOM 534 N ALA A 320 -10.717 -2.608 2.346 1.00 0.00 N ATOM 535 CA ALA A 320 -9.713 -1.544 2.068 1.00 0.00 C ATOM 536 C ALA A 320 -8.417 -1.846 2.828 1.00 0.00 C ATOM 537 O ALA A 320 -7.936 -1.023 3.582 1.00 0.00 O ATOM 538 CB ALA A 320 -10.257 -0.185 2.508 1.00 0.00 C ATOM 0 H ALA A 320 -10.544 -3.159 3.187 1.00 0.00 H new ATOM 0 HA ALA A 320 -9.510 -1.519 0.997 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -9.516 0.588 2.301 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -11.173 0.035 1.960 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -10.470 -0.207 3.577 1.00 0.00 H new ATOM 544 N LYS A 321 -7.839 -3.019 2.635 1.00 0.00 N ATOM 545 CA LYS A 321 -6.562 -3.366 3.349 1.00 0.00 C ATOM 546 C LYS A 321 -5.475 -3.635 2.299 1.00 0.00 C ATOM 547 O LYS A 321 -5.707 -4.322 1.326 1.00 0.00 O ATOM 548 CB LYS A 321 -6.812 -4.605 4.219 1.00 0.00 C ATOM 549 CG LYS A 321 -5.486 -5.266 4.618 1.00 0.00 C ATOM 550 CD LYS A 321 -5.739 -6.318 5.719 1.00 0.00 C ATOM 551 CE LYS A 321 -5.738 -5.654 7.103 1.00 0.00 C ATOM 552 NZ LYS A 321 -5.736 -6.708 8.155 1.00 0.00 N ATOM 0 H LYS A 321 -8.197 -3.746 2.016 1.00 0.00 H new ATOM 0 HA LYS A 321 -6.232 -2.550 3.992 1.00 0.00 H new ATOM 0 HB2 LYS A 321 -7.366 -4.321 5.114 1.00 0.00 H new ATOM 0 HB3 LYS A 321 -7.430 -5.319 3.675 1.00 0.00 H new ATOM 0 HG2 LYS A 321 -5.028 -5.738 3.749 1.00 0.00 H new ATOM 0 HG3 LYS A 321 -4.786 -4.511 4.977 1.00 0.00 H new ATOM 0 HD2 LYS A 321 -6.695 -6.812 5.546 1.00 0.00 H new ATOM 0 HD3 LYS A 321 -4.970 -7.089 5.678 1.00 0.00 H new ATOM 0 HE2 LYS A 321 -4.862 -5.014 7.211 1.00 0.00 H new ATOM 0 HE3 LYS A 321 -6.615 -5.016 7.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 321 -5.735 -6.261 9.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 321 -6.585 -7.301 8.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 321 -4.887 -7.299 8.052 1.00 0.00 H new ATOM 566 N LEU A 322 -4.299 -3.066 2.474 1.00 0.00 N ATOM 567 CA LEU A 322 -3.200 -3.249 1.463 1.00 0.00 C ATOM 568 C LEU A 322 -2.019 -4.010 2.065 1.00 0.00 C ATOM 569 O LEU A 322 -1.510 -3.679 3.116 1.00 0.00 O ATOM 570 CB LEU A 322 -2.759 -1.850 0.992 1.00 0.00 C ATOM 571 CG LEU A 322 -1.610 -1.905 -0.046 1.00 0.00 C ATOM 572 CD1 LEU A 322 -0.261 -2.241 0.624 1.00 0.00 C ATOM 573 CD2 LEU A 322 -1.923 -2.940 -1.138 1.00 0.00 C ATOM 0 H LEU A 322 -4.053 -2.483 3.274 1.00 0.00 H new ATOM 0 HA LEU A 322 -3.564 -3.838 0.621 1.00 0.00 H new ATOM 0 HB2 LEU A 322 -3.613 -1.332 0.556 1.00 0.00 H new ATOM 0 HB3 LEU A 322 -2.437 -1.265 1.854 1.00 0.00 H new ATOM 0 HG LEU A 322 -1.528 -0.917 -0.500 1.00 0.00 H new ATOM 0 HD11 LEU A 322 0.523 -2.272 -0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 322 -0.022 -1.477 1.364 1.00 0.00 H new ATOM 0 HD13 LEU A 322 -0.330 -3.212 1.114 1.00 0.00 H new ATOM 0 HD21 LEU A 322 -1.106 -2.966 -1.859 1.00 0.00 H new ATOM 0 HD22 LEU A 322 -2.038 -3.924 -0.684 1.00 0.00 H new ATOM 0 HD23 LEU A 322 -2.847 -2.665 -1.646 1.00 0.00 H new ATOM 585 N SER A 323 -1.577 -5.031 1.367 1.00 0.00 N ATOM 586 CA SER A 323 -0.416 -5.858 1.828 1.00 0.00 C ATOM 587 C SER A 323 0.697 -5.758 0.780 1.00 0.00 C ATOM 588 O SER A 323 0.435 -5.592 -0.395 1.00 0.00 O ATOM 589 CB SER A 323 -0.877 -7.320 1.969 1.00 0.00 C ATOM 590 OG SER A 323 0.062 -8.187 1.339 1.00 0.00 O ATOM 0 H SER A 323 -1.981 -5.331 0.480 1.00 0.00 H new ATOM 0 HA SER A 323 -0.044 -5.503 2.789 1.00 0.00 H new ATOM 0 HB2 SER A 323 -0.975 -7.580 3.023 1.00 0.00 H new ATOM 0 HB3 SER A 323 -1.861 -7.445 1.517 1.00 0.00 H new ATOM 0 HG SER A 323 -0.147 -9.117 1.567 1.00 0.00 H new ATOM 596 N ILE A 324 1.937 -5.847 1.193 1.00 0.00 N ATOM 597 CA ILE A 324 3.064 -5.744 0.214 1.00 0.00 C ATOM 598 C ILE A 324 4.199 -6.697 0.606 1.00 0.00 C ATOM 599 O ILE A 324 4.456 -6.951 1.769 1.00 0.00 O ATOM 600 CB ILE A 324 3.602 -4.294 0.169 1.00 0.00 C ATOM 601 CG1 ILE A 324 3.453 -3.603 1.537 1.00 0.00 C ATOM 602 CG2 ILE A 324 2.841 -3.486 -0.881 1.00 0.00 C ATOM 603 CD1 ILE A 324 4.373 -4.257 2.575 1.00 0.00 C ATOM 0 H ILE A 324 2.218 -5.986 2.164 1.00 0.00 H new ATOM 0 HA ILE A 324 2.689 -6.020 -0.772 1.00 0.00 H new ATOM 0 HB ILE A 324 4.660 -4.339 -0.089 1.00 0.00 H new ATOM 0 HG12 ILE A 324 3.695 -2.544 1.444 1.00 0.00 H new ATOM 0 HG13 ILE A 324 2.417 -3.665 1.871 1.00 0.00 H new ATOM 0 HG21 ILE A 324 3.227 -2.467 -0.906 1.00 0.00 H new ATOM 0 HG22 ILE A 324 2.972 -3.947 -1.860 1.00 0.00 H new ATOM 0 HG23 ILE A 324 1.781 -3.467 -0.628 1.00 0.00 H new ATOM 0 HD11 ILE A 324 4.253 -3.755 3.535 1.00 0.00 H new ATOM 0 HD12 ILE A 324 4.111 -5.310 2.681 1.00 0.00 H new ATOM 0 HD13 ILE A 324 5.409 -4.172 2.248 1.00 0.00 H new ATOM 615 N THR A 325 4.885 -7.213 -0.385 1.00 0.00 N ATOM 616 CA THR A 325 6.024 -8.147 -0.139 1.00 0.00 C ATOM 617 C THR A 325 7.342 -7.370 -0.264 1.00 0.00 C ATOM 618 O THR A 325 7.681 -6.873 -1.319 1.00 0.00 O ATOM 619 CB THR A 325 5.971 -9.278 -1.188 1.00 0.00 C ATOM 620 OG1 THR A 325 4.929 -10.182 -0.839 1.00 0.00 O ATOM 621 CG2 THR A 325 7.307 -10.043 -1.235 1.00 0.00 C ATOM 0 H THR A 325 4.699 -7.022 -1.370 1.00 0.00 H new ATOM 0 HA THR A 325 5.958 -8.577 0.860 1.00 0.00 H new ATOM 0 HB THR A 325 5.785 -8.840 -2.169 1.00 0.00 H new ATOM 0 HG1 THR A 325 4.886 -10.903 -1.501 1.00 0.00 H new ATOM 0 HG21 THR A 325 7.247 -10.835 -1.981 1.00 0.00 H new ATOM 0 HG22 THR A 325 8.111 -9.356 -1.500 1.00 0.00 H new ATOM 0 HG23 THR A 325 7.511 -10.480 -0.257 1.00 0.00 H new ATOM 629 N ILE A 326 8.089 -7.262 0.810 1.00 0.00 N ATOM 630 CA ILE A 326 9.390 -6.517 0.767 1.00 0.00 C ATOM 631 C ILE A 326 10.446 -7.306 1.544 1.00 0.00 C ATOM 632 O ILE A 326 10.190 -7.807 2.620 1.00 0.00 O ATOM 633 CB ILE A 326 9.216 -5.138 1.413 1.00 0.00 C ATOM 634 CG1 ILE A 326 8.037 -4.414 0.764 1.00 0.00 C ATOM 635 CG2 ILE A 326 10.486 -4.308 1.211 1.00 0.00 C ATOM 636 CD1 ILE A 326 7.789 -3.096 1.497 1.00 0.00 C ATOM 0 H ILE A 326 7.853 -7.660 1.719 1.00 0.00 H new ATOM 0 HA ILE A 326 9.705 -6.395 -0.269 1.00 0.00 H new ATOM 0 HB ILE A 326 9.029 -5.265 2.479 1.00 0.00 H new ATOM 0 HG12 ILE A 326 8.247 -4.224 -0.289 1.00 0.00 H new ATOM 0 HG13 ILE A 326 7.145 -5.039 0.804 1.00 0.00 H new ATOM 0 HG21 ILE A 326 10.358 -3.329 1.672 1.00 0.00 H new ATOM 0 HG22 ILE A 326 11.331 -4.818 1.673 1.00 0.00 H new ATOM 0 HG23 ILE A 326 10.675 -4.185 0.144 1.00 0.00 H new ATOM 0 HD11 ILE A 326 6.949 -2.576 1.037 1.00 0.00 H new ATOM 0 HD12 ILE A 326 7.561 -3.299 2.543 1.00 0.00 H new ATOM 0 HD13 ILE A 326 8.680 -2.471 1.434 1.00 0.00 H new ATOM 648 N ASP A 327 11.633 -7.413 0.997 1.00 0.00 N ATOM 649 CA ASP A 327 12.733 -8.165 1.681 1.00 0.00 C ATOM 650 C ASP A 327 12.183 -9.433 2.335 1.00 0.00 C ATOM 651 O ASP A 327 12.719 -9.928 3.308 1.00 0.00 O ATOM 652 CB ASP A 327 13.386 -7.276 2.743 1.00 0.00 C ATOM 653 CG ASP A 327 12.331 -6.821 3.750 1.00 0.00 C ATOM 654 OD1 ASP A 327 11.926 -7.636 4.559 1.00 0.00 O ATOM 655 OD2 ASP A 327 11.945 -5.664 3.693 1.00 0.00 O ATOM 0 H ASP A 327 11.889 -7.007 0.097 1.00 0.00 H new ATOM 0 HA ASP A 327 13.479 -8.448 0.938 1.00 0.00 H new ATOM 0 HB2 ASP A 327 14.178 -7.824 3.253 1.00 0.00 H new ATOM 0 HB3 ASP A 327 13.850 -6.410 2.271 1.00 0.00 H new ATOM 660 N GLY A 328 11.120 -9.968 1.799 1.00 0.00 N ATOM 661 CA GLY A 328 10.530 -11.213 2.373 1.00 0.00 C ATOM 662 C GLY A 328 9.507 -10.864 3.458 1.00 0.00 C ATOM 663 O GLY A 328 8.352 -11.232 3.374 1.00 0.00 O ATOM 0 H GLY A 328 10.632 -9.595 0.985 1.00 0.00 H new ATOM 0 HA2 GLY A 328 10.051 -11.794 1.585 1.00 0.00 H new ATOM 0 HA3 GLY A 328 11.318 -11.837 2.794 1.00 0.00 H new ATOM 667 N GLU A 329 9.918 -10.166 4.482 1.00 0.00 N ATOM 668 CA GLU A 329 8.961 -9.814 5.573 1.00 0.00 C ATOM 669 C GLU A 329 7.788 -9.012 4.994 1.00 0.00 C ATOM 670 O GLU A 329 7.952 -7.926 4.476 1.00 0.00 O ATOM 671 CB GLU A 329 9.694 -8.989 6.656 1.00 0.00 C ATOM 672 CG GLU A 329 10.008 -9.870 7.871 1.00 0.00 C ATOM 673 CD GLU A 329 10.909 -9.102 8.837 1.00 0.00 C ATOM 674 OE1 GLU A 329 10.542 -7.999 9.207 1.00 0.00 O ATOM 675 OE2 GLU A 329 11.953 -9.627 9.188 1.00 0.00 O ATOM 0 H GLU A 329 10.871 -9.825 4.611 1.00 0.00 H new ATOM 0 HA GLU A 329 8.572 -10.726 6.026 1.00 0.00 H new ATOM 0 HB2 GLU A 329 10.617 -8.578 6.248 1.00 0.00 H new ATOM 0 HB3 GLU A 329 9.076 -8.144 6.960 1.00 0.00 H new ATOM 0 HG2 GLU A 329 9.084 -10.161 8.371 1.00 0.00 H new ATOM 0 HG3 GLU A 329 10.500 -10.789 7.550 1.00 0.00 H new ATOM 682 N THR A 330 6.606 -9.553 5.093 1.00 0.00 N ATOM 683 CA THR A 330 5.397 -8.850 4.566 1.00 0.00 C ATOM 684 C THR A 330 4.793 -7.959 5.656 1.00 0.00 C ATOM 685 O THR A 330 4.753 -8.319 6.816 1.00 0.00 O ATOM 686 CB THR A 330 4.354 -9.887 4.128 1.00 0.00 C ATOM 687 OG1 THR A 330 3.195 -9.216 3.651 1.00 0.00 O ATOM 688 CG2 THR A 330 3.976 -10.775 5.317 1.00 0.00 C ATOM 0 H THR A 330 6.422 -10.461 5.520 1.00 0.00 H new ATOM 0 HA THR A 330 5.687 -8.233 3.715 1.00 0.00 H new ATOM 0 HB THR A 330 4.772 -10.507 3.335 1.00 0.00 H new ATOM 0 HG1 THR A 330 3.461 -8.496 3.042 1.00 0.00 H new ATOM 0 HG21 THR A 330 3.235 -11.510 5.001 1.00 0.00 H new ATOM 0 HG22 THR A 330 4.864 -11.290 5.684 1.00 0.00 H new ATOM 0 HG23 THR A 330 3.559 -10.159 6.113 1.00 0.00 H new ATOM 696 N LYS A 331 4.301 -6.806 5.281 1.00 0.00 N ATOM 697 CA LYS A 331 3.663 -5.875 6.265 1.00 0.00 C ATOM 698 C LYS A 331 2.325 -5.447 5.666 1.00 0.00 C ATOM 699 O LYS A 331 2.120 -5.569 4.475 1.00 0.00 O ATOM 700 CB LYS A 331 4.569 -4.652 6.478 1.00 0.00 C ATOM 701 CG LYS A 331 4.086 -3.809 7.674 1.00 0.00 C ATOM 702 CD LYS A 331 4.451 -4.481 9.009 1.00 0.00 C ATOM 703 CE LYS A 331 4.397 -3.443 10.138 1.00 0.00 C ATOM 704 NZ LYS A 331 4.413 -4.139 11.456 1.00 0.00 N ATOM 0 H LYS A 331 4.314 -6.464 4.320 1.00 0.00 H new ATOM 0 HA LYS A 331 3.515 -6.357 7.231 1.00 0.00 H new ATOM 0 HB2 LYS A 331 5.594 -4.980 6.650 1.00 0.00 H new ATOM 0 HB3 LYS A 331 4.577 -4.040 5.576 1.00 0.00 H new ATOM 0 HG2 LYS A 331 4.535 -2.817 7.628 1.00 0.00 H new ATOM 0 HG3 LYS A 331 3.006 -3.674 7.615 1.00 0.00 H new ATOM 0 HD2 LYS A 331 3.760 -5.297 9.218 1.00 0.00 H new ATOM 0 HD3 LYS A 331 5.449 -4.916 8.948 1.00 0.00 H new ATOM 0 HE2 LYS A 331 5.247 -2.764 10.063 1.00 0.00 H new ATOM 0 HE3 LYS A 331 3.496 -2.837 10.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 331 4.376 -3.435 12.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 331 3.589 -4.769 11.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 331 5.285 -4.699 11.542 1.00 0.00 H new ATOM 718 N VAL A 332 1.400 -4.973 6.455 1.00 0.00 N ATOM 719 CA VAL A 332 0.076 -4.573 5.887 1.00 0.00 C ATOM 720 C VAL A 332 -0.421 -3.295 6.552 1.00 0.00 C ATOM 721 O VAL A 332 -0.021 -2.948 7.646 1.00 0.00 O ATOM 722 CB VAL A 332 -0.917 -5.708 6.118 1.00 0.00 C ATOM 723 CG1 VAL A 332 -2.116 -5.542 5.193 1.00 0.00 C ATOM 724 CG2 VAL A 332 -0.238 -7.038 5.805 1.00 0.00 C ATOM 0 H VAL A 332 1.500 -4.845 7.462 1.00 0.00 H new ATOM 0 HA VAL A 332 0.177 -4.382 4.819 1.00 0.00 H new ATOM 0 HB VAL A 332 -1.250 -5.688 7.156 1.00 0.00 H new ATOM 0 HG11 VAL A 332 -2.822 -6.355 5.362 1.00 0.00 H new ATOM 0 HG12 VAL A 332 -2.604 -4.589 5.398 1.00 0.00 H new ATOM 0 HG13 VAL A 332 -1.781 -5.562 4.156 1.00 0.00 H new ATOM 0 HG21 VAL A 332 -0.943 -7.854 5.968 1.00 0.00 H new ATOM 0 HG22 VAL A 332 0.089 -7.044 4.765 1.00 0.00 H new ATOM 0 HG23 VAL A 332 0.625 -7.168 6.458 1.00 0.00 H new ATOM 734 N PHE A 333 -1.288 -2.583 5.881 1.00 0.00 N ATOM 735 CA PHE A 333 -1.818 -1.307 6.438 1.00 0.00 C ATOM 736 C PHE A 333 -3.296 -1.170 6.076 1.00 0.00 C ATOM 737 O PHE A 333 -3.721 -1.565 5.008 1.00 0.00 O ATOM 738 CB PHE A 333 -1.021 -0.151 5.841 1.00 0.00 C ATOM 739 CG PHE A 333 0.443 -0.519 5.825 1.00 0.00 C ATOM 740 CD1 PHE A 333 1.231 -0.307 6.964 1.00 0.00 C ATOM 741 CD2 PHE A 333 1.016 -1.071 4.673 1.00 0.00 C ATOM 742 CE1 PHE A 333 2.589 -0.648 6.949 1.00 0.00 C ATOM 743 CE2 PHE A 333 2.374 -1.409 4.659 1.00 0.00 C ATOM 744 CZ PHE A 333 3.160 -1.197 5.796 1.00 0.00 C ATOM 0 H PHE A 333 -1.654 -2.835 4.963 1.00 0.00 H new ATOM 0 HA PHE A 333 -1.721 -1.297 7.524 1.00 0.00 H new ATOM 0 HB2 PHE A 333 -1.367 0.062 4.829 1.00 0.00 H new ATOM 0 HB3 PHE A 333 -1.175 0.755 6.427 1.00 0.00 H new ATOM 0 HD1 PHE A 333 0.791 0.119 7.853 1.00 0.00 H new ATOM 0 HD2 PHE A 333 0.410 -1.236 3.795 1.00 0.00 H new ATOM 0 HE1 PHE A 333 3.196 -0.487 7.828 1.00 0.00 H new ATOM 0 HE2 PHE A 333 2.815 -1.834 3.769 1.00 0.00 H new ATOM 0 HZ PHE A 333 4.208 -1.457 5.784 1.00 0.00 H new ATOM 754 N HIS A 334 -4.088 -0.622 6.964 1.00 0.00 N ATOM 755 CA HIS A 334 -5.552 -0.465 6.692 1.00 0.00 C ATOM 756 C HIS A 334 -5.879 0.999 6.348 1.00 0.00 C ATOM 757 O HIS A 334 -6.824 1.273 5.637 1.00 0.00 O ATOM 758 CB HIS A 334 -6.330 -0.894 7.951 1.00 0.00 C ATOM 759 CG HIS A 334 -7.705 -1.377 7.574 1.00 0.00 C ATOM 760 ND1 HIS A 334 -8.446 -0.785 6.562 1.00 0.00 N ATOM 761 CD2 HIS A 334 -8.484 -2.398 8.060 1.00 0.00 C ATOM 762 CE1 HIS A 334 -9.613 -1.446 6.474 1.00 0.00 C ATOM 763 NE2 HIS A 334 -9.687 -2.440 7.364 1.00 0.00 N ATOM 0 H HIS A 334 -3.782 -0.274 7.872 1.00 0.00 H new ATOM 0 HA HIS A 334 -5.837 -1.087 5.843 1.00 0.00 H new ATOM 0 HB2 HIS A 334 -5.789 -1.685 8.470 1.00 0.00 H new ATOM 0 HB3 HIS A 334 -6.408 -0.055 8.642 1.00 0.00 H new ATOM 0 HD1 HIS A 334 -8.158 0.008 5.989 1.00 0.00 H new ATOM 0 HD2 HIS A 334 -8.205 -3.067 8.861 1.00 0.00 H new ATOM 0 HE1 HIS A 334 -10.395 -1.203 5.770 1.00 0.00 H new ATOM 0 HE2 HIS A 334 -10.460 -3.090 7.503 1.00 0.00 H new ATOM 771 N ASP A 335 -5.119 1.940 6.864 1.00 0.00 N ATOM 772 CA ASP A 335 -5.403 3.390 6.587 1.00 0.00 C ATOM 773 C ASP A 335 -4.367 3.968 5.614 1.00 0.00 C ATOM 774 O ASP A 335 -3.200 3.630 5.654 1.00 0.00 O ATOM 775 CB ASP A 335 -5.342 4.170 7.902 1.00 0.00 C ATOM 776 CG ASP A 335 -5.727 5.629 7.651 1.00 0.00 C ATOM 777 OD1 ASP A 335 -4.872 6.380 7.211 1.00 0.00 O ATOM 778 OD2 ASP A 335 -6.871 5.973 7.905 1.00 0.00 O ATOM 0 H ASP A 335 -4.314 1.767 7.466 1.00 0.00 H new ATOM 0 HA ASP A 335 -6.393 3.475 6.139 1.00 0.00 H new ATOM 0 HB2 ASP A 335 -6.018 3.725 8.632 1.00 0.00 H new ATOM 0 HB3 ASP A 335 -4.338 4.115 8.323 1.00 0.00 H new ATOM 783 N LYS A 336 -4.794 4.849 4.745 1.00 0.00 N ATOM 784 CA LYS A 336 -3.856 5.471 3.762 1.00 0.00 C ATOM 785 C LYS A 336 -2.736 6.200 4.501 1.00 0.00 C ATOM 786 O LYS A 336 -1.620 6.284 4.031 1.00 0.00 O ATOM 787 CB LYS A 336 -4.624 6.472 2.896 1.00 0.00 C ATOM 788 CG LYS A 336 -5.143 7.613 3.776 1.00 0.00 C ATOM 789 CD LYS A 336 -6.169 8.441 2.996 1.00 0.00 C ATOM 790 CE LYS A 336 -6.830 9.455 3.934 1.00 0.00 C ATOM 791 NZ LYS A 336 -7.505 10.512 3.128 1.00 0.00 N ATOM 0 H LYS A 336 -5.761 5.166 4.674 1.00 0.00 H new ATOM 0 HA LYS A 336 -3.424 4.691 3.134 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -3.975 6.867 2.115 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -5.456 5.975 2.398 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -5.599 7.209 4.680 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -4.315 8.247 4.092 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -5.681 8.959 2.170 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -6.924 7.787 2.561 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -7.555 8.954 4.576 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -6.082 9.903 4.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -7.954 11.201 3.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -6.803 10.997 2.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -8.230 10.077 2.522 1.00 0.00 H new ATOM 805 N THR A 337 -3.022 6.734 5.655 1.00 0.00 N ATOM 806 CA THR A 337 -1.967 7.457 6.412 1.00 0.00 C ATOM 807 C THR A 337 -0.886 6.474 6.838 1.00 0.00 C ATOM 808 O THR A 337 0.273 6.627 6.511 1.00 0.00 O ATOM 809 CB THR A 337 -2.570 8.101 7.660 1.00 0.00 C ATOM 810 OG1 THR A 337 -3.582 9.021 7.277 1.00 0.00 O ATOM 811 CG2 THR A 337 -1.473 8.832 8.443 1.00 0.00 C ATOM 0 H THR A 337 -3.937 6.701 6.104 1.00 0.00 H new ATOM 0 HA THR A 337 -1.539 8.230 5.774 1.00 0.00 H new ATOM 0 HB THR A 337 -3.007 7.328 8.293 1.00 0.00 H new ATOM 0 HG1 THR A 337 -4.419 8.538 7.113 1.00 0.00 H new ATOM 0 HG21 THR A 337 -1.905 9.291 9.333 1.00 0.00 H new ATOM 0 HG22 THR A 337 -0.702 8.121 8.739 1.00 0.00 H new ATOM 0 HG23 THR A 337 -1.031 9.605 7.814 1.00 0.00 H new ATOM 819 N LYS A 338 -1.256 5.466 7.576 1.00 0.00 N ATOM 820 CA LYS A 338 -0.257 4.474 8.035 1.00 0.00 C ATOM 821 C LYS A 338 0.630 4.053 6.857 1.00 0.00 C ATOM 822 O LYS A 338 1.828 3.918 6.998 1.00 0.00 O ATOM 823 CB LYS A 338 -1.003 3.270 8.616 1.00 0.00 C ATOM 824 CG LYS A 338 -0.145 2.553 9.661 1.00 0.00 C ATOM 825 CD LYS A 338 -1.022 1.545 10.396 1.00 0.00 C ATOM 826 CE LYS A 338 -0.149 0.630 11.260 1.00 0.00 C ATOM 827 NZ LYS A 338 0.398 1.407 12.411 1.00 0.00 N ATOM 0 H LYS A 338 -2.213 5.289 7.880 1.00 0.00 H new ATOM 0 HA LYS A 338 0.385 4.904 8.804 1.00 0.00 H new ATOM 0 HB2 LYS A 338 -1.937 3.600 9.070 1.00 0.00 H new ATOM 0 HB3 LYS A 338 -1.264 2.577 7.816 1.00 0.00 H new ATOM 0 HG2 LYS A 338 0.693 2.047 9.181 1.00 0.00 H new ATOM 0 HG3 LYS A 338 0.276 3.272 10.363 1.00 0.00 H new ATOM 0 HD2 LYS A 338 -1.747 2.067 11.021 1.00 0.00 H new ATOM 0 HD3 LYS A 338 -1.589 0.951 9.679 1.00 0.00 H new ATOM 0 HE2 LYS A 338 -0.736 -0.214 11.623 1.00 0.00 H new ATOM 0 HE3 LYS A 338 0.666 0.219 10.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 338 0.935 0.772 13.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 338 1.026 2.157 12.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 338 -0.385 1.835 12.944 1.00 0.00 H new ATOM 841 N PHE A 339 0.067 3.869 5.690 1.00 0.00 N ATOM 842 CA PHE A 339 0.920 3.490 4.527 1.00 0.00 C ATOM 843 C PHE A 339 1.907 4.627 4.276 1.00 0.00 C ATOM 844 O PHE A 339 3.105 4.465 4.393 1.00 0.00 O ATOM 845 CB PHE A 339 0.070 3.275 3.269 1.00 0.00 C ATOM 846 CG PHE A 339 0.974 2.827 2.141 1.00 0.00 C ATOM 847 CD1 PHE A 339 1.344 1.482 2.038 1.00 0.00 C ATOM 848 CD2 PHE A 339 1.450 3.756 1.204 1.00 0.00 C ATOM 849 CE1 PHE A 339 2.193 1.062 1.004 1.00 0.00 C ATOM 850 CE2 PHE A 339 2.296 3.336 0.167 1.00 0.00 C ATOM 851 CZ PHE A 339 2.668 1.986 0.068 1.00 0.00 C ATOM 0 H PHE A 339 -0.930 3.963 5.495 1.00 0.00 H new ATOM 0 HA PHE A 339 1.440 2.558 4.749 1.00 0.00 H new ATOM 0 HB2 PHE A 339 -0.699 2.526 3.457 1.00 0.00 H new ATOM 0 HB3 PHE A 339 -0.443 4.198 2.998 1.00 0.00 H new ATOM 0 HD1 PHE A 339 0.975 0.765 2.757 1.00 0.00 H new ATOM 0 HD2 PHE A 339 1.165 4.795 1.281 1.00 0.00 H new ATOM 0 HE1 PHE A 339 2.480 0.024 0.930 1.00 0.00 H new ATOM 0 HE2 PHE A 339 2.661 4.051 -0.555 1.00 0.00 H new ATOM 0 HZ PHE A 339 3.320 1.662 -0.730 1.00 0.00 H new ATOM 861 N THR A 340 1.401 5.786 3.940 1.00 0.00 N ATOM 862 CA THR A 340 2.294 6.957 3.690 1.00 0.00 C ATOM 863 C THR A 340 3.344 7.039 4.800 1.00 0.00 C ATOM 864 O THR A 340 4.502 7.315 4.555 1.00 0.00 O ATOM 865 CB THR A 340 1.452 8.238 3.677 1.00 0.00 C ATOM 866 OG1 THR A 340 0.379 8.084 2.757 1.00 0.00 O ATOM 867 CG2 THR A 340 2.314 9.431 3.255 1.00 0.00 C ATOM 0 H THR A 340 0.404 5.972 3.828 1.00 0.00 H new ATOM 0 HA THR A 340 2.795 6.843 2.729 1.00 0.00 H new ATOM 0 HB THR A 340 1.060 8.418 4.678 1.00 0.00 H new ATOM 0 HG1 THR A 340 -0.368 7.629 3.199 1.00 0.00 H new ATOM 0 HG21 THR A 340 1.706 10.335 3.249 1.00 0.00 H new ATOM 0 HG22 THR A 340 3.137 9.552 3.959 1.00 0.00 H new ATOM 0 HG23 THR A 340 2.713 9.256 2.256 1.00 0.00 H new ATOM 875 N GLN A 341 2.949 6.791 6.016 1.00 0.00 N ATOM 876 CA GLN A 341 3.924 6.842 7.140 1.00 0.00 C ATOM 877 C GLN A 341 4.922 5.700 6.977 1.00 0.00 C ATOM 878 O GLN A 341 6.117 5.894 7.062 1.00 0.00 O ATOM 879 CB GLN A 341 3.182 6.690 8.469 1.00 0.00 C ATOM 880 CG GLN A 341 2.287 7.911 8.694 1.00 0.00 C ATOM 881 CD GLN A 341 1.473 7.715 9.975 1.00 0.00 C ATOM 882 OE1 GLN A 341 1.145 6.603 10.336 1.00 0.00 O ATOM 883 NE2 GLN A 341 1.126 8.758 10.679 1.00 0.00 N ATOM 0 H GLN A 341 1.993 6.555 6.281 1.00 0.00 H new ATOM 0 HA GLN A 341 4.450 7.797 7.132 1.00 0.00 H new ATOM 0 HB2 GLN A 341 2.580 5.781 8.460 1.00 0.00 H new ATOM 0 HB3 GLN A 341 3.895 6.592 9.287 1.00 0.00 H new ATOM 0 HG2 GLN A 341 2.895 8.812 8.771 1.00 0.00 H new ATOM 0 HG3 GLN A 341 1.620 8.048 7.843 1.00 0.00 H new ATOM 0 HE21 GLN A 341 1.401 9.692 10.376 1.00 0.00 H new ATOM 0 HE22 GLN A 341 0.580 8.639 11.532 1.00 0.00 H new ATOM 892 N TYR A 342 4.441 4.513 6.731 1.00 0.00 N ATOM 893 CA TYR A 342 5.364 3.357 6.552 1.00 0.00 C ATOM 894 C TYR A 342 6.453 3.741 5.550 1.00 0.00 C ATOM 895 O TYR A 342 7.580 3.295 5.640 1.00 0.00 O ATOM 896 CB TYR A 342 4.591 2.144 6.029 1.00 0.00 C ATOM 897 CG TYR A 342 5.559 1.024 5.730 1.00 0.00 C ATOM 898 CD1 TYR A 342 6.022 0.204 6.765 1.00 0.00 C ATOM 899 CD2 TYR A 342 5.997 0.812 4.418 1.00 0.00 C ATOM 900 CE1 TYR A 342 6.921 -0.832 6.488 1.00 0.00 C ATOM 901 CE2 TYR A 342 6.897 -0.225 4.141 1.00 0.00 C ATOM 902 CZ TYR A 342 7.360 -1.047 5.177 1.00 0.00 C ATOM 903 OH TYR A 342 8.251 -2.066 4.906 1.00 0.00 O ATOM 0 H TYR A 342 3.449 4.293 6.646 1.00 0.00 H new ATOM 0 HA TYR A 342 5.815 3.101 7.511 1.00 0.00 H new ATOM 0 HB2 TYR A 342 3.859 1.819 6.768 1.00 0.00 H new ATOM 0 HB3 TYR A 342 4.038 2.412 5.129 1.00 0.00 H new ATOM 0 HD1 TYR A 342 5.686 0.371 7.778 1.00 0.00 H new ATOM 0 HD2 TYR A 342 5.642 1.447 3.620 1.00 0.00 H new ATOM 0 HE1 TYR A 342 7.276 -1.466 7.287 1.00 0.00 H new ATOM 0 HE2 TYR A 342 7.234 -0.391 3.129 1.00 0.00 H new ATOM 0 HH TYR A 342 8.118 -2.796 5.547 1.00 0.00 H new ATOM 913 N LEU A 343 6.132 4.567 4.595 1.00 0.00 N ATOM 914 CA LEU A 343 7.162 4.981 3.601 1.00 0.00 C ATOM 915 C LEU A 343 7.971 6.145 4.156 1.00 0.00 C ATOM 916 O LEU A 343 9.188 6.161 4.078 1.00 0.00 O ATOM 917 CB LEU A 343 6.486 5.407 2.295 1.00 0.00 C ATOM 918 CG LEU A 343 5.920 4.189 1.543 1.00 0.00 C ATOM 919 CD1 LEU A 343 5.349 4.668 0.213 1.00 0.00 C ATOM 920 CD2 LEU A 343 7.026 3.154 1.268 1.00 0.00 C ATOM 0 H LEU A 343 5.206 4.972 4.459 1.00 0.00 H new ATOM 0 HA LEU A 343 7.825 4.138 3.404 1.00 0.00 H new ATOM 0 HB2 LEU A 343 5.682 6.111 2.510 1.00 0.00 H new ATOM 0 HB3 LEU A 343 7.205 5.927 1.662 1.00 0.00 H new ATOM 0 HG LEU A 343 5.148 3.719 2.153 1.00 0.00 H new ATOM 0 HD11 LEU A 343 4.942 3.818 -0.336 1.00 0.00 H new ATOM 0 HD12 LEU A 343 4.557 5.394 0.397 1.00 0.00 H new ATOM 0 HD13 LEU A 343 6.139 5.135 -0.375 1.00 0.00 H new ATOM 0 HD21 LEU A 343 6.603 2.302 0.736 1.00 0.00 H new ATOM 0 HD22 LEU A 343 7.808 3.610 0.660 1.00 0.00 H new ATOM 0 HD23 LEU A 343 7.452 2.816 2.213 1.00 0.00 H new ATOM 932 N SER A 344 7.318 7.119 4.722 1.00 0.00 N ATOM 933 CA SER A 344 8.069 8.270 5.288 1.00 0.00 C ATOM 934 C SER A 344 9.181 7.725 6.180 1.00 0.00 C ATOM 935 O SER A 344 10.210 8.345 6.366 1.00 0.00 O ATOM 936 CB SER A 344 7.122 9.138 6.112 1.00 0.00 C ATOM 937 OG SER A 344 6.724 8.428 7.276 1.00 0.00 O ATOM 0 H SER A 344 6.304 7.168 4.817 1.00 0.00 H new ATOM 0 HA SER A 344 8.496 8.875 4.488 1.00 0.00 H new ATOM 0 HB2 SER A 344 7.615 10.069 6.391 1.00 0.00 H new ATOM 0 HB3 SER A 344 6.247 9.406 5.519 1.00 0.00 H new ATOM 0 HG SER A 344 6.606 7.480 7.057 1.00 0.00 H new ATOM 943 N THR A 345 8.977 6.547 6.721 1.00 0.00 N ATOM 944 CA THR A 345 10.012 5.917 7.595 1.00 0.00 C ATOM 945 C THR A 345 10.786 4.862 6.796 1.00 0.00 C ATOM 946 O THR A 345 11.652 4.192 7.323 1.00 0.00 O ATOM 947 CB THR A 345 9.344 5.281 8.825 1.00 0.00 C ATOM 948 OG1 THR A 345 10.344 4.865 9.745 1.00 0.00 O ATOM 949 CG2 THR A 345 8.498 4.076 8.414 1.00 0.00 C ATOM 0 H THR A 345 8.131 5.993 6.592 1.00 0.00 H new ATOM 0 HA THR A 345 10.710 6.680 7.938 1.00 0.00 H new ATOM 0 HB THR A 345 8.695 6.021 9.293 1.00 0.00 H new ATOM 0 HG1 THR A 345 11.158 4.622 9.256 1.00 0.00 H new ATOM 0 HG21 THR A 345 8.033 3.639 9.298 1.00 0.00 H new ATOM 0 HG22 THR A 345 7.723 4.396 7.717 1.00 0.00 H new ATOM 0 HG23 THR A 345 9.133 3.332 7.933 1.00 0.00 H new ATOM 957 N ASN A 346 10.491 4.717 5.519 1.00 0.00 N ATOM 958 CA ASN A 346 11.224 3.714 4.676 1.00 0.00 C ATOM 959 C ASN A 346 11.615 4.381 3.350 1.00 0.00 C ATOM 960 O ASN A 346 11.002 4.155 2.326 1.00 0.00 O ATOM 961 CB ASN A 346 10.319 2.502 4.394 1.00 0.00 C ATOM 962 CG ASN A 346 11.175 1.304 3.973 1.00 0.00 C ATOM 963 OD1 ASN A 346 12.148 0.977 4.623 1.00 0.00 O ATOM 964 ND2 ASN A 346 10.850 0.633 2.901 1.00 0.00 N ATOM 0 H ASN A 346 9.774 5.251 5.027 1.00 0.00 H new ATOM 0 HA ASN A 346 12.115 3.372 5.203 1.00 0.00 H new ATOM 0 HB2 ASN A 346 9.741 2.253 5.284 1.00 0.00 H new ATOM 0 HB3 ASN A 346 9.605 2.745 3.607 1.00 0.00 H new ATOM 0 HD21 ASN A 346 11.413 -0.166 2.609 1.00 0.00 H new ATOM 0 HD22 ASN A 346 10.033 0.908 2.356 1.00 0.00 H new ATOM 971 N PRO A 347 12.632 5.205 3.378 1.00 0.00 N ATOM 972 CA PRO A 347 13.122 5.928 2.166 1.00 0.00 C ATOM 973 C PRO A 347 13.460 4.968 1.020 1.00 0.00 C ATOM 974 O PRO A 347 13.572 5.365 -0.123 1.00 0.00 O ATOM 975 CB PRO A 347 14.384 6.664 2.659 1.00 0.00 C ATOM 976 CG PRO A 347 14.215 6.775 4.140 1.00 0.00 C ATOM 977 CD PRO A 347 13.430 5.534 4.565 1.00 0.00 C ATOM 0 HA PRO A 347 12.367 6.600 1.759 1.00 0.00 H new ATOM 0 HB2 PRO A 347 15.288 6.110 2.406 1.00 0.00 H new ATOM 0 HB3 PRO A 347 14.473 7.647 2.197 1.00 0.00 H new ATOM 0 HG2 PRO A 347 15.182 6.817 4.642 1.00 0.00 H new ATOM 0 HG3 PRO A 347 13.679 7.686 4.405 1.00 0.00 H new ATOM 0 HD2 PRO A 347 14.094 4.715 4.841 1.00 0.00 H new ATOM 0 HD3 PRO A 347 12.798 5.737 5.429 1.00 0.00 H new ATOM 985 N ALA A 348 13.626 3.709 1.322 1.00 0.00 N ATOM 986 CA ALA A 348 13.958 2.724 0.257 1.00 0.00 C ATOM 987 C ALA A 348 12.854 2.732 -0.801 1.00 0.00 C ATOM 988 O ALA A 348 13.097 2.976 -1.969 1.00 0.00 O ATOM 989 CB ALA A 348 14.069 1.327 0.873 1.00 0.00 C ATOM 0 H ALA A 348 13.546 3.321 2.262 1.00 0.00 H new ATOM 0 HA ALA A 348 14.908 2.991 -0.207 1.00 0.00 H new ATOM 0 HB1 ALA A 348 14.312 0.604 0.094 1.00 0.00 H new ATOM 0 HB2 ALA A 348 14.854 1.324 1.629 1.00 0.00 H new ATOM 0 HB3 ALA A 348 13.120 1.057 1.335 1.00 0.00 H new ATOM 995 N LEU A 349 11.638 2.478 -0.406 1.00 0.00 N ATOM 996 CA LEU A 349 10.530 2.483 -1.400 1.00 0.00 C ATOM 997 C LEU A 349 10.216 3.933 -1.779 1.00 0.00 C ATOM 998 O LEU A 349 10.069 4.260 -2.939 1.00 0.00 O ATOM 999 CB LEU A 349 9.277 1.827 -0.798 1.00 0.00 C ATOM 1000 CG LEU A 349 9.312 0.301 -0.953 1.00 0.00 C ATOM 1001 CD1 LEU A 349 8.062 -0.286 -0.287 1.00 0.00 C ATOM 1002 CD2 LEU A 349 9.341 -0.108 -2.443 1.00 0.00 C ATOM 0 H LEU A 349 11.365 2.269 0.554 1.00 0.00 H new ATOM 0 HA LEU A 349 10.830 1.920 -2.284 1.00 0.00 H new ATOM 0 HB2 LEU A 349 9.202 2.085 0.258 1.00 0.00 H new ATOM 0 HB3 LEU A 349 8.387 2.223 -1.287 1.00 0.00 H new ATOM 0 HG LEU A 349 10.216 -0.082 -0.480 1.00 0.00 H new ATOM 0 HD11 LEU A 349 8.071 -1.371 -0.388 1.00 0.00 H new ATOM 0 HD12 LEU A 349 8.054 -0.020 0.770 1.00 0.00 H new ATOM 0 HD13 LEU A 349 7.170 0.116 -0.769 1.00 0.00 H new ATOM 0 HD21 LEU A 349 9.366 -1.195 -2.522 1.00 0.00 H new ATOM 0 HD22 LEU A 349 8.449 0.272 -2.942 1.00 0.00 H new ATOM 0 HD23 LEU A 349 10.229 0.310 -2.918 1.00 0.00 H new ATOM 1014 N GLN A 350 10.104 4.796 -0.801 1.00 0.00 N ATOM 1015 CA GLN A 350 9.790 6.229 -1.075 1.00 0.00 C ATOM 1016 C GLN A 350 10.585 6.720 -2.291 1.00 0.00 C ATOM 1017 O GLN A 350 10.148 7.581 -3.027 1.00 0.00 O ATOM 1018 CB GLN A 350 10.167 7.062 0.171 1.00 0.00 C ATOM 1019 CG GLN A 350 9.165 8.206 0.374 1.00 0.00 C ATOM 1020 CD GLN A 350 9.787 9.286 1.263 1.00 0.00 C ATOM 1021 OE1 GLN A 350 10.906 9.703 1.038 1.00 0.00 O ATOM 1022 NE2 GLN A 350 9.106 9.760 2.271 1.00 0.00 N ATOM 0 H GLN A 350 10.218 4.565 0.186 1.00 0.00 H new ATOM 0 HA GLN A 350 8.727 6.339 -1.290 1.00 0.00 H new ATOM 0 HB2 GLN A 350 10.181 6.422 1.053 1.00 0.00 H new ATOM 0 HB3 GLN A 350 11.172 7.467 0.055 1.00 0.00 H new ATOM 0 HG2 GLN A 350 8.885 8.632 -0.589 1.00 0.00 H new ATOM 0 HG3 GLN A 350 8.252 7.826 0.832 1.00 0.00 H new ATOM 0 HE21 GLN A 350 8.167 9.411 2.461 1.00 0.00 H new ATOM 0 HE22 GLN A 350 9.513 10.479 2.868 1.00 0.00 H new ATOM 1031 N ARG A 351 11.751 6.177 -2.504 1.00 0.00 N ATOM 1032 CA ARG A 351 12.573 6.606 -3.659 1.00 0.00 C ATOM 1033 C ARG A 351 12.095 5.871 -4.919 1.00 0.00 C ATOM 1034 O ARG A 351 11.987 6.452 -5.980 1.00 0.00 O ATOM 1035 CB ARG A 351 14.040 6.272 -3.352 1.00 0.00 C ATOM 1036 CG ARG A 351 14.850 6.192 -4.649 1.00 0.00 C ATOM 1037 CD ARG A 351 16.342 6.332 -4.340 1.00 0.00 C ATOM 1038 NE ARG A 351 16.648 7.752 -4.000 1.00 0.00 N ATOM 1039 CZ ARG A 351 17.779 8.054 -3.423 1.00 0.00 C ATOM 1040 NH1 ARG A 351 18.644 7.114 -3.152 1.00 0.00 N ATOM 1041 NH2 ARG A 351 18.047 9.294 -3.118 1.00 0.00 N ATOM 0 H ARG A 351 12.168 5.451 -1.922 1.00 0.00 H new ATOM 0 HA ARG A 351 12.476 7.678 -3.832 1.00 0.00 H new ATOM 0 HB2 ARG A 351 14.464 7.033 -2.697 1.00 0.00 H new ATOM 0 HB3 ARG A 351 14.100 5.323 -2.819 1.00 0.00 H new ATOM 0 HG2 ARG A 351 14.661 5.242 -5.148 1.00 0.00 H new ATOM 0 HG3 ARG A 351 14.536 6.980 -5.334 1.00 0.00 H new ATOM 0 HD2 ARG A 351 16.615 5.681 -3.509 1.00 0.00 H new ATOM 0 HD3 ARG A 351 16.934 6.017 -5.200 1.00 0.00 H new ATOM 0 HE ARG A 351 15.974 8.486 -4.218 1.00 0.00 H new ATOM 0 HH11 ARG A 351 18.435 6.145 -3.391 1.00 0.00 H new ATOM 0 HH12 ARG A 351 19.528 7.349 -2.701 1.00 0.00 H new ATOM 0 HH21 ARG A 351 17.372 10.029 -3.330 1.00 0.00 H new ATOM 0 HH22 ARG A 351 18.931 9.529 -2.667 1.00 0.00 H new ATOM 1055 N ILE A 352 11.814 4.601 -4.814 1.00 0.00 N ATOM 1056 CA ILE A 352 11.351 3.847 -6.014 1.00 0.00 C ATOM 1057 C ILE A 352 9.910 4.245 -6.351 1.00 0.00 C ATOM 1058 O ILE A 352 9.618 4.665 -7.453 1.00 0.00 O ATOM 1059 CB ILE A 352 11.433 2.339 -5.739 1.00 0.00 C ATOM 1060 CG1 ILE A 352 12.909 1.927 -5.670 1.00 0.00 C ATOM 1061 CG2 ILE A 352 10.732 1.560 -6.864 1.00 0.00 C ATOM 1062 CD1 ILE A 352 13.028 0.545 -5.026 1.00 0.00 C ATOM 0 H ILE A 352 11.884 4.055 -3.955 1.00 0.00 H new ATOM 0 HA ILE A 352 11.991 4.088 -6.863 1.00 0.00 H new ATOM 0 HB ILE A 352 10.939 2.113 -4.794 1.00 0.00 H new ATOM 0 HG12 ILE A 352 13.339 1.911 -6.671 1.00 0.00 H new ATOM 0 HG13 ILE A 352 13.474 2.658 -5.092 1.00 0.00 H new ATOM 0 HG21 ILE A 352 10.795 0.491 -6.660 1.00 0.00 H new ATOM 0 HG22 ILE A 352 9.685 1.858 -6.915 1.00 0.00 H new ATOM 0 HG23 ILE A 352 11.218 1.778 -7.815 1.00 0.00 H new ATOM 0 HD11 ILE A 352 14.078 0.255 -4.978 1.00 0.00 H new ATOM 0 HD12 ILE A 352 12.614 0.576 -4.018 1.00 0.00 H new ATOM 0 HD13 ILE A 352 12.477 -0.183 -5.622 1.00 0.00 H new ATOM 1074 N ILE A 353 9.006 4.116 -5.420 1.00 0.00 N ATOM 1075 CA ILE A 353 7.591 4.489 -5.699 1.00 0.00 C ATOM 1076 C ILE A 353 7.522 5.954 -6.127 1.00 0.00 C ATOM 1077 O ILE A 353 8.505 6.543 -6.532 1.00 0.00 O ATOM 1078 CB ILE A 353 6.753 4.273 -4.433 1.00 0.00 C ATOM 1079 CG1 ILE A 353 7.205 5.254 -3.312 1.00 0.00 C ATOM 1080 CG2 ILE A 353 6.936 2.824 -3.965 1.00 0.00 C ATOM 1081 CD1 ILE A 353 6.285 6.484 -3.259 1.00 0.00 C ATOM 0 H ILE A 353 9.186 3.768 -4.478 1.00 0.00 H new ATOM 0 HA ILE A 353 7.198 3.866 -6.503 1.00 0.00 H new ATOM 0 HB ILE A 353 5.703 4.464 -4.652 1.00 0.00 H new ATOM 0 HG12 ILE A 353 7.193 4.743 -2.349 1.00 0.00 H new ATOM 0 HG13 ILE A 353 8.232 5.570 -3.492 1.00 0.00 H new ATOM 0 HG21 ILE A 353 6.345 2.655 -3.065 1.00 0.00 H new ATOM 0 HG22 ILE A 353 6.604 2.144 -4.749 1.00 0.00 H new ATOM 0 HG23 ILE A 353 7.989 2.642 -3.748 1.00 0.00 H new ATOM 0 HD11 ILE A 353 6.620 7.155 -2.468 1.00 0.00 H new ATOM 0 HD12 ILE A 353 6.319 7.005 -4.216 1.00 0.00 H new ATOM 0 HD13 ILE A 353 5.263 6.165 -3.055 1.00 0.00 H new