USER MOD reduce.3.24.130724 H: found=0, std=0, add=591, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 593 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 175 TYR OH : rot 141:sc= 0.264 USER MOD Single : A 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 191 GLN : amide:sc= 0 X(o=0,f=0) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 213 MET CE :methyl 145:sc= -0.293 (180deg=-2.08!) USER MOD Single : A 214 THR OG1 : rot -5:sc= -0.779 USER MOD Single : A 227 THR OG1 : rot 100:sc= -0.126 USER MOD Single : A 228 GLN : amide:sc= -0.116 K(o=-0.12,f=-5.3!) USER MOD Single : A 232 LYS NZ :NH3+ -168:sc= -0.02 (180deg=-0.195) USER MOD Single : A 236 LYS NZ :NH3+ -162:sc= 0.152 (180deg=-0.55) USER MOD Single : A 238 LYS NZ :NH3+ 179:sc= 1.25 (180deg=1.24) USER MOD Single : A 250 TYR OH : rot 180:sc= -0.263 USER MOD Single : A 256 THR OG1 : rot 180:sc= -0.0568 USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 169 -7.659 12.396 0.632 1.00 1.52 N ATOM 33 CA ASP A 169 -6.206 12.624 0.677 1.00 65.43 C ATOM 34 C ASP A 169 -5.525 11.867 -0.477 1.00 2.43 C ATOM 35 O ASP A 169 -4.990 12.475 -1.411 1.00 31.23 O ATOM 36 CB ASP A 169 -5.634 12.192 2.055 1.00 73.33 C ATOM 37 CG ASP A 169 -4.120 12.428 2.203 1.00 24.41 C ATOM 38 OD1 ASP A 169 -3.681 13.589 2.066 1.00 61.23 O ATOM 39 OD2 ASP A 169 -3.375 11.465 2.485 1.00 54.20 O ATOM 0 HA ASP A 169 -6.003 13.688 0.554 1.00 65.43 H new ATOM 0 HB2 ASP A 169 -6.156 12.738 2.841 1.00 73.33 H new ATOM 0 HB3 ASP A 169 -5.844 11.133 2.209 1.00 73.33 H new ATOM 44 N VAL A 170 -5.594 10.537 -0.401 1.00 51.31 N ATOM 45 CA VAL A 170 -5.033 9.612 -1.401 1.00 71.31 C ATOM 46 C VAL A 170 -6.165 8.916 -2.188 1.00 4.42 C ATOM 47 O VAL A 170 -7.351 9.221 -1.987 1.00 31.22 O ATOM 48 CB VAL A 170 -4.154 8.527 -0.678 1.00 52.20 C ATOM 49 CG1 VAL A 170 -2.986 9.163 0.096 1.00 60.34 C ATOM 50 CG2 VAL A 170 -5.005 7.640 0.256 1.00 41.51 C ATOM 0 H VAL A 170 -6.051 10.057 0.374 1.00 51.31 H new ATOM 0 HA VAL A 170 -4.418 10.181 -2.098 1.00 71.31 H new ATOM 0 HB VAL A 170 -3.732 7.892 -1.457 1.00 52.20 H new ATOM 0 HG11 VAL A 170 -2.402 8.381 0.582 1.00 60.34 H new ATOM 0 HG12 VAL A 170 -2.349 9.715 -0.595 1.00 60.34 H new ATOM 0 HG13 VAL A 170 -3.378 9.845 0.851 1.00 60.34 H new ATOM 0 HG21 VAL A 170 -4.365 6.901 0.739 1.00 41.51 H new ATOM 0 HG22 VAL A 170 -5.479 8.262 1.016 1.00 41.51 H new ATOM 0 HG23 VAL A 170 -5.772 7.130 -0.326 1.00 41.51 H new ATOM 60 N ILE A 171 -5.792 7.973 -3.079 1.00 31.12 N ATOM 61 CA ILE A 171 -6.747 7.009 -3.664 1.00 30.10 C ATOM 62 C ILE A 171 -6.748 5.744 -2.776 1.00 11.33 C ATOM 63 O ILE A 171 -5.702 5.381 -2.212 1.00 54.44 O ATOM 64 CB ILE A 171 -6.427 6.657 -5.176 1.00 40.21 C ATOM 65 CG1 ILE A 171 -7.505 5.674 -5.755 1.00 5.32 C ATOM 66 CG2 ILE A 171 -4.998 6.090 -5.347 1.00 32.51 C ATOM 67 CD1 ILE A 171 -7.363 5.351 -7.230 1.00 44.41 C ATOM 0 H ILE A 171 -4.834 7.859 -3.409 1.00 31.12 H new ATOM 0 HA ILE A 171 -7.738 7.463 -3.683 1.00 30.10 H new ATOM 0 HB ILE A 171 -6.469 7.585 -5.747 1.00 40.21 H new ATOM 0 HG12 ILE A 171 -7.464 4.742 -5.190 1.00 5.32 H new ATOM 0 HG13 ILE A 171 -8.492 6.105 -5.588 1.00 5.32 H new ATOM 0 HG21 ILE A 171 -4.820 5.862 -6.398 1.00 32.51 H new ATOM 0 HG22 ILE A 171 -4.271 6.828 -5.008 1.00 32.51 H new ATOM 0 HG23 ILE A 171 -4.895 5.180 -4.756 1.00 32.51 H new ATOM 0 HD11 ILE A 171 -8.155 4.665 -7.530 1.00 44.41 H new ATOM 0 HD12 ILE A 171 -7.438 6.269 -7.812 1.00 44.41 H new ATOM 0 HD13 ILE A 171 -6.394 4.886 -7.409 1.00 44.41 H new ATOM 79 N ASP A 172 -7.930 5.108 -2.635 1.00 21.43 N ATOM 80 CA ASP A 172 -8.146 3.991 -1.695 1.00 4.32 C ATOM 81 C ASP A 172 -7.285 2.749 -2.033 1.00 21.42 C ATOM 82 O ASP A 172 -7.115 2.391 -3.206 1.00 32.41 O ATOM 83 CB ASP A 172 -9.644 3.590 -1.663 1.00 52.43 C ATOM 84 CG ASP A 172 -9.950 2.522 -0.584 1.00 44.55 C ATOM 85 OD1 ASP A 172 -10.099 2.891 0.603 1.00 2.13 O ATOM 86 OD2 ASP A 172 -10.023 1.315 -0.913 1.00 60.12 O ATOM 0 H ASP A 172 -8.762 5.356 -3.171 1.00 21.43 H new ATOM 0 HA ASP A 172 -7.836 4.348 -0.713 1.00 4.32 H new ATOM 0 HB2 ASP A 172 -10.250 4.476 -1.474 1.00 52.43 H new ATOM 0 HB3 ASP A 172 -9.935 3.207 -2.641 1.00 52.43 H new ATOM 91 N ALA A 173 -6.768 2.115 -0.970 1.00 1.13 N ATOM 92 CA ALA A 173 -6.069 0.822 -1.020 1.00 11.10 C ATOM 93 C ALA A 173 -6.226 0.130 0.343 1.00 74.22 C ATOM 94 O ALA A 173 -6.399 0.804 1.365 1.00 44.33 O ATOM 95 CB ALA A 173 -4.578 1.015 -1.362 1.00 53.24 C ATOM 0 H ALA A 173 -6.826 2.498 -0.026 1.00 1.13 H new ATOM 0 HA ALA A 173 -6.505 0.202 -1.803 1.00 11.10 H new ATOM 0 HB1 ALA A 173 -4.083 0.044 -1.393 1.00 53.24 H new ATOM 0 HB2 ALA A 173 -4.487 1.500 -2.334 1.00 53.24 H new ATOM 0 HB3 ALA A 173 -4.108 1.638 -0.601 1.00 53.24 H new ATOM 101 N ASP A 174 -6.162 -1.206 0.358 1.00 51.24 N ATOM 102 CA ASP A 174 -6.144 -2.018 1.602 1.00 43.13 C ATOM 103 C ASP A 174 -5.292 -3.272 1.346 1.00 41.31 C ATOM 104 O ASP A 174 -5.139 -3.682 0.192 1.00 62.23 O ATOM 105 CB ASP A 174 -7.580 -2.421 2.038 1.00 34.20 C ATOM 106 CG ASP A 174 -7.620 -3.091 3.432 1.00 41.15 C ATOM 107 OD1 ASP A 174 -7.606 -2.371 4.447 1.00 14.15 O ATOM 108 OD2 ASP A 174 -7.646 -4.339 3.521 1.00 4.12 O ATOM 0 H ASP A 174 -6.121 -1.767 -0.493 1.00 51.24 H new ATOM 0 HA ASP A 174 -5.716 -1.427 2.412 1.00 43.13 H new ATOM 0 HB2 ASP A 174 -8.213 -1.534 2.048 1.00 34.20 H new ATOM 0 HB3 ASP A 174 -8.000 -3.104 1.300 1.00 34.20 H new ATOM 113 N TYR A 175 -4.740 -3.890 2.409 1.00 74.03 N ATOM 114 CA TYR A 175 -3.926 -5.108 2.261 1.00 10.30 C ATOM 115 C TYR A 175 -4.253 -6.163 3.314 1.00 34.32 C ATOM 116 O TYR A 175 -4.948 -5.898 4.284 1.00 23.35 O ATOM 117 CB TYR A 175 -2.409 -4.770 2.234 1.00 3.21 C ATOM 118 CG TYR A 175 -1.777 -4.174 3.495 1.00 44.14 C ATOM 119 CD1 TYR A 175 -1.415 -2.834 3.557 1.00 51.24 C ATOM 120 CD2 TYR A 175 -1.475 -4.971 4.601 1.00 43.42 C ATOM 121 CE1 TYR A 175 -0.777 -2.320 4.665 1.00 34.33 C ATOM 122 CE2 TYR A 175 -0.848 -4.446 5.708 1.00 13.44 C ATOM 123 CZ TYR A 175 -0.500 -3.123 5.731 1.00 24.11 C ATOM 124 OH TYR A 175 0.133 -2.596 6.832 1.00 43.04 O ATOM 0 H TYR A 175 -4.843 -3.567 3.371 1.00 74.03 H new ATOM 0 HA TYR A 175 -4.186 -5.548 1.298 1.00 10.30 H new ATOM 0 HB2 TYR A 175 -1.868 -5.685 1.991 1.00 3.21 H new ATOM 0 HB3 TYR A 175 -2.238 -4.072 1.414 1.00 3.21 H new ATOM 0 HD1 TYR A 175 -1.637 -2.185 2.723 1.00 51.24 H new ATOM 0 HD2 TYR A 175 -1.738 -6.018 4.588 1.00 43.42 H new ATOM 0 HE1 TYR A 175 -0.496 -1.278 4.689 1.00 34.33 H new ATOM 0 HE2 TYR A 175 -0.631 -5.077 6.557 1.00 13.44 H new ATOM 0 HH TYR A 175 -0.253 -2.981 7.647 1.00 43.04 H new ATOM 134 N LYS A 176 -3.724 -7.368 3.076 1.00 41.20 N ATOM 135 CA LYS A 176 -3.837 -8.536 3.973 1.00 4.44 C ATOM 136 C LYS A 176 -2.485 -9.270 3.977 1.00 15.04 C ATOM 137 O LYS A 176 -1.780 -9.226 2.967 1.00 65.11 O ATOM 138 CB LYS A 176 -4.982 -9.502 3.508 1.00 14.41 C ATOM 139 CG LYS A 176 -6.419 -8.970 3.726 1.00 14.41 C ATOM 140 CD LYS A 176 -6.763 -8.748 5.217 1.00 42.55 C ATOM 141 CE LYS A 176 -6.767 -10.053 6.034 1.00 4.43 C ATOM 142 NZ LYS A 176 -7.058 -9.806 7.476 1.00 73.41 N ATOM 0 H LYS A 176 -3.189 -7.569 2.231 1.00 41.20 H new ATOM 0 HA LYS A 176 -4.088 -8.199 4.979 1.00 4.44 H new ATOM 0 HB2 LYS A 176 -4.847 -9.716 2.448 1.00 14.41 H new ATOM 0 HB3 LYS A 176 -4.877 -10.448 4.040 1.00 14.41 H new ATOM 0 HG2 LYS A 176 -6.538 -8.030 3.188 1.00 14.41 H new ATOM 0 HG3 LYS A 176 -7.130 -9.675 3.296 1.00 14.41 H new ATOM 0 HD2 LYS A 176 -6.042 -8.056 5.652 1.00 42.55 H new ATOM 0 HD3 LYS A 176 -7.743 -8.276 5.292 1.00 42.55 H new ATOM 0 HE2 LYS A 176 -7.512 -10.735 5.625 1.00 4.43 H new ATOM 0 HE3 LYS A 176 -5.799 -10.544 5.938 1.00 4.43 H new ATOM 0 HZ1 LYS A 176 -7.052 -10.709 7.991 1.00 73.41 H new ATOM 0 HZ2 LYS A 176 -6.333 -9.176 7.874 1.00 73.41 H new ATOM 0 HZ3 LYS A 176 -7.993 -9.361 7.570 1.00 73.41 H new ATOM 156 N PRO A 177 -2.094 -9.958 5.100 1.00 41.34 N ATOM 157 CA PRO A 177 -0.811 -10.697 5.166 1.00 12.32 C ATOM 158 C PRO A 177 -0.804 -11.879 4.172 1.00 4.43 C ATOM 159 O PRO A 177 -1.546 -12.857 4.342 1.00 15.13 O ATOM 160 CB PRO A 177 -0.723 -11.158 6.645 1.00 33.14 C ATOM 161 CG PRO A 177 -2.140 -11.179 7.128 1.00 4.25 C ATOM 162 CD PRO A 177 -2.858 -10.081 6.373 1.00 72.44 C ATOM 0 HA PRO A 177 0.051 -10.093 4.882 1.00 12.32 H new ATOM 0 HB2 PRO A 177 -0.264 -12.143 6.725 1.00 33.14 H new ATOM 0 HB3 PRO A 177 -0.114 -10.474 7.236 1.00 33.14 H new ATOM 0 HG2 PRO A 177 -2.602 -12.148 6.939 1.00 4.25 H new ATOM 0 HG3 PRO A 177 -2.188 -11.008 8.203 1.00 4.25 H new ATOM 0 HD2 PRO A 177 -3.901 -10.340 6.189 1.00 72.44 H new ATOM 0 HD3 PRO A 177 -2.855 -9.145 6.932 1.00 72.44 H new ATOM 170 N ALA A 178 0.007 -11.729 3.112 1.00 0.44 N ATOM 171 CA ALA A 178 0.093 -12.685 1.986 1.00 52.31 C ATOM 172 C ALA A 178 0.497 -14.088 2.471 1.00 42.21 C ATOM 173 O ALA A 178 -0.090 -15.099 2.070 1.00 13.24 O ATOM 174 CB ALA A 178 1.093 -12.162 0.937 1.00 3.23 C ATOM 0 H ALA A 178 0.632 -10.930 3.008 1.00 0.44 H new ATOM 0 HA ALA A 178 -0.893 -12.770 1.529 1.00 52.31 H new ATOM 0 HB1 ALA A 178 1.154 -12.868 0.109 1.00 3.23 H new ATOM 0 HB2 ALA A 178 0.757 -11.194 0.565 1.00 3.23 H new ATOM 0 HB3 ALA A 178 2.076 -12.053 1.394 1.00 3.23 H new ATOM 285 N GLN A 191 3.286 4.346 15.436 1.00 21.21 N ATOM 286 CA GLN A 191 2.262 3.491 14.804 1.00 22.13 C ATOM 287 C GLN A 191 2.243 3.690 13.272 1.00 72.32 C ATOM 288 O GLN A 191 1.759 2.825 12.532 1.00 22.01 O ATOM 289 CB GLN A 191 0.853 3.751 15.412 1.00 33.12 C ATOM 290 CG GLN A 191 0.704 3.314 16.883 1.00 10.32 C ATOM 291 CD GLN A 191 -0.757 3.264 17.348 1.00 3.23 C ATOM 292 OE1 GLN A 191 -1.420 2.231 17.238 1.00 63.33 O ATOM 293 NE2 GLN A 191 -1.267 4.369 17.870 1.00 10.43 N ATOM 0 HA GLN A 191 2.527 2.454 15.009 1.00 22.13 H new ATOM 0 HB2 GLN A 191 0.629 4.815 15.337 1.00 33.12 H new ATOM 0 HB3 GLN A 191 0.109 3.226 14.812 1.00 33.12 H new ATOM 0 HG2 GLN A 191 1.154 2.330 17.011 1.00 10.32 H new ATOM 0 HG3 GLN A 191 1.259 4.004 17.519 1.00 10.32 H new ATOM 0 HE21 GLN A 191 -0.693 5.208 17.948 1.00 10.43 H new ATOM 0 HE22 GLN A 191 -2.234 4.381 18.194 1.00 10.43 H new ATOM 302 N ASP A 192 2.762 4.832 12.812 1.00 12.44 N ATOM 303 CA ASP A 192 2.879 5.154 11.374 1.00 63.23 C ATOM 304 C ASP A 192 4.113 4.474 10.752 1.00 32.20 C ATOM 305 O ASP A 192 5.120 4.224 11.432 1.00 34.24 O ATOM 306 CB ASP A 192 2.962 6.695 11.181 1.00 3.44 C ATOM 307 CG ASP A 192 3.071 7.140 9.703 1.00 31.12 C ATOM 308 OD1 ASP A 192 2.038 7.179 9.004 1.00 44.23 O ATOM 309 OD2 ASP A 192 4.184 7.494 9.255 1.00 2.45 O ATOM 0 H ASP A 192 3.116 5.567 13.424 1.00 12.44 H new ATOM 0 HA ASP A 192 1.992 4.775 10.865 1.00 63.23 H new ATOM 0 HB2 ASP A 192 2.078 7.154 11.624 1.00 3.44 H new ATOM 0 HB3 ASP A 192 3.826 7.073 11.728 1.00 3.44 H new ATOM 314 N LEU A 193 4.016 4.200 9.449 1.00 33.24 N ATOM 315 CA LEU A 193 5.137 3.785 8.595 1.00 31.04 C ATOM 316 C LEU A 193 5.109 4.618 7.307 1.00 73.23 C ATOM 317 O LEU A 193 4.042 4.964 6.812 1.00 1.34 O ATOM 318 CB LEU A 193 5.086 2.251 8.264 1.00 64.41 C ATOM 319 CG LEU A 193 5.795 1.293 9.276 1.00 10.33 C ATOM 320 CD1 LEU A 193 5.582 -0.190 8.893 1.00 72.55 C ATOM 321 CD2 LEU A 193 7.307 1.612 9.373 1.00 21.33 C ATOM 0 H LEU A 193 3.133 4.262 8.943 1.00 33.24 H new ATOM 0 HA LEU A 193 6.069 3.959 9.132 1.00 31.04 H new ATOM 0 HB2 LEU A 193 4.040 1.953 8.188 1.00 64.41 H new ATOM 0 HB3 LEU A 193 5.532 2.099 7.281 1.00 64.41 H new ATOM 0 HG LEU A 193 5.342 1.458 10.254 1.00 10.33 H new ATOM 0 HD11 LEU A 193 6.088 -0.829 9.617 1.00 72.55 H new ATOM 0 HD12 LEU A 193 4.516 -0.416 8.892 1.00 72.55 H new ATOM 0 HD13 LEU A 193 5.992 -0.372 7.900 1.00 72.55 H new ATOM 0 HD21 LEU A 193 7.777 0.932 10.083 1.00 21.33 H new ATOM 0 HD22 LEU A 193 7.768 1.489 8.393 1.00 21.33 H new ATOM 0 HD23 LEU A 193 7.441 2.640 9.711 1.00 21.33 H new ATOM 333 N TYR A 194 6.295 4.971 6.806 1.00 32.51 N ATOM 334 CA TYR A 194 6.477 5.504 5.446 1.00 10.35 C ATOM 335 C TYR A 194 7.240 4.443 4.665 1.00 65.24 C ATOM 336 O TYR A 194 8.211 3.875 5.185 1.00 62.23 O ATOM 337 CB TYR A 194 7.281 6.836 5.420 1.00 14.42 C ATOM 338 CG TYR A 194 6.637 8.000 6.187 1.00 34.25 C ATOM 339 CD1 TYR A 194 7.215 8.497 7.357 1.00 44.24 C ATOM 340 CD2 TYR A 194 5.460 8.608 5.734 1.00 14.44 C ATOM 341 CE1 TYR A 194 6.653 9.554 8.041 1.00 51.31 C ATOM 342 CE2 TYR A 194 4.895 9.669 6.423 1.00 1.23 C ATOM 343 CZ TYR A 194 5.495 10.133 7.577 1.00 24.32 C ATOM 344 OH TYR A 194 4.947 11.194 8.266 1.00 24.43 O ATOM 0 H TYR A 194 7.165 4.896 7.333 1.00 32.51 H new ATOM 0 HA TYR A 194 5.500 5.726 5.015 1.00 10.35 H new ATOM 0 HB2 TYR A 194 8.272 6.652 5.834 1.00 14.42 H new ATOM 0 HB3 TYR A 194 7.420 7.138 4.382 1.00 14.42 H new ATOM 0 HD1 TYR A 194 8.120 8.044 7.734 1.00 44.24 H new ATOM 0 HD2 TYR A 194 4.986 8.245 4.834 1.00 14.44 H new ATOM 0 HE1 TYR A 194 7.121 9.927 8.940 1.00 51.31 H new ATOM 0 HE2 TYR A 194 3.989 10.131 6.059 1.00 1.23 H new ATOM 0 HH TYR A 194 4.132 11.493 7.812 1.00 24.43 H new ATOM 354 N ALA A 195 6.799 4.176 3.442 1.00 55.11 N ATOM 355 CA ALA A 195 7.435 3.198 2.558 1.00 34.22 C ATOM 356 C ALA A 195 7.034 3.476 1.104 1.00 53.41 C ATOM 357 O ALA A 195 6.178 4.323 0.825 1.00 34.10 O ATOM 358 CB ALA A 195 7.084 1.754 2.980 1.00 41.31 C ATOM 0 H ALA A 195 5.985 4.633 3.030 1.00 55.11 H new ATOM 0 HA ALA A 195 8.517 3.298 2.641 1.00 34.22 H new ATOM 0 HB1 ALA A 195 7.570 1.049 2.305 1.00 41.31 H new ATOM 0 HB2 ALA A 195 7.430 1.578 3.999 1.00 41.31 H new ATOM 0 HB3 ALA A 195 6.004 1.614 2.934 1.00 41.31 H new ATOM 364 N THR A 196 7.680 2.768 0.188 1.00 54.41 N ATOM 365 CA THR A 196 7.424 2.878 -1.242 1.00 71.30 C ATOM 366 C THR A 196 6.817 1.553 -1.731 1.00 4.21 C ATOM 367 O THR A 196 7.203 0.478 -1.246 1.00 4.32 O ATOM 368 CB THR A 196 8.759 3.200 -1.986 1.00 62.44 C ATOM 369 OG1 THR A 196 9.388 4.337 -1.362 1.00 53.41 O ATOM 370 CG2 THR A 196 8.536 3.498 -3.464 1.00 11.14 C ATOM 0 H THR A 196 8.407 2.091 0.420 1.00 54.41 H new ATOM 0 HA THR A 196 6.722 3.686 -1.449 1.00 71.30 H new ATOM 0 HB THR A 196 9.398 2.320 -1.918 1.00 62.44 H new ATOM 0 HG1 THR A 196 10.227 4.541 -1.825 1.00 53.41 H new ATOM 0 HG21 THR A 196 9.492 3.716 -3.940 1.00 11.14 H new ATOM 0 HG22 THR A 196 8.081 2.632 -3.945 1.00 11.14 H new ATOM 0 HG23 THR A 196 7.875 4.359 -3.566 1.00 11.14 H new ATOM 378 N LEU A 197 5.857 1.627 -2.663 1.00 5.12 N ATOM 379 CA LEU A 197 5.199 0.437 -3.226 1.00 62.22 C ATOM 380 C LEU A 197 5.648 0.248 -4.673 1.00 30.13 C ATOM 381 O LEU A 197 5.483 1.150 -5.490 1.00 3.33 O ATOM 382 CB LEU A 197 3.648 0.562 -3.188 1.00 32.22 C ATOM 383 CG LEU A 197 2.861 -0.701 -3.683 1.00 15.10 C ATOM 384 CD1 LEU A 197 3.174 -1.932 -2.807 1.00 52.15 C ATOM 385 CD2 LEU A 197 1.343 -0.434 -3.739 1.00 22.11 C ATOM 0 H LEU A 197 5.515 2.508 -3.047 1.00 5.12 H new ATOM 0 HA LEU A 197 5.486 -0.422 -2.619 1.00 62.22 H new ATOM 0 HB2 LEU A 197 3.343 0.782 -2.165 1.00 32.22 H new ATOM 0 HB3 LEU A 197 3.354 1.415 -3.799 1.00 32.22 H new ATOM 0 HG LEU A 197 3.196 -0.917 -4.697 1.00 15.10 H new ATOM 0 HD11 LEU A 197 2.614 -2.792 -3.174 1.00 52.15 H new ATOM 0 HD12 LEU A 197 4.241 -2.148 -2.851 1.00 52.15 H new ATOM 0 HD13 LEU A 197 2.888 -1.727 -1.775 1.00 52.15 H new ATOM 0 HD21 LEU A 197 0.829 -1.330 -4.086 1.00 22.11 H new ATOM 0 HD22 LEU A 197 0.983 -0.171 -2.744 1.00 22.11 H new ATOM 0 HD23 LEU A 197 1.143 0.388 -4.426 1.00 22.11 H new ATOM 397 N ASP A 198 6.237 -0.916 -4.967 1.00 53.42 N ATOM 398 CA ASP A 198 6.479 -1.356 -6.349 1.00 42.21 C ATOM 399 C ASP A 198 5.195 -1.995 -6.903 1.00 23.21 C ATOM 400 O ASP A 198 4.541 -2.789 -6.211 1.00 12.21 O ATOM 401 CB ASP A 198 7.653 -2.371 -6.419 1.00 14.22 C ATOM 402 CG ASP A 198 9.008 -1.763 -6.008 1.00 53.22 C ATOM 403 OD1 ASP A 198 9.330 -1.767 -4.800 1.00 63.14 O ATOM 404 OD2 ASP A 198 9.760 -1.279 -6.888 1.00 52.22 O ATOM 0 H ASP A 198 6.558 -1.577 -4.260 1.00 53.42 H new ATOM 0 HA ASP A 198 6.754 -0.490 -6.951 1.00 42.21 H new ATOM 0 HB2 ASP A 198 7.431 -3.218 -5.770 1.00 14.22 H new ATOM 0 HB3 ASP A 198 7.729 -2.758 -7.435 1.00 14.22 H new ATOM 409 N VAL A 199 4.834 -1.620 -8.127 1.00 65.15 N ATOM 410 CA VAL A 199 3.693 -2.187 -8.850 1.00 51.15 C ATOM 411 C VAL A 199 4.065 -2.293 -10.340 1.00 35.13 C ATOM 412 O VAL A 199 4.437 -1.292 -10.945 1.00 31.13 O ATOM 413 CB VAL A 199 2.381 -1.333 -8.649 1.00 35.43 C ATOM 414 CG1 VAL A 199 2.586 0.162 -8.990 1.00 54.40 C ATOM 415 CG2 VAL A 199 1.197 -1.931 -9.448 1.00 14.43 C ATOM 0 H VAL A 199 5.332 -0.903 -8.655 1.00 65.15 H new ATOM 0 HA VAL A 199 3.475 -3.177 -8.450 1.00 51.15 H new ATOM 0 HB VAL A 199 2.136 -1.381 -7.588 1.00 35.43 H new ATOM 0 HG11 VAL A 199 1.652 0.702 -8.834 1.00 54.40 H new ATOM 0 HG12 VAL A 199 3.359 0.580 -8.345 1.00 54.40 H new ATOM 0 HG13 VAL A 199 2.892 0.259 -10.032 1.00 54.40 H new ATOM 0 HG21 VAL A 199 0.307 -1.322 -9.290 1.00 14.43 H new ATOM 0 HG22 VAL A 199 1.444 -1.944 -10.510 1.00 14.43 H new ATOM 0 HG23 VAL A 199 1.005 -2.949 -9.107 1.00 14.43 H new ATOM 425 N PRO A 200 4.035 -3.514 -10.952 1.00 53.42 N ATOM 426 CA PRO A 200 4.275 -3.685 -12.407 1.00 13.25 C ATOM 427 C PRO A 200 3.315 -2.840 -13.254 1.00 4.21 C ATOM 428 O PRO A 200 2.142 -2.710 -12.899 1.00 35.03 O ATOM 429 CB PRO A 200 4.043 -5.197 -12.637 1.00 44.24 C ATOM 430 CG PRO A 200 4.305 -5.816 -11.302 1.00 55.42 C ATOM 431 CD PRO A 200 3.796 -4.818 -10.289 1.00 74.13 C ATOM 0 HA PRO A 200 5.270 -3.354 -12.704 1.00 13.25 H new ATOM 0 HB2 PRO A 200 3.026 -5.397 -12.976 1.00 44.24 H new ATOM 0 HB3 PRO A 200 4.716 -5.592 -13.398 1.00 44.24 H new ATOM 0 HG2 PRO A 200 3.790 -6.772 -11.205 1.00 55.42 H new ATOM 0 HG3 PRO A 200 5.368 -6.011 -11.161 1.00 55.42 H new ATOM 0 HD2 PRO A 200 2.739 -4.970 -10.069 1.00 74.13 H new ATOM 0 HD3 PRO A 200 4.333 -4.894 -9.343 1.00 74.13 H new ATOM 439 N ALA A 201 3.830 -2.280 -14.371 1.00 52.23 N ATOM 440 CA ALA A 201 3.043 -1.466 -15.317 1.00 42.21 C ATOM 441 C ALA A 201 1.709 -2.147 -15.745 1.00 62.22 C ATOM 442 O ALA A 201 0.661 -1.486 -15.718 1.00 35.32 O ATOM 443 CB ALA A 201 3.893 -1.068 -16.545 1.00 0.14 C ATOM 0 H ALA A 201 4.808 -2.382 -14.641 1.00 52.23 H new ATOM 0 HA ALA A 201 2.761 -0.557 -14.785 1.00 42.21 H new ATOM 0 HB1 ALA A 201 3.289 -0.469 -17.227 1.00 0.14 H new ATOM 0 HB2 ALA A 201 4.755 -0.487 -16.218 1.00 0.14 H new ATOM 0 HB3 ALA A 201 4.235 -1.967 -17.058 1.00 0.14 H new ATOM 449 N PRO A 202 1.696 -3.494 -16.115 1.00 43.15 N ATOM 450 CA PRO A 202 0.428 -4.241 -16.358 1.00 4.15 C ATOM 451 C PRO A 202 -0.565 -4.158 -15.169 1.00 32.54 C ATOM 452 O PRO A 202 -1.693 -3.690 -15.350 1.00 71.41 O ATOM 453 CB PRO A 202 0.895 -5.708 -16.628 1.00 34.25 C ATOM 454 CG PRO A 202 2.331 -5.760 -16.187 1.00 24.10 C ATOM 455 CD PRO A 202 2.875 -4.372 -16.406 1.00 75.42 C ATOM 0 HA PRO A 202 -0.132 -3.818 -17.192 1.00 4.15 H new ATOM 0 HB2 PRO A 202 0.288 -6.422 -16.072 1.00 34.25 H new ATOM 0 HB3 PRO A 202 0.799 -5.962 -17.684 1.00 34.25 H new ATOM 0 HG2 PRO A 202 2.409 -6.050 -15.139 1.00 24.10 H new ATOM 0 HG3 PRO A 202 2.891 -6.496 -16.764 1.00 24.10 H new ATOM 0 HD2 PRO A 202 3.711 -4.157 -15.741 1.00 75.42 H new ATOM 0 HD3 PRO A 202 3.236 -4.237 -17.426 1.00 75.42 H new ATOM 463 N ILE A 203 -0.113 -4.547 -13.949 1.00 74.32 N ATOM 464 CA ILE A 203 -0.969 -4.579 -12.733 1.00 74.41 C ATOM 465 C ILE A 203 -1.464 -3.164 -12.341 1.00 53.24 C ATOM 466 O ILE A 203 -2.558 -3.010 -11.801 1.00 43.11 O ATOM 467 CB ILE A 203 -0.216 -5.246 -11.506 1.00 1.21 C ATOM 468 CG1 ILE A 203 0.247 -6.690 -11.874 1.00 54.10 C ATOM 469 CG2 ILE A 203 -1.099 -5.262 -10.223 1.00 55.02 C ATOM 470 CD1 ILE A 203 0.944 -7.447 -10.752 1.00 51.25 C ATOM 0 H ILE A 203 0.848 -4.845 -13.780 1.00 74.32 H new ATOM 0 HA ILE A 203 -1.837 -5.190 -12.981 1.00 74.41 H new ATOM 0 HB ILE A 203 0.662 -4.638 -11.287 1.00 1.21 H new ATOM 0 HG12 ILE A 203 -0.623 -7.264 -12.194 1.00 54.10 H new ATOM 0 HG13 ILE A 203 0.922 -6.632 -12.728 1.00 54.10 H new ATOM 0 HG21 ILE A 203 -0.546 -5.727 -9.407 1.00 55.02 H new ATOM 0 HG22 ILE A 203 -1.360 -4.240 -9.948 1.00 55.02 H new ATOM 0 HG23 ILE A 203 -2.009 -5.830 -10.415 1.00 55.02 H new ATOM 0 HD11 ILE A 203 1.228 -8.439 -11.104 1.00 51.25 H new ATOM 0 HD12 ILE A 203 1.836 -6.902 -10.445 1.00 51.25 H new ATOM 0 HD13 ILE A 203 0.267 -7.543 -9.903 1.00 51.25 H new ATOM 482 N ALA A 204 -0.661 -2.137 -12.643 1.00 21.24 N ATOM 483 CA ALA A 204 -0.994 -0.738 -12.322 1.00 10.31 C ATOM 484 C ALA A 204 -2.161 -0.224 -13.187 1.00 34.21 C ATOM 485 O ALA A 204 -3.065 0.448 -12.685 1.00 41.14 O ATOM 486 CB ALA A 204 0.246 0.151 -12.489 1.00 53.34 C ATOM 0 H ALA A 204 0.236 -2.248 -13.115 1.00 21.24 H new ATOM 0 HA ALA A 204 -1.318 -0.695 -11.282 1.00 10.31 H new ATOM 0 HB1 ALA A 204 -0.011 1.183 -12.249 1.00 53.34 H new ATOM 0 HB2 ALA A 204 1.033 -0.192 -11.817 1.00 53.34 H new ATOM 0 HB3 ALA A 204 0.598 0.095 -13.519 1.00 53.34 H new ATOM 492 N VAL A 205 -2.126 -0.565 -14.487 1.00 34.44 N ATOM 493 CA VAL A 205 -3.164 -0.163 -15.454 1.00 43.12 C ATOM 494 C VAL A 205 -4.465 -0.969 -15.241 1.00 41.32 C ATOM 495 O VAL A 205 -5.540 -0.388 -15.064 1.00 54.04 O ATOM 496 CB VAL A 205 -2.656 -0.338 -16.932 1.00 13.21 C ATOM 497 CG1 VAL A 205 -3.757 -0.001 -17.965 1.00 73.11 C ATOM 498 CG2 VAL A 205 -1.391 0.516 -17.163 1.00 5.52 C ATOM 0 H VAL A 205 -1.379 -1.126 -14.897 1.00 34.44 H new ATOM 0 HA VAL A 205 -3.380 0.892 -15.284 1.00 43.12 H new ATOM 0 HB VAL A 205 -2.400 -1.387 -17.078 1.00 13.21 H new ATOM 0 HG11 VAL A 205 -3.364 -0.135 -18.973 1.00 73.11 H new ATOM 0 HG12 VAL A 205 -4.610 -0.664 -17.817 1.00 73.11 H new ATOM 0 HG13 VAL A 205 -4.074 1.034 -17.834 1.00 73.11 H new ATOM 0 HG21 VAL A 205 -1.048 0.387 -18.189 1.00 5.52 H new ATOM 0 HG22 VAL A 205 -1.624 1.566 -16.987 1.00 5.52 H new ATOM 0 HG23 VAL A 205 -0.607 0.198 -16.476 1.00 5.52 H new ATOM 508 N VAL A 206 -4.351 -2.306 -15.256 1.00 31.54 N ATOM 509 CA VAL A 206 -5.529 -3.209 -15.190 1.00 61.22 C ATOM 510 C VAL A 206 -6.105 -3.309 -13.755 1.00 2.35 C ATOM 511 O VAL A 206 -7.277 -3.671 -13.580 1.00 41.51 O ATOM 512 CB VAL A 206 -5.192 -4.652 -15.735 1.00 73.43 C ATOM 513 CG1 VAL A 206 -4.590 -4.583 -17.155 1.00 32.24 C ATOM 514 CG2 VAL A 206 -4.274 -5.433 -14.770 1.00 52.53 C ATOM 0 H VAL A 206 -3.457 -2.794 -15.313 1.00 31.54 H new ATOM 0 HA VAL A 206 -6.289 -2.765 -15.833 1.00 61.22 H new ATOM 0 HB VAL A 206 -6.130 -5.203 -15.796 1.00 73.43 H new ATOM 0 HG11 VAL A 206 -4.368 -5.591 -17.505 1.00 32.24 H new ATOM 0 HG12 VAL A 206 -5.305 -4.113 -17.831 1.00 32.24 H new ATOM 0 HG13 VAL A 206 -3.672 -3.996 -17.133 1.00 32.24 H new ATOM 0 HG21 VAL A 206 -4.067 -6.420 -15.183 1.00 52.53 H new ATOM 0 HG22 VAL A 206 -3.338 -4.891 -14.640 1.00 52.53 H new ATOM 0 HG23 VAL A 206 -4.768 -5.540 -13.804 1.00 52.53 H new ATOM 524 N GLY A 207 -5.270 -2.995 -12.744 1.00 41.53 N ATOM 525 CA GLY A 207 -5.639 -3.166 -11.332 1.00 23.22 C ATOM 526 C GLY A 207 -5.336 -4.571 -10.828 1.00 23.45 C ATOM 527 O GLY A 207 -4.973 -5.454 -11.611 1.00 10.41 O ATOM 0 H GLY A 207 -4.332 -2.620 -12.885 1.00 41.53 H new ATOM 0 HA2 GLY A 207 -5.098 -2.439 -10.726 1.00 23.22 H new ATOM 0 HA3 GLY A 207 -6.702 -2.958 -11.207 1.00 23.22 H new ATOM 531 N GLY A 208 -5.453 -4.770 -9.515 1.00 35.50 N ATOM 532 CA GLY A 208 -5.297 -6.083 -8.906 1.00 13.14 C ATOM 533 C GLY A 208 -4.665 -5.975 -7.532 1.00 12.23 C ATOM 534 O GLY A 208 -5.145 -5.212 -6.688 1.00 10.05 O ATOM 0 H GLY A 208 -5.658 -4.025 -8.849 1.00 35.50 H new ATOM 0 HA2 GLY A 208 -6.270 -6.568 -8.825 1.00 13.14 H new ATOM 0 HA3 GLY A 208 -4.679 -6.713 -9.546 1.00 13.14 H new ATOM 538 N LYS A 209 -3.605 -6.761 -7.294 1.00 61.22 N ATOM 539 CA LYS A 209 -2.829 -6.737 -6.041 1.00 74.34 C ATOM 540 C LYS A 209 -1.334 -6.868 -6.356 1.00 53.10 C ATOM 541 O LYS A 209 -0.954 -7.369 -7.426 1.00 53.20 O ATOM 542 CB LYS A 209 -3.276 -7.885 -5.083 1.00 33.20 C ATOM 543 CG LYS A 209 -4.621 -7.630 -4.363 1.00 22.24 C ATOM 544 CD LYS A 209 -5.096 -8.837 -3.532 1.00 13.02 C ATOM 545 CE LYS A 209 -6.479 -8.607 -2.903 1.00 72.31 C ATOM 546 NZ LYS A 209 -6.901 -9.761 -2.064 1.00 65.22 N ATOM 0 H LYS A 209 -3.257 -7.439 -7.972 1.00 61.22 H new ATOM 0 HA LYS A 209 -3.013 -5.787 -5.540 1.00 74.34 H new ATOM 0 HB2 LYS A 209 -3.354 -8.809 -5.655 1.00 33.20 H new ATOM 0 HB3 LYS A 209 -2.500 -8.039 -4.333 1.00 33.20 H new ATOM 0 HG2 LYS A 209 -4.519 -6.764 -3.710 1.00 22.24 H new ATOM 0 HG3 LYS A 209 -5.382 -7.383 -5.103 1.00 22.24 H new ATOM 0 HD2 LYS A 209 -5.132 -9.721 -4.168 1.00 13.02 H new ATOM 0 HD3 LYS A 209 -4.371 -9.040 -2.744 1.00 13.02 H new ATOM 0 HE2 LYS A 209 -6.456 -7.703 -2.294 1.00 72.31 H new ATOM 0 HE3 LYS A 209 -7.214 -8.442 -3.691 1.00 72.31 H new ATOM 0 HZ1 LYS A 209 -7.838 -9.569 -1.656 1.00 65.22 H new ATOM 0 HZ2 LYS A 209 -6.947 -10.618 -2.651 1.00 65.22 H new ATOM 0 HZ3 LYS A 209 -6.213 -9.903 -1.297 1.00 65.22 H new ATOM 560 N VAL A 210 -0.491 -6.426 -5.412 1.00 41.32 N ATOM 561 CA VAL A 210 0.976 -6.634 -5.456 1.00 30.34 C ATOM 562 C VAL A 210 1.484 -6.999 -4.057 1.00 10.23 C ATOM 563 O VAL A 210 0.863 -6.649 -3.054 1.00 40.11 O ATOM 564 CB VAL A 210 1.759 -5.363 -5.965 1.00 41.33 C ATOM 565 CG1 VAL A 210 1.487 -5.068 -7.450 1.00 4.12 C ATOM 566 CG2 VAL A 210 1.448 -4.128 -5.095 1.00 73.45 C ATOM 0 H VAL A 210 -0.803 -5.910 -4.589 1.00 41.32 H new ATOM 0 HA VAL A 210 1.161 -7.442 -6.164 1.00 30.34 H new ATOM 0 HB VAL A 210 2.821 -5.590 -5.870 1.00 41.33 H new ATOM 0 HG11 VAL A 210 2.048 -4.184 -7.754 1.00 4.12 H new ATOM 0 HG12 VAL A 210 1.798 -5.921 -8.053 1.00 4.12 H new ATOM 0 HG13 VAL A 210 0.422 -4.890 -7.596 1.00 4.12 H new ATOM 0 HG21 VAL A 210 2.003 -3.269 -5.472 1.00 73.45 H new ATOM 0 HG22 VAL A 210 0.380 -3.915 -5.134 1.00 73.45 H new ATOM 0 HG23 VAL A 210 1.741 -4.326 -4.064 1.00 73.45 H new ATOM 576 N ARG A 211 2.623 -7.692 -3.998 1.00 20.35 N ATOM 577 CA ARG A 211 3.292 -7.994 -2.729 1.00 54.52 C ATOM 578 C ARG A 211 4.140 -6.789 -2.302 1.00 52.33 C ATOM 579 O ARG A 211 4.930 -6.257 -3.090 1.00 33.12 O ATOM 580 CB ARG A 211 4.144 -9.279 -2.863 1.00 21.43 C ATOM 581 CG ARG A 211 3.301 -10.545 -3.123 1.00 0.21 C ATOM 582 CD ARG A 211 4.155 -11.737 -3.587 1.00 2.41 C ATOM 583 NE ARG A 211 4.889 -11.422 -4.835 1.00 13.52 N ATOM 584 CZ ARG A 211 6.163 -11.751 -5.097 1.00 51.30 C ATOM 585 NH1 ARG A 211 6.898 -12.407 -4.199 1.00 11.44 N ATOM 586 NH2 ARG A 211 6.702 -11.401 -6.258 1.00 31.23 N ATOM 0 H ARG A 211 3.105 -8.057 -4.820 1.00 20.35 H new ATOM 0 HA ARG A 211 2.548 -8.179 -1.954 1.00 54.52 H new ATOM 0 HB2 ARG A 211 4.856 -9.151 -3.678 1.00 21.43 H new ATOM 0 HB3 ARG A 211 4.725 -9.418 -1.951 1.00 21.43 H new ATOM 0 HG2 ARG A 211 2.769 -10.817 -2.211 1.00 0.21 H new ATOM 0 HG3 ARG A 211 2.547 -10.326 -3.879 1.00 0.21 H new ATOM 0 HD2 ARG A 211 4.864 -12.005 -2.804 1.00 2.41 H new ATOM 0 HD3 ARG A 211 3.515 -12.604 -3.748 1.00 2.41 H new ATOM 0 HE ARG A 211 4.382 -10.911 -5.557 1.00 13.52 H new ATOM 0 HH11 ARG A 211 6.493 -12.665 -3.299 1.00 11.44 H new ATOM 0 HH12 ARG A 211 7.865 -12.651 -4.412 1.00 11.44 H new ATOM 0 HH21 ARG A 211 6.148 -10.886 -6.943 1.00 31.23 H new ATOM 0 HH22 ARG A 211 7.670 -11.647 -6.466 1.00 31.23 H new ATOM 600 N ALA A 212 3.925 -6.354 -1.063 1.00 13.45 N ATOM 601 CA ALA A 212 4.639 -5.229 -0.443 1.00 41.02 C ATOM 602 C ALA A 212 5.444 -5.742 0.748 1.00 34.53 C ATOM 603 O ALA A 212 5.016 -6.683 1.432 1.00 64.34 O ATOM 604 CB ALA A 212 3.649 -4.140 0.009 1.00 72.42 C ATOM 0 H ALA A 212 3.235 -6.780 -0.444 1.00 13.45 H new ATOM 0 HA ALA A 212 5.314 -4.786 -1.175 1.00 41.02 H new ATOM 0 HB1 ALA A 212 4.198 -3.316 0.465 1.00 72.42 H new ATOM 0 HB2 ALA A 212 3.094 -3.772 -0.854 1.00 72.42 H new ATOM 0 HB3 ALA A 212 2.954 -4.560 0.736 1.00 72.42 H new ATOM 610 N MET A 213 6.603 -5.128 0.987 1.00 50.12 N ATOM 611 CA MET A 213 7.466 -5.466 2.119 1.00 12.15 C ATOM 612 C MET A 213 7.161 -4.525 3.287 1.00 45.54 C ATOM 613 O MET A 213 7.423 -3.317 3.208 1.00 55.21 O ATOM 614 CB MET A 213 8.956 -5.377 1.697 1.00 41.32 C ATOM 615 CG MET A 213 9.365 -6.271 0.502 1.00 10.55 C ATOM 616 SD MET A 213 9.769 -7.989 0.934 1.00 62.22 S ATOM 617 CE MET A 213 8.182 -8.755 1.294 1.00 33.13 C ATOM 0 H MET A 213 6.971 -4.380 0.399 1.00 50.12 H new ATOM 0 HA MET A 213 7.272 -6.490 2.439 1.00 12.15 H new ATOM 0 HB2 MET A 213 9.183 -4.341 1.447 1.00 41.32 H new ATOM 0 HB3 MET A 213 9.575 -5.641 2.555 1.00 41.32 H new ATOM 0 HG2 MET A 213 8.552 -6.276 -0.224 1.00 10.55 H new ATOM 0 HG3 MET A 213 10.229 -5.823 0.011 1.00 10.55 H new ATOM 0 HE1 MET A 213 8.196 -9.794 0.963 1.00 33.13 H new ATOM 0 HE2 MET A 213 7.995 -8.718 2.367 1.00 33.13 H new ATOM 0 HE3 MET A 213 7.392 -8.218 0.770 1.00 33.13 H new ATOM 627 N THR A 214 6.550 -5.079 4.341 1.00 40.25 N ATOM 628 CA THR A 214 6.285 -4.369 5.599 1.00 25.15 C ATOM 629 C THR A 214 7.000 -5.088 6.751 1.00 13.14 C ATOM 630 O THR A 214 7.583 -6.163 6.556 1.00 4.51 O ATOM 631 CB THR A 214 4.750 -4.286 5.879 1.00 24.12 C ATOM 632 OG1 THR A 214 4.186 -5.597 5.815 1.00 62.32 O ATOM 633 CG2 THR A 214 4.041 -3.370 4.876 1.00 71.13 C ATOM 0 H THR A 214 6.222 -6.045 4.345 1.00 40.25 H new ATOM 0 HA THR A 214 6.666 -3.351 5.516 1.00 25.15 H new ATOM 0 HB THR A 214 4.609 -3.864 6.874 1.00 24.12 H new ATOM 0 HG1 THR A 214 4.872 -6.235 5.526 1.00 62.32 H new ATOM 0 HG21 THR A 214 2.975 -3.338 5.103 1.00 71.13 H new ATOM 0 HG22 THR A 214 4.457 -2.365 4.944 1.00 71.13 H new ATOM 0 HG23 THR A 214 4.185 -3.755 3.867 1.00 71.13 H new ATOM 641 N LEU A 215 6.937 -4.493 7.955 1.00 73.54 N ATOM 642 CA LEU A 215 7.629 -5.041 9.140 1.00 1.42 C ATOM 643 C LEU A 215 6.852 -6.225 9.758 1.00 24.14 C ATOM 644 O LEU A 215 7.312 -6.836 10.729 1.00 24.34 O ATOM 645 CB LEU A 215 7.902 -3.917 10.180 1.00 10.22 C ATOM 646 CG LEU A 215 8.562 -2.608 9.618 1.00 73.03 C ATOM 647 CD1 LEU A 215 9.046 -1.684 10.752 1.00 20.32 C ATOM 648 CD2 LEU A 215 9.706 -2.902 8.624 1.00 33.55 C ATOM 0 H LEU A 215 6.416 -3.635 8.135 1.00 73.54 H new ATOM 0 HA LEU A 215 8.592 -5.437 8.817 1.00 1.42 H new ATOM 0 HB2 LEU A 215 6.957 -3.650 10.654 1.00 10.22 H new ATOM 0 HB3 LEU A 215 8.547 -4.320 10.961 1.00 10.22 H new ATOM 0 HG LEU A 215 7.781 -2.086 9.065 1.00 73.03 H new ATOM 0 HD11 LEU A 215 9.497 -0.789 10.324 1.00 20.32 H new ATOM 0 HD12 LEU A 215 8.199 -1.401 11.377 1.00 20.32 H new ATOM 0 HD13 LEU A 215 9.785 -2.208 11.358 1.00 20.32 H new ATOM 0 HD21 LEU A 215 10.127 -1.963 8.266 1.00 33.55 H new ATOM 0 HD22 LEU A 215 10.483 -3.481 9.124 1.00 33.55 H new ATOM 0 HD23 LEU A 215 9.317 -3.470 7.779 1.00 33.55 H new ATOM 660 N GLU A 216 5.683 -6.536 9.171 1.00 34.54 N ATOM 661 CA GLU A 216 4.887 -7.731 9.507 1.00 24.44 C ATOM 662 C GLU A 216 5.101 -8.852 8.458 1.00 73.23 C ATOM 663 O GLU A 216 4.560 -9.947 8.621 1.00 54.42 O ATOM 664 CB GLU A 216 3.385 -7.357 9.589 1.00 61.13 C ATOM 665 CG GLU A 216 2.759 -6.991 8.229 1.00 41.10 C ATOM 666 CD GLU A 216 1.318 -6.500 8.324 1.00 54.23 C ATOM 667 OE1 GLU A 216 1.073 -5.287 8.144 1.00 1.04 O ATOM 668 OE2 GLU A 216 0.419 -7.330 8.583 1.00 13.14 O ATOM 0 H GLU A 216 5.260 -5.960 8.443 1.00 34.54 H new ATOM 0 HA GLU A 216 5.218 -8.105 10.476 1.00 24.44 H new ATOM 0 HB2 GLU A 216 2.835 -8.194 10.018 1.00 61.13 H new ATOM 0 HB3 GLU A 216 3.267 -6.515 10.271 1.00 61.13 H new ATOM 0 HG2 GLU A 216 3.366 -6.218 7.757 1.00 41.10 H new ATOM 0 HG3 GLU A 216 2.793 -7.864 7.578 1.00 41.10 H new ATOM 675 N GLY A 217 5.869 -8.545 7.383 1.00 62.44 N ATOM 676 CA GLY A 217 6.203 -9.508 6.316 1.00 21.21 C ATOM 677 C GLY A 217 5.600 -9.125 4.960 1.00 62.43 C ATOM 678 O GLY A 217 5.282 -7.951 4.742 1.00 52.01 O ATOM 0 H GLY A 217 6.272 -7.620 7.236 1.00 62.44 H new ATOM 0 HA2 GLY A 217 7.287 -9.576 6.220 1.00 21.21 H new ATOM 0 HA3 GLY A 217 5.846 -10.497 6.601 1.00 21.21 H new ATOM 682 N PRO A 218 5.476 -10.094 3.993 1.00 24.30 N ATOM 683 CA PRO A 218 4.819 -9.845 2.686 1.00 63.21 C ATOM 684 C PRO A 218 3.284 -9.686 2.815 1.00 54.24 C ATOM 685 O PRO A 218 2.614 -10.505 3.459 1.00 51.24 O ATOM 686 CB PRO A 218 5.197 -11.096 1.858 1.00 42.03 C ATOM 687 CG PRO A 218 5.424 -12.178 2.868 1.00 54.11 C ATOM 688 CD PRO A 218 5.995 -11.494 4.093 1.00 24.31 C ATOM 0 HA PRO A 218 5.144 -8.911 2.228 1.00 63.21 H new ATOM 0 HB2 PRO A 218 4.401 -11.365 1.164 1.00 42.03 H new ATOM 0 HB3 PRO A 218 6.092 -10.919 1.262 1.00 42.03 H new ATOM 0 HG2 PRO A 218 4.492 -12.691 3.106 1.00 54.11 H new ATOM 0 HG3 PRO A 218 6.113 -12.931 2.485 1.00 54.11 H new ATOM 0 HD2 PRO A 218 5.665 -11.978 5.012 1.00 24.31 H new ATOM 0 HD3 PRO A 218 7.085 -11.518 4.093 1.00 24.31 H new ATOM 696 N VAL A 219 2.734 -8.626 2.188 1.00 52.23 N ATOM 697 CA VAL A 219 1.291 -8.306 2.235 1.00 1.45 C ATOM 698 C VAL A 219 0.771 -7.949 0.827 1.00 13.33 C ATOM 699 O VAL A 219 1.456 -7.267 0.070 1.00 10.23 O ATOM 700 CB VAL A 219 0.997 -7.120 3.234 1.00 35.03 C ATOM 701 CG1 VAL A 219 1.313 -7.514 4.695 1.00 23.40 C ATOM 702 CG2 VAL A 219 1.756 -5.827 2.842 1.00 35.43 C ATOM 0 H VAL A 219 3.279 -7.966 1.633 1.00 52.23 H new ATOM 0 HA VAL A 219 0.768 -9.192 2.595 1.00 1.45 H new ATOM 0 HB VAL A 219 -0.070 -6.912 3.162 1.00 35.03 H new ATOM 0 HG11 VAL A 219 1.098 -6.672 5.353 1.00 23.40 H new ATOM 0 HG12 VAL A 219 0.698 -8.366 4.983 1.00 23.40 H new ATOM 0 HG13 VAL A 219 2.366 -7.782 4.780 1.00 23.40 H new ATOM 0 HG21 VAL A 219 1.524 -5.038 3.557 1.00 35.43 H new ATOM 0 HG22 VAL A 219 2.829 -6.019 2.849 1.00 35.43 H new ATOM 0 HG23 VAL A 219 1.450 -5.514 1.844 1.00 35.43 H new ATOM 712 N GLU A 220 -0.441 -8.415 0.480 1.00 42.32 N ATOM 713 CA GLU A 220 -1.062 -8.124 -0.827 1.00 52.30 C ATOM 714 C GLU A 220 -1.838 -6.798 -0.761 1.00 35.34 C ATOM 715 O GLU A 220 -2.934 -6.763 -0.198 1.00 22.15 O ATOM 716 CB GLU A 220 -2.032 -9.263 -1.240 1.00 20.02 C ATOM 717 CG GLU A 220 -1.394 -10.652 -1.431 1.00 4.11 C ATOM 718 CD GLU A 220 -2.429 -11.730 -1.798 1.00 51.05 C ATOM 719 OE1 GLU A 220 -2.769 -11.867 -2.993 1.00 12.04 O ATOM 720 OE2 GLU A 220 -2.933 -12.427 -0.890 1.00 75.20 O ATOM 0 H GLU A 220 -1.014 -8.998 1.090 1.00 42.32 H new ATOM 0 HA GLU A 220 -0.268 -8.047 -1.569 1.00 52.30 H new ATOM 0 HB2 GLU A 220 -2.811 -9.343 -0.482 1.00 20.02 H new ATOM 0 HB3 GLU A 220 -2.521 -8.978 -2.171 1.00 20.02 H new ATOM 0 HG2 GLU A 220 -0.638 -10.597 -2.215 1.00 4.11 H new ATOM 0 HG3 GLU A 220 -0.881 -10.942 -0.514 1.00 4.11 H new ATOM 727 N VAL A 221 -1.288 -5.735 -1.366 1.00 31.03 N ATOM 728 CA VAL A 221 -1.927 -4.409 -1.400 1.00 4.14 C ATOM 729 C VAL A 221 -2.762 -4.303 -2.681 1.00 11.11 C ATOM 730 O VAL A 221 -2.218 -4.406 -3.785 1.00 10.12 O ATOM 731 CB VAL A 221 -0.866 -3.232 -1.373 1.00 62.22 C ATOM 732 CG1 VAL A 221 -1.559 -1.844 -1.429 1.00 45.15 C ATOM 733 CG2 VAL A 221 0.039 -3.340 -0.130 1.00 50.14 C ATOM 0 H VAL A 221 -0.388 -5.769 -1.845 1.00 31.03 H new ATOM 0 HA VAL A 221 -2.551 -4.310 -0.512 1.00 4.14 H new ATOM 0 HB VAL A 221 -0.242 -3.328 -2.262 1.00 62.22 H new ATOM 0 HG11 VAL A 221 -0.803 -1.059 -1.409 1.00 45.15 H new ATOM 0 HG12 VAL A 221 -2.140 -1.764 -2.348 1.00 45.15 H new ATOM 0 HG13 VAL A 221 -2.221 -1.733 -0.570 1.00 45.15 H new ATOM 0 HG21 VAL A 221 0.759 -2.522 -0.132 1.00 50.14 H new ATOM 0 HG22 VAL A 221 -0.572 -3.283 0.771 1.00 50.14 H new ATOM 0 HG23 VAL A 221 0.570 -4.292 -0.148 1.00 50.14 H new ATOM 743 N ALA A 222 -4.082 -4.138 -2.500 1.00 64.34 N ATOM 744 CA ALA A 222 -5.043 -3.984 -3.592 1.00 74.54 C ATOM 745 C ALA A 222 -4.783 -2.676 -4.347 1.00 61.13 C ATOM 746 O ALA A 222 -5.099 -1.585 -3.850 1.00 74.01 O ATOM 747 CB ALA A 222 -6.470 -4.029 -3.034 1.00 52.44 C ATOM 0 H ALA A 222 -4.513 -4.108 -1.576 1.00 64.34 H new ATOM 0 HA ALA A 222 -4.924 -4.806 -4.298 1.00 74.54 H new ATOM 0 HB1 ALA A 222 -7.184 -3.914 -3.850 1.00 52.44 H new ATOM 0 HB2 ALA A 222 -6.637 -4.985 -2.538 1.00 52.44 H new ATOM 0 HB3 ALA A 222 -6.606 -3.220 -2.317 1.00 52.44 H new ATOM 753 N VAL A 223 -4.132 -2.823 -5.508 1.00 61.33 N ATOM 754 CA VAL A 223 -3.876 -1.733 -6.448 1.00 34.33 C ATOM 755 C VAL A 223 -5.169 -1.443 -7.238 1.00 63.42 C ATOM 756 O VAL A 223 -5.673 -2.336 -7.920 1.00 64.33 O ATOM 757 CB VAL A 223 -2.720 -2.103 -7.459 1.00 11.41 C ATOM 758 CG1 VAL A 223 -2.445 -0.950 -8.459 1.00 42.52 C ATOM 759 CG2 VAL A 223 -1.440 -2.500 -6.699 1.00 34.02 C ATOM 0 H VAL A 223 -3.763 -3.720 -5.823 1.00 61.33 H new ATOM 0 HA VAL A 223 -3.564 -0.855 -5.883 1.00 34.33 H new ATOM 0 HB VAL A 223 -3.050 -2.963 -8.042 1.00 11.41 H new ATOM 0 HG11 VAL A 223 -1.644 -1.241 -9.138 1.00 42.52 H new ATOM 0 HG12 VAL A 223 -3.349 -0.742 -9.032 1.00 42.52 H new ATOM 0 HG13 VAL A 223 -2.149 -0.056 -7.911 1.00 42.52 H new ATOM 0 HG21 VAL A 223 -0.656 -2.751 -7.413 1.00 34.02 H new ATOM 0 HG22 VAL A 223 -1.112 -1.666 -6.078 1.00 34.02 H new ATOM 0 HG23 VAL A 223 -1.645 -3.364 -6.067 1.00 34.02 H new ATOM 769 N PRO A 224 -5.753 -0.214 -7.129 1.00 1.23 N ATOM 770 CA PRO A 224 -6.870 0.208 -8.011 1.00 33.50 C ATOM 771 C PRO A 224 -6.415 0.324 -9.498 1.00 50.43 C ATOM 772 O PRO A 224 -5.229 0.561 -9.763 1.00 74.33 O ATOM 773 CB PRO A 224 -7.291 1.579 -7.420 1.00 4.34 C ATOM 774 CG PRO A 224 -6.108 2.061 -6.635 1.00 73.24 C ATOM 775 CD PRO A 224 -5.414 0.829 -6.121 1.00 64.54 C ATOM 0 HA PRO A 224 -7.691 -0.508 -8.034 1.00 33.50 H new ATOM 0 HB2 PRO A 224 -7.550 2.283 -8.210 1.00 4.34 H new ATOM 0 HB3 PRO A 224 -8.169 1.478 -6.783 1.00 4.34 H new ATOM 0 HG2 PRO A 224 -5.439 2.651 -7.262 1.00 73.24 H new ATOM 0 HG3 PRO A 224 -6.422 2.703 -5.812 1.00 73.24 H new ATOM 0 HD2 PRO A 224 -4.337 0.978 -6.046 1.00 64.54 H new ATOM 0 HD3 PRO A 224 -5.768 0.555 -5.127 1.00 64.54 H new ATOM 783 N PRO A 225 -7.335 0.119 -10.497 1.00 63.44 N ATOM 784 CA PRO A 225 -6.993 0.246 -11.937 1.00 2.12 C ATOM 785 C PRO A 225 -6.574 1.684 -12.317 1.00 13.44 C ATOM 786 O PRO A 225 -7.145 2.657 -11.803 1.00 12.30 O ATOM 787 CB PRO A 225 -8.299 -0.184 -12.669 1.00 70.33 C ATOM 788 CG PRO A 225 -9.086 -0.947 -11.639 1.00 41.12 C ATOM 789 CD PRO A 225 -8.755 -0.290 -10.322 1.00 1.33 C ATOM 0 HA PRO A 225 -6.134 -0.367 -12.210 1.00 2.12 H new ATOM 0 HB2 PRO A 225 -8.854 0.682 -13.028 1.00 70.33 H new ATOM 0 HB3 PRO A 225 -8.079 -0.804 -13.538 1.00 70.33 H new ATOM 0 HG2 PRO A 225 -10.155 -0.899 -11.845 1.00 41.12 H new ATOM 0 HG3 PRO A 225 -8.809 -2.001 -11.634 1.00 41.12 H new ATOM 0 HD2 PRO A 225 -9.400 0.566 -10.125 1.00 1.33 H new ATOM 0 HD3 PRO A 225 -8.876 -0.979 -9.486 1.00 1.33 H new ATOM 797 N ARG A 226 -5.565 1.775 -13.205 1.00 61.22 N ATOM 798 CA ARG A 226 -5.049 3.040 -13.768 1.00 44.33 C ATOM 799 C ARG A 226 -4.457 3.927 -12.657 1.00 22.31 C ATOM 800 O ARG A 226 -4.786 5.114 -12.519 1.00 34.32 O ATOM 801 CB ARG A 226 -6.141 3.764 -14.606 1.00 2.34 C ATOM 802 CG ARG A 226 -6.672 2.934 -15.804 1.00 31.13 C ATOM 803 CD ARG A 226 -7.890 3.587 -16.476 1.00 11.02 C ATOM 804 NE ARG A 226 -8.984 3.803 -15.500 1.00 71.44 N ATOM 805 CZ ARG A 226 -9.804 4.863 -15.469 1.00 62.12 C ATOM 806 NH1 ARG A 226 -9.680 5.846 -16.353 1.00 12.31 N ATOM 807 NH2 ARG A 226 -10.737 4.953 -14.529 1.00 60.02 N ATOM 0 H ARG A 226 -5.075 0.954 -13.559 1.00 61.22 H new ATOM 0 HA ARG A 226 -4.235 2.814 -14.456 1.00 44.33 H new ATOM 0 HB2 ARG A 226 -6.977 4.017 -13.954 1.00 2.34 H new ATOM 0 HB3 ARG A 226 -5.734 4.703 -14.980 1.00 2.34 H new ATOM 0 HG2 ARG A 226 -5.877 2.813 -16.539 1.00 31.13 H new ATOM 0 HG3 ARG A 226 -6.942 1.936 -15.459 1.00 31.13 H new ATOM 0 HD2 ARG A 226 -7.599 4.540 -16.917 1.00 11.02 H new ATOM 0 HD3 ARG A 226 -8.244 2.954 -17.290 1.00 11.02 H new ATOM 0 HE ARG A 226 -9.125 3.083 -14.791 1.00 71.44 H new ATOM 0 HH11 ARG A 226 -8.954 5.801 -17.068 1.00 12.31 H new ATOM 0 HH12 ARG A 226 -10.311 6.647 -16.317 1.00 12.31 H new ATOM 0 HH21 ARG A 226 -10.830 4.216 -13.830 1.00 60.02 H new ATOM 0 HH22 ARG A 226 -11.361 5.760 -14.505 1.00 60.02 H new ATOM 821 N THR A 227 -3.604 3.294 -11.844 1.00 22.03 N ATOM 822 CA THR A 227 -2.812 3.950 -10.810 1.00 65.23 C ATOM 823 C THR A 227 -1.385 4.194 -11.341 1.00 4.10 C ATOM 824 O THR A 227 -0.603 3.256 -11.518 1.00 13.33 O ATOM 825 CB THR A 227 -2.799 3.080 -9.513 1.00 32.31 C ATOM 826 OG1 THR A 227 -4.129 3.023 -8.982 1.00 14.30 O ATOM 827 CG2 THR A 227 -1.848 3.618 -8.438 1.00 44.32 C ATOM 0 H THR A 227 -3.445 2.288 -11.892 1.00 22.03 H new ATOM 0 HA THR A 227 -3.255 4.913 -10.557 1.00 65.23 H new ATOM 0 HB THR A 227 -2.438 2.089 -9.789 1.00 32.31 H new ATOM 0 HG1 THR A 227 -4.547 2.174 -9.237 1.00 14.30 H new ATOM 0 HG21 THR A 227 -1.885 2.970 -7.562 1.00 44.32 H new ATOM 0 HG22 THR A 227 -0.831 3.641 -8.830 1.00 44.32 H new ATOM 0 HG23 THR A 227 -2.151 4.626 -8.156 1.00 44.32 H new ATOM 835 N GLN A 228 -1.071 5.475 -11.594 1.00 43.04 N ATOM 836 CA GLN A 228 0.204 5.894 -12.205 1.00 3.30 C ATOM 837 C GLN A 228 1.314 6.061 -11.152 1.00 53.42 C ATOM 838 O GLN A 228 1.029 6.195 -9.953 1.00 64.22 O ATOM 839 CB GLN A 228 0.016 7.216 -13.006 1.00 52.11 C ATOM 840 CG GLN A 228 -1.031 7.140 -14.154 1.00 2.44 C ATOM 841 CD GLN A 228 -2.494 7.293 -13.702 1.00 15.14 C ATOM 842 OE1 GLN A 228 -2.784 7.952 -12.705 1.00 33.12 O ATOM 843 NE2 GLN A 228 -3.423 6.711 -14.441 1.00 0.33 N ATOM 0 H GLN A 228 -1.695 6.253 -11.380 1.00 43.04 H new ATOM 0 HA GLN A 228 0.514 5.105 -12.890 1.00 3.30 H new ATOM 0 HB2 GLN A 228 -0.281 8.004 -12.314 1.00 52.11 H new ATOM 0 HB3 GLN A 228 0.977 7.508 -13.429 1.00 52.11 H new ATOM 0 HG2 GLN A 228 -0.807 7.918 -14.883 1.00 2.44 H new ATOM 0 HG3 GLN A 228 -0.921 6.183 -14.665 1.00 2.44 H new ATOM 0 HE21 GLN A 228 -3.156 6.170 -15.263 1.00 0.33 H new ATOM 0 HE22 GLN A 228 -4.407 6.803 -14.189 1.00 0.33 H new ATOM 852 N ALA A 229 2.576 6.057 -11.629 1.00 74.31 N ATOM 853 CA ALA A 229 3.771 6.259 -10.788 1.00 5.43 C ATOM 854 C ALA A 229 3.823 7.712 -10.284 1.00 15.51 C ATOM 855 O ALA A 229 3.785 8.645 -11.089 1.00 53.04 O ATOM 856 CB ALA A 229 5.041 5.919 -11.584 1.00 10.40 C ATOM 0 H ALA A 229 2.794 5.913 -12.615 1.00 74.31 H new ATOM 0 HA ALA A 229 3.714 5.595 -9.926 1.00 5.43 H new ATOM 0 HB1 ALA A 229 5.917 6.072 -10.954 1.00 10.40 H new ATOM 0 HB2 ALA A 229 5.002 4.878 -11.905 1.00 10.40 H new ATOM 0 HB3 ALA A 229 5.106 6.566 -12.459 1.00 10.40 H new ATOM 862 N GLY A 230 3.900 7.887 -8.959 1.00 72.43 N ATOM 863 CA GLY A 230 3.851 9.219 -8.337 1.00 11.03 C ATOM 864 C GLY A 230 2.576 9.440 -7.541 1.00 74.23 C ATOM 865 O GLY A 230 2.454 10.445 -6.833 1.00 22.43 O ATOM 0 H GLY A 230 3.997 7.120 -8.293 1.00 72.43 H new ATOM 0 HA2 GLY A 230 4.712 9.342 -7.680 1.00 11.03 H new ATOM 0 HA3 GLY A 230 3.929 9.982 -9.112 1.00 11.03 H new ATOM 869 N ARG A 231 1.609 8.508 -7.681 1.00 72.55 N ATOM 870 CA ARG A 231 0.409 8.479 -6.836 1.00 65.20 C ATOM 871 C ARG A 231 0.756 8.066 -5.401 1.00 4.23 C ATOM 872 O ARG A 231 1.827 7.507 -5.129 1.00 71.23 O ATOM 873 CB ARG A 231 -0.687 7.538 -7.408 1.00 64.41 C ATOM 874 CG ARG A 231 -1.465 8.114 -8.611 1.00 14.12 C ATOM 875 CD ARG A 231 -2.698 7.273 -8.955 1.00 31.21 C ATOM 876 NE ARG A 231 -3.524 7.884 -10.006 1.00 71.52 N ATOM 877 CZ ARG A 231 -4.854 7.741 -10.120 1.00 15.31 C ATOM 878 NH1 ARG A 231 -5.536 7.008 -9.247 1.00 53.43 N ATOM 879 NH2 ARG A 231 -5.487 8.315 -11.129 1.00 40.45 N ATOM 0 H ARG A 231 1.643 7.764 -8.378 1.00 72.55 H new ATOM 0 HA ARG A 231 0.008 9.493 -6.827 1.00 65.20 H new ATOM 0 HB2 ARG A 231 -0.221 6.600 -7.709 1.00 64.41 H new ATOM 0 HB3 ARG A 231 -1.395 7.302 -6.614 1.00 64.41 H new ATOM 0 HG2 ARG A 231 -1.774 9.135 -8.387 1.00 14.12 H new ATOM 0 HG3 ARG A 231 -0.807 8.163 -9.478 1.00 14.12 H new ATOM 0 HD2 ARG A 231 -2.379 6.282 -9.279 1.00 31.21 H new ATOM 0 HD3 ARG A 231 -3.301 7.136 -8.058 1.00 31.21 H new ATOM 0 HE ARG A 231 -3.051 8.461 -10.702 1.00 71.52 H new ATOM 0 HH11 ARG A 231 -5.049 6.546 -8.479 1.00 53.43 H new ATOM 0 HH12 ARG A 231 -6.546 6.907 -9.345 1.00 53.43 H new ATOM 0 HH21 ARG A 231 -4.965 8.862 -11.814 1.00 40.45 H new ATOM 0 HH22 ARG A 231 -6.497 8.211 -11.223 1.00 40.45 H new ATOM 893 N LYS A 232 -0.173 8.354 -4.494 1.00 61.14 N ATOM 894 CA LYS A 232 -0.015 8.101 -3.064 1.00 72.31 C ATOM 895 C LYS A 232 -1.134 7.173 -2.559 1.00 11.30 C ATOM 896 O LYS A 232 -2.281 7.238 -3.028 1.00 0.43 O ATOM 897 CB LYS A 232 -0.005 9.453 -2.305 1.00 41.11 C ATOM 898 CG LYS A 232 -1.089 10.462 -2.750 1.00 74.24 C ATOM 899 CD LYS A 232 -1.010 11.800 -1.981 1.00 43.02 C ATOM 900 CE LYS A 232 -1.997 12.843 -2.498 1.00 42.31 C ATOM 901 NZ LYS A 232 -1.750 13.193 -3.918 1.00 73.23 N ATOM 0 H LYS A 232 -1.070 8.776 -4.735 1.00 61.14 H new ATOM 0 HA LYS A 232 0.933 7.595 -2.880 1.00 72.31 H new ATOM 0 HB2 LYS A 232 -0.130 9.255 -1.240 1.00 41.11 H new ATOM 0 HB3 LYS A 232 0.974 9.916 -2.431 1.00 41.11 H new ATOM 0 HG2 LYS A 232 -0.984 10.655 -3.818 1.00 74.24 H new ATOM 0 HG3 LYS A 232 -2.074 10.020 -2.601 1.00 74.24 H new ATOM 0 HD2 LYS A 232 -1.203 11.617 -0.924 1.00 43.02 H new ATOM 0 HD3 LYS A 232 0.002 12.197 -2.056 1.00 43.02 H new ATOM 0 HE2 LYS A 232 -3.013 12.464 -2.391 1.00 42.31 H new ATOM 0 HE3 LYS A 232 -1.926 13.742 -1.886 1.00 42.31 H new ATOM 0 HZ1 LYS A 232 -2.301 14.039 -4.168 1.00 73.23 H new ATOM 0 HZ2 LYS A 232 -0.737 13.385 -4.057 1.00 73.23 H new ATOM 0 HZ3 LYS A 232 -2.038 12.400 -4.526 1.00 73.23 H new ATOM 915 N LEU A 233 -0.763 6.290 -1.617 1.00 50.22 N ATOM 916 CA LEU A 233 -1.684 5.387 -0.902 1.00 5.43 C ATOM 917 C LEU A 233 -1.497 5.602 0.605 1.00 74.24 C ATOM 918 O LEU A 233 -0.368 5.809 1.062 1.00 0.32 O ATOM 919 CB LEU A 233 -1.402 3.896 -1.255 1.00 53.11 C ATOM 920 CG LEU A 233 -1.545 3.494 -2.757 1.00 25.32 C ATOM 921 CD1 LEU A 233 -1.173 2.013 -2.963 1.00 42.35 C ATOM 922 CD2 LEU A 233 -2.961 3.789 -3.300 1.00 52.10 C ATOM 0 H LEU A 233 0.208 6.181 -1.324 1.00 50.22 H new ATOM 0 HA LEU A 233 -2.708 5.613 -1.201 1.00 5.43 H new ATOM 0 HB2 LEU A 233 -0.389 3.655 -0.933 1.00 53.11 H new ATOM 0 HB3 LEU A 233 -2.079 3.273 -0.670 1.00 53.11 H new ATOM 0 HG LEU A 233 -0.847 4.107 -3.327 1.00 25.32 H new ATOM 0 HD11 LEU A 233 -1.280 1.754 -4.016 1.00 42.35 H new ATOM 0 HD12 LEU A 233 -0.141 1.850 -2.652 1.00 42.35 H new ATOM 0 HD13 LEU A 233 -1.835 1.385 -2.366 1.00 42.35 H new ATOM 0 HD21 LEU A 233 -3.017 3.495 -4.348 1.00 52.10 H new ATOM 0 HD22 LEU A 233 -3.696 3.226 -2.725 1.00 52.10 H new ATOM 0 HD23 LEU A 233 -3.170 4.855 -3.211 1.00 52.10 H new ATOM 934 N ARG A 234 -2.594 5.544 1.365 1.00 20.23 N ATOM 935 CA ARG A 234 -2.578 5.741 2.827 1.00 53.42 C ATOM 936 C ARG A 234 -3.405 4.628 3.468 1.00 65.23 C ATOM 937 O ARG A 234 -4.579 4.438 3.130 1.00 72.11 O ATOM 938 CB ARG A 234 -3.139 7.143 3.167 1.00 31.50 C ATOM 939 CG ARG A 234 -3.003 7.587 4.631 1.00 34.54 C ATOM 940 CD ARG A 234 -3.569 8.995 4.868 1.00 0.31 C ATOM 941 NE ARG A 234 -3.254 9.516 6.207 1.00 44.44 N ATOM 942 CZ ARG A 234 -3.456 10.790 6.590 1.00 42.33 C ATOM 943 NH1 ARG A 234 -3.967 11.685 5.735 1.00 60.13 N ATOM 944 NH2 ARG A 234 -3.143 11.159 7.826 1.00 44.21 N ATOM 0 H ARG A 234 -3.523 5.359 0.988 1.00 20.23 H new ATOM 0 HA ARG A 234 -1.562 5.693 3.218 1.00 53.42 H new ATOM 0 HB2 ARG A 234 -2.635 7.876 2.538 1.00 31.50 H new ATOM 0 HB3 ARG A 234 -4.195 7.165 2.898 1.00 31.50 H new ATOM 0 HG2 ARG A 234 -3.522 6.876 5.274 1.00 34.54 H new ATOM 0 HG3 ARG A 234 -1.952 7.567 4.918 1.00 34.54 H new ATOM 0 HD2 ARG A 234 -3.169 9.674 4.115 1.00 0.31 H new ATOM 0 HD3 ARG A 234 -4.651 8.974 4.736 1.00 0.31 H new ATOM 0 HE ARG A 234 -2.857 8.870 6.889 1.00 44.44 H new ATOM 0 HH11 ARG A 234 -4.207 11.403 4.784 1.00 60.13 H new ATOM 0 HH12 ARG A 234 -4.117 12.649 6.034 1.00 60.13 H new ATOM 0 HH21 ARG A 234 -2.752 10.479 8.478 1.00 44.21 H new ATOM 0 HH22 ARG A 234 -3.293 12.123 8.124 1.00 44.21 H new ATOM 958 N LEU A 235 -2.781 3.899 4.388 1.00 63.51 N ATOM 959 CA LEU A 235 -3.290 2.628 4.896 1.00 32.03 C ATOM 960 C LEU A 235 -3.491 2.728 6.414 1.00 54.32 C ATOM 961 O LEU A 235 -2.616 2.359 7.199 1.00 72.22 O ATOM 962 CB LEU A 235 -2.281 1.509 4.483 1.00 54.11 C ATOM 963 CG LEU A 235 -2.109 1.294 2.936 1.00 15.01 C ATOM 964 CD1 LEU A 235 -0.798 0.569 2.598 1.00 20.32 C ATOM 965 CD2 LEU A 235 -3.304 0.528 2.342 1.00 43.31 C ATOM 0 H LEU A 235 -1.894 4.178 4.808 1.00 63.51 H new ATOM 0 HA LEU A 235 -4.263 2.381 4.471 1.00 32.03 H new ATOM 0 HB2 LEU A 235 -1.307 1.746 4.910 1.00 54.11 H new ATOM 0 HB3 LEU A 235 -2.605 0.569 4.930 1.00 54.11 H new ATOM 0 HG LEU A 235 -2.070 2.286 2.485 1.00 15.01 H new ATOM 0 HD11 LEU A 235 -0.721 0.442 1.518 1.00 20.32 H new ATOM 0 HD12 LEU A 235 0.046 1.159 2.955 1.00 20.32 H new ATOM 0 HD13 LEU A 235 -0.788 -0.408 3.080 1.00 20.32 H new ATOM 0 HD21 LEU A 235 -3.155 0.395 1.270 1.00 43.31 H new ATOM 0 HD22 LEU A 235 -3.385 -0.448 2.821 1.00 43.31 H new ATOM 0 HD23 LEU A 235 -4.220 1.093 2.514 1.00 43.31 H new ATOM 977 N LYS A 236 -4.655 3.267 6.812 1.00 62.40 N ATOM 978 CA LYS A 236 -5.040 3.439 8.223 1.00 23.40 C ATOM 979 C LYS A 236 -5.546 2.114 8.814 1.00 41.43 C ATOM 980 O LYS A 236 -6.290 1.379 8.149 1.00 51.41 O ATOM 981 CB LYS A 236 -6.139 4.523 8.355 1.00 2.00 C ATOM 982 CG LYS A 236 -5.680 5.926 7.931 1.00 41.03 C ATOM 983 CD LYS A 236 -6.733 7.011 8.231 1.00 13.14 C ATOM 984 CE LYS A 236 -6.187 8.430 8.010 1.00 12.43 C ATOM 985 NZ LYS A 236 -5.055 8.733 8.931 1.00 23.23 N ATOM 0 H LYS A 236 -5.363 3.599 6.157 1.00 62.40 H new ATOM 0 HA LYS A 236 -4.157 3.756 8.778 1.00 23.40 H new ATOM 0 HB2 LYS A 236 -6.997 4.233 7.749 1.00 2.00 H new ATOM 0 HB3 LYS A 236 -6.478 4.559 9.390 1.00 2.00 H new ATOM 0 HG2 LYS A 236 -4.753 6.172 8.448 1.00 41.03 H new ATOM 0 HG3 LYS A 236 -5.459 5.925 6.864 1.00 41.03 H new ATOM 0 HD2 LYS A 236 -7.603 6.856 7.594 1.00 13.14 H new ATOM 0 HD3 LYS A 236 -7.071 6.911 9.262 1.00 13.14 H new ATOM 0 HE2 LYS A 236 -5.855 8.536 6.977 1.00 12.43 H new ATOM 0 HE3 LYS A 236 -6.986 9.156 8.164 1.00 12.43 H new ATOM 0 HZ1 LYS A 236 -4.911 9.762 8.978 1.00 23.23 H new ATOM 0 HZ2 LYS A 236 -5.274 8.370 9.881 1.00 23.23 H new ATOM 0 HZ3 LYS A 236 -4.189 8.278 8.578 1.00 23.23 H new ATOM 999 N GLY A 237 -5.159 1.845 10.076 1.00 1.45 N ATOM 1000 CA GLY A 237 -5.498 0.587 10.746 1.00 45.02 C ATOM 1001 C GLY A 237 -4.745 -0.601 10.162 1.00 30.52 C ATOM 1002 O GLY A 237 -5.207 -1.738 10.242 1.00 34.41 O ATOM 0 H GLY A 237 -4.611 2.487 10.648 1.00 1.45 H new ATOM 0 HA2 GLY A 237 -5.271 0.671 11.809 1.00 45.02 H new ATOM 0 HA3 GLY A 237 -6.570 0.411 10.662 1.00 45.02 H new ATOM 1006 N LYS A 238 -3.560 -0.325 9.593 1.00 20.42 N ATOM 1007 CA LYS A 238 -2.765 -1.303 8.831 1.00 54.55 C ATOM 1008 C LYS A 238 -1.301 -1.363 9.334 1.00 53.14 C ATOM 1009 O LYS A 238 -0.789 -2.451 9.578 1.00 30.23 O ATOM 1010 CB LYS A 238 -2.778 -0.903 7.329 1.00 40.03 C ATOM 1011 CG LYS A 238 -4.162 -0.847 6.617 1.00 60.00 C ATOM 1012 CD LYS A 238 -4.632 -2.175 5.975 1.00 4.32 C ATOM 1013 CE LYS A 238 -5.155 -3.208 6.980 1.00 15.13 C ATOM 1014 NZ LYS A 238 -5.839 -4.338 6.297 1.00 24.53 N ATOM 0 H LYS A 238 -3.122 0.594 9.650 1.00 20.42 H new ATOM 0 HA LYS A 238 -3.208 -2.289 8.970 1.00 54.55 H new ATOM 0 HB2 LYS A 238 -2.311 0.078 7.237 1.00 40.03 H new ATOM 0 HB3 LYS A 238 -2.148 -1.608 6.787 1.00 40.03 H new ATOM 0 HG2 LYS A 238 -4.912 -0.528 7.341 1.00 60.00 H new ATOM 0 HG3 LYS A 238 -4.122 -0.082 5.841 1.00 60.00 H new ATOM 0 HD2 LYS A 238 -5.418 -1.958 5.252 1.00 4.32 H new ATOM 0 HD3 LYS A 238 -3.801 -2.612 5.421 1.00 4.32 H new ATOM 0 HE2 LYS A 238 -4.325 -3.590 7.575 1.00 15.13 H new ATOM 0 HE3 LYS A 238 -5.847 -2.727 7.671 1.00 15.13 H new ATOM 0 HZ1 LYS A 238 -6.165 -5.026 7.006 1.00 24.53 H new ATOM 0 HZ2 LYS A 238 -6.655 -3.978 5.763 1.00 24.53 H new ATOM 0 HZ3 LYS A 238 -5.176 -4.802 5.644 1.00 24.53 H new ATOM 1028 N GLY A 239 -0.671 -0.179 9.490 1.00 34.53 N ATOM 1029 CA GLY A 239 0.796 -0.033 9.634 1.00 41.40 C ATOM 1030 C GLY A 239 1.456 -0.843 10.777 1.00 21.31 C ATOM 1031 O GLY A 239 1.706 -2.045 10.637 1.00 53.54 O ATOM 0 H GLY A 239 -1.169 0.711 9.520 1.00 34.53 H new ATOM 0 HA2 GLY A 239 1.263 -0.325 8.693 1.00 41.40 H new ATOM 0 HA3 GLY A 239 1.022 1.022 9.788 1.00 41.40 H new ATOM 1035 N PHE A 240 1.786 -0.164 11.896 1.00 12.31 N ATOM 1036 CA PHE A 240 2.371 -0.814 13.096 1.00 52.12 C ATOM 1037 C PHE A 240 1.251 -1.400 13.984 1.00 32.42 C ATOM 1038 O PHE A 240 0.128 -0.902 13.957 1.00 43.54 O ATOM 1039 CB PHE A 240 3.232 0.197 13.939 1.00 44.54 C ATOM 1040 CG PHE A 240 4.742 -0.019 13.896 1.00 3.14 C ATOM 1041 CD1 PHE A 240 5.486 0.362 12.788 1.00 40.13 C ATOM 1042 CD2 PHE A 240 5.417 -0.605 14.973 1.00 11.30 C ATOM 1043 CE1 PHE A 240 6.851 0.164 12.752 1.00 12.53 C ATOM 1044 CE2 PHE A 240 6.782 -0.803 14.935 1.00 72.51 C ATOM 1045 CZ PHE A 240 7.501 -0.412 13.828 1.00 44.45 C ATOM 0 H PHE A 240 1.657 0.843 11.997 1.00 12.31 H new ATOM 0 HA PHE A 240 3.024 -1.615 12.750 1.00 52.12 H new ATOM 0 HB2 PHE A 240 3.018 1.207 13.589 1.00 44.54 H new ATOM 0 HB3 PHE A 240 2.906 0.144 14.978 1.00 44.54 H new ATOM 0 HD1 PHE A 240 4.991 0.819 11.944 1.00 40.13 H new ATOM 0 HD2 PHE A 240 4.860 -0.907 15.848 1.00 11.30 H new ATOM 0 HE1 PHE A 240 7.414 0.460 11.879 1.00 12.53 H new ATOM 0 HE2 PHE A 240 7.285 -1.264 15.772 1.00 72.51 H new ATOM 0 HZ PHE A 240 8.571 -0.555 13.800 1.00 44.45 H new ATOM 1055 N PRO A 241 1.549 -2.469 14.793 1.00 11.11 N ATOM 1056 CA PRO A 241 0.623 -3.005 15.840 1.00 21.20 C ATOM 1057 C PRO A 241 0.173 -1.951 16.887 1.00 65.31 C ATOM 1058 O PRO A 241 0.879 -0.968 17.143 1.00 33.03 O ATOM 1059 CB PRO A 241 1.464 -4.126 16.517 1.00 31.12 C ATOM 1060 CG PRO A 241 2.875 -3.819 16.129 1.00 33.13 C ATOM 1061 CD PRO A 241 2.791 -3.284 14.732 1.00 73.23 C ATOM 0 HA PRO A 241 -0.313 -3.346 15.398 1.00 21.20 H new ATOM 0 HB2 PRO A 241 1.339 -4.117 17.600 1.00 31.12 H new ATOM 0 HB3 PRO A 241 1.162 -5.114 16.169 1.00 31.12 H new ATOM 0 HG2 PRO A 241 3.319 -3.088 16.805 1.00 33.13 H new ATOM 0 HG3 PRO A 241 3.498 -4.712 16.172 1.00 33.13 H new ATOM 0 HD2 PRO A 241 3.662 -2.683 14.471 1.00 73.23 H new ATOM 0 HD3 PRO A 241 2.721 -4.081 13.992 1.00 73.23 H new ATOM 1069 N GLY A 242 -1.011 -2.197 17.484 1.00 42.42 N ATOM 1070 CA GLY A 242 -1.551 -1.369 18.562 1.00 3.51 C ATOM 1071 C GLY A 242 -2.708 -2.063 19.295 1.00 35.44 C ATOM 1072 O GLY A 242 -3.487 -2.778 18.648 1.00 62.14 O ATOM 0 H GLY A 242 -1.614 -2.978 17.226 1.00 42.42 H new ATOM 0 HA2 GLY A 242 -0.758 -1.137 19.273 1.00 3.51 H new ATOM 0 HA3 GLY A 242 -1.898 -0.421 18.152 1.00 3.51 H new ATOM 1076 N PRO A 243 -2.839 -1.890 20.660 1.00 50.44 N ATOM 1077 CA PRO A 243 -3.930 -2.514 21.466 1.00 15.14 C ATOM 1078 C PRO A 243 -5.335 -2.013 21.073 1.00 20.12 C ATOM 1079 O PRO A 243 -6.258 -2.813 20.941 1.00 32.40 O ATOM 1080 CB PRO A 243 -3.579 -2.114 22.928 1.00 13.11 C ATOM 1081 CG PRO A 243 -2.701 -0.905 22.800 1.00 4.30 C ATOM 1082 CD PRO A 243 -1.913 -1.120 21.530 1.00 63.12 C ATOM 0 HA PRO A 243 -3.979 -3.592 21.310 1.00 15.14 H new ATOM 0 HB2 PRO A 243 -4.478 -1.890 23.502 1.00 13.11 H new ATOM 0 HB3 PRO A 243 -3.064 -2.923 23.446 1.00 13.11 H new ATOM 0 HG2 PRO A 243 -3.294 0.008 22.746 1.00 4.30 H new ATOM 0 HG3 PRO A 243 -2.040 -0.805 23.661 1.00 4.30 H new ATOM 0 HD2 PRO A 243 -1.629 -0.173 21.071 1.00 63.12 H new ATOM 0 HD3 PRO A 243 -0.992 -1.671 21.720 1.00 63.12 H new ATOM 1090 N ALA A 244 -5.487 -0.685 20.899 1.00 64.53 N ATOM 1091 CA ALA A 244 -6.785 -0.067 20.531 1.00 43.21 C ATOM 1092 C ALA A 244 -7.048 -0.198 19.021 1.00 72.22 C ATOM 1093 O ALA A 244 -8.201 -0.201 18.580 1.00 11.10 O ATOM 1094 CB ALA A 244 -6.822 1.412 20.963 1.00 12.22 C ATOM 0 H ALA A 244 -4.726 -0.014 21.007 1.00 64.53 H new ATOM 0 HA ALA A 244 -7.576 -0.600 21.059 1.00 43.21 H new ATOM 0 HB1 ALA A 244 -7.781 1.848 20.685 1.00 12.22 H new ATOM 0 HB2 ALA A 244 -6.692 1.479 22.043 1.00 12.22 H new ATOM 0 HB3 ALA A 244 -6.018 1.956 20.467 1.00 12.22 H new ATOM 1100 N GLY A 245 -5.960 -0.300 18.253 1.00 61.43 N ATOM 1101 CA GLY A 245 -6.017 -0.428 16.798 1.00 13.22 C ATOM 1102 C GLY A 245 -4.653 -0.199 16.178 1.00 10.15 C ATOM 1103 O GLY A 245 -3.785 0.415 16.810 1.00 12.32 O ATOM 0 H GLY A 245 -5.011 -0.296 18.627 1.00 61.43 H new ATOM 0 HA2 GLY A 245 -6.380 -1.421 16.531 1.00 13.22 H new ATOM 0 HA3 GLY A 245 -6.729 0.291 16.394 1.00 13.22 H new ATOM 1107 N ARG A 246 -4.464 -0.680 14.936 1.00 24.43 N ATOM 1108 CA ARG A 246 -3.185 -0.542 14.219 1.00 41.24 C ATOM 1109 C ARG A 246 -3.041 0.876 13.630 1.00 0.25 C ATOM 1110 O ARG A 246 -4.033 1.599 13.476 1.00 13.20 O ATOM 1111 CB ARG A 246 -3.027 -1.657 13.124 1.00 60.44 C ATOM 1112 CG ARG A 246 -2.359 -2.954 13.656 1.00 61.23 C ATOM 1113 CD ARG A 246 -1.655 -3.795 12.577 1.00 54.25 C ATOM 1114 NE ARG A 246 -2.591 -4.498 11.683 1.00 2.34 N ATOM 1115 CZ ARG A 246 -2.234 -5.167 10.569 1.00 4.14 C ATOM 1116 NH1 ARG A 246 -0.960 -5.224 10.194 1.00 12.11 N ATOM 1117 NH2 ARG A 246 -3.158 -5.780 9.837 1.00 12.31 N ATOM 0 H ARG A 246 -5.185 -1.170 14.407 1.00 24.43 H new ATOM 0 HA ARG A 246 -2.373 -0.682 14.932 1.00 41.24 H new ATOM 0 HB2 ARG A 246 -4.010 -1.902 12.721 1.00 60.44 H new ATOM 0 HB3 ARG A 246 -2.433 -1.264 12.299 1.00 60.44 H new ATOM 0 HG2 ARG A 246 -1.632 -2.686 14.422 1.00 61.23 H new ATOM 0 HG3 ARG A 246 -3.119 -3.568 14.139 1.00 61.23 H new ATOM 0 HD2 ARG A 246 -1.013 -3.146 11.982 1.00 54.25 H new ATOM 0 HD3 ARG A 246 -1.008 -4.526 13.061 1.00 54.25 H new ATOM 0 HE ARG A 246 -3.582 -4.477 11.925 1.00 2.34 H new ATOM 0 HH11 ARG A 246 -0.243 -4.759 10.751 1.00 12.11 H new ATOM 0 HH12 ARG A 246 -0.699 -5.733 9.349 1.00 12.11 H new ATOM 0 HH21 ARG A 246 -4.138 -5.744 10.118 1.00 12.31 H new ATOM 0 HH22 ARG A 246 -2.888 -6.286 8.994 1.00 12.31 H new ATOM 1131 N GLY A 247 -1.791 1.255 13.315 1.00 53.41 N ATOM 1132 CA GLY A 247 -1.459 2.600 12.835 1.00 64.25 C ATOM 1133 C GLY A 247 -1.572 2.751 11.328 1.00 65.31 C ATOM 1134 O GLY A 247 -2.313 2.015 10.683 1.00 1.25 O ATOM 0 H GLY A 247 -0.985 0.635 13.387 1.00 53.41 H new ATOM 0 HA2 GLY A 247 -2.120 3.322 13.315 1.00 64.25 H new ATOM 0 HA3 GLY A 247 -0.442 2.846 13.142 1.00 64.25 H new ATOM 1138 N ASP A 248 -0.839 3.726 10.769 1.00 61.14 N ATOM 1139 CA ASP A 248 -0.910 4.067 9.335 1.00 72.51 C ATOM 1140 C ASP A 248 0.312 3.480 8.596 1.00 70.12 C ATOM 1141 O ASP A 248 1.346 3.209 9.203 1.00 10.23 O ATOM 1142 CB ASP A 248 -0.964 5.622 9.154 1.00 1.13 C ATOM 1143 CG ASP A 248 -1.699 6.102 7.874 1.00 50.13 C ATOM 1144 OD1 ASP A 248 -2.534 7.038 7.973 1.00 0.43 O ATOM 1145 OD2 ASP A 248 -1.446 5.568 6.767 1.00 71.43 O ATOM 0 H ASP A 248 -0.181 4.301 11.295 1.00 61.14 H new ATOM 0 HA ASP A 248 -1.817 3.637 8.910 1.00 72.51 H new ATOM 0 HB2 ASP A 248 -1.455 6.058 10.024 1.00 1.13 H new ATOM 0 HB3 ASP A 248 0.055 6.008 9.137 1.00 1.13 H new ATOM 1150 N LEU A 249 0.153 3.260 7.295 1.00 25.43 N ATOM 1151 CA LEU A 249 1.245 2.943 6.368 1.00 43.41 C ATOM 1152 C LEU A 249 1.029 3.757 5.096 1.00 44.42 C ATOM 1153 O LEU A 249 0.041 3.574 4.389 1.00 23.30 O ATOM 1154 CB LEU A 249 1.315 1.429 6.032 1.00 61.32 C ATOM 1155 CG LEU A 249 2.292 1.030 4.867 1.00 63.31 C ATOM 1156 CD1 LEU A 249 3.753 1.438 5.133 1.00 74.15 C ATOM 1157 CD2 LEU A 249 2.189 -0.465 4.553 1.00 21.03 C ATOM 0 H LEU A 249 -0.759 3.297 6.840 1.00 25.43 H new ATOM 0 HA LEU A 249 2.194 3.198 6.840 1.00 43.41 H new ATOM 0 HB2 LEU A 249 1.613 0.890 6.931 1.00 61.32 H new ATOM 0 HB3 LEU A 249 0.313 1.087 5.773 1.00 61.32 H new ATOM 0 HG LEU A 249 1.971 1.595 3.992 1.00 63.31 H new ATOM 0 HD11 LEU A 249 4.375 1.134 4.291 1.00 74.15 H new ATOM 0 HD12 LEU A 249 3.812 2.519 5.256 1.00 74.15 H new ATOM 0 HD13 LEU A 249 4.108 0.950 6.041 1.00 74.15 H new ATOM 0 HD21 LEU A 249 2.875 -0.715 3.744 1.00 21.03 H new ATOM 0 HD22 LEU A 249 2.449 -1.042 5.440 1.00 21.03 H new ATOM 0 HD23 LEU A 249 1.169 -0.704 4.251 1.00 21.03 H new ATOM 1169 N TYR A 250 1.949 4.656 4.818 1.00 62.34 N ATOM 1170 CA TYR A 250 1.877 5.515 3.652 1.00 13.34 C ATOM 1171 C TYR A 250 2.794 4.946 2.552 1.00 30.44 C ATOM 1172 O TYR A 250 4.019 4.995 2.681 1.00 42.33 O ATOM 1173 CB TYR A 250 2.283 6.949 4.072 1.00 45.40 C ATOM 1174 CG TYR A 250 1.881 8.019 3.066 1.00 2.12 C ATOM 1175 CD1 TYR A 250 0.528 8.303 2.850 1.00 21.12 C ATOM 1176 CD2 TYR A 250 2.826 8.745 2.343 1.00 5.45 C ATOM 1177 CE1 TYR A 250 0.134 9.273 1.957 1.00 10.11 C ATOM 1178 CE2 TYR A 250 2.438 9.715 1.444 1.00 3.21 C ATOM 1179 CZ TYR A 250 1.097 9.975 1.258 1.00 2.23 C ATOM 1180 OH TYR A 250 0.720 10.955 0.386 1.00 13.32 O ATOM 0 H TYR A 250 2.774 4.814 5.397 1.00 62.34 H new ATOM 0 HA TYR A 250 0.865 5.555 3.249 1.00 13.34 H new ATOM 0 HB2 TYR A 250 1.827 7.179 5.035 1.00 45.40 H new ATOM 0 HB3 TYR A 250 3.363 6.984 4.214 1.00 45.40 H new ATOM 0 HD1 TYR A 250 -0.222 7.750 3.395 1.00 21.12 H new ATOM 0 HD2 TYR A 250 3.877 8.545 2.489 1.00 5.45 H new ATOM 0 HE1 TYR A 250 -0.914 9.483 1.805 1.00 10.11 H new ATOM 0 HE2 TYR A 250 3.181 10.268 0.888 1.00 3.21 H new ATOM 0 HH TYR A 250 1.517 11.353 -0.024 1.00 13.32 H new ATOM 1190 N LEU A 251 2.182 4.380 1.491 1.00 15.21 N ATOM 1191 CA LEU A 251 2.909 3.785 0.347 1.00 55.54 C ATOM 1192 C LEU A 251 2.888 4.744 -0.852 1.00 34.41 C ATOM 1193 O LEU A 251 1.815 5.113 -1.327 1.00 1.12 O ATOM 1194 CB LEU A 251 2.284 2.411 -0.068 1.00 42.31 C ATOM 1195 CG LEU A 251 2.553 1.203 0.885 1.00 23.52 C ATOM 1196 CD1 LEU A 251 1.905 -0.091 0.341 1.00 53.21 C ATOM 1197 CD2 LEU A 251 4.062 0.994 1.120 1.00 44.42 C ATOM 0 H LEU A 251 1.168 4.322 1.402 1.00 15.21 H new ATOM 0 HA LEU A 251 3.940 3.615 0.658 1.00 55.54 H new ATOM 0 HB2 LEU A 251 1.205 2.541 -0.157 1.00 42.31 H new ATOM 0 HB3 LEU A 251 2.657 2.153 -1.059 1.00 42.31 H new ATOM 0 HG LEU A 251 2.093 1.439 1.845 1.00 23.52 H new ATOM 0 HD11 LEU A 251 2.109 -0.915 1.025 1.00 53.21 H new ATOM 0 HD12 LEU A 251 0.828 0.050 0.254 1.00 53.21 H new ATOM 0 HD13 LEU A 251 2.321 -0.322 -0.640 1.00 53.21 H new ATOM 0 HD21 LEU A 251 4.212 0.146 1.788 1.00 44.42 H new ATOM 0 HD22 LEU A 251 4.555 0.798 0.168 1.00 44.42 H new ATOM 0 HD23 LEU A 251 4.488 1.890 1.571 1.00 44.42 H new ATOM 1209 N GLU A 252 4.068 5.152 -1.334 1.00 64.32 N ATOM 1210 CA GLU A 252 4.187 5.968 -2.555 1.00 72.30 C ATOM 1211 C GLU A 252 4.351 5.041 -3.775 1.00 22.43 C ATOM 1212 O GLU A 252 5.343 4.312 -3.870 1.00 61.13 O ATOM 1213 CB GLU A 252 5.382 6.950 -2.434 1.00 52.51 C ATOM 1214 CG GLU A 252 5.268 7.933 -1.248 1.00 50.34 C ATOM 1215 CD GLU A 252 6.336 9.034 -1.269 1.00 74.12 C ATOM 1216 OE1 GLU A 252 6.207 9.986 -2.073 1.00 34.45 O ATOM 1217 OE2 GLU A 252 7.315 8.956 -0.492 1.00 52.13 O ATOM 0 H GLU A 252 4.962 4.930 -0.895 1.00 64.32 H new ATOM 0 HA GLU A 252 3.282 6.562 -2.686 1.00 72.30 H new ATOM 0 HB2 GLU A 252 6.302 6.375 -2.330 1.00 52.51 H new ATOM 0 HB3 GLU A 252 5.466 7.520 -3.359 1.00 52.51 H new ATOM 0 HG2 GLU A 252 4.280 8.394 -1.261 1.00 50.34 H new ATOM 0 HG3 GLU A 252 5.348 7.376 -0.314 1.00 50.34 H new ATOM 1224 N VAL A 253 3.358 5.073 -4.678 1.00 22.31 N ATOM 1225 CA VAL A 253 3.292 4.219 -5.879 1.00 52.31 C ATOM 1226 C VAL A 253 4.474 4.487 -6.838 1.00 5.31 C ATOM 1227 O VAL A 253 4.735 5.636 -7.205 1.00 22.33 O ATOM 1228 CB VAL A 253 1.933 4.440 -6.651 1.00 23.33 C ATOM 1229 CG1 VAL A 253 1.867 3.601 -7.952 1.00 14.51 C ATOM 1230 CG2 VAL A 253 0.733 4.137 -5.725 1.00 4.44 C ATOM 0 H VAL A 253 2.562 5.705 -4.594 1.00 22.31 H new ATOM 0 HA VAL A 253 3.352 3.186 -5.537 1.00 52.31 H new ATOM 0 HB VAL A 253 1.883 5.488 -6.948 1.00 23.33 H new ATOM 0 HG11 VAL A 253 0.916 3.782 -8.454 1.00 14.51 H new ATOM 0 HG12 VAL A 253 2.686 3.888 -8.612 1.00 14.51 H new ATOM 0 HG13 VAL A 253 1.953 2.542 -7.707 1.00 14.51 H new ATOM 0 HG21 VAL A 253 -0.197 4.294 -6.271 1.00 4.44 H new ATOM 0 HG22 VAL A 253 0.786 3.102 -5.388 1.00 4.44 H new ATOM 0 HG23 VAL A 253 0.763 4.801 -4.861 1.00 4.44 H new ATOM 1240 N ARG A 254 5.172 3.402 -7.221 1.00 2.40 N ATOM 1241 CA ARG A 254 6.229 3.404 -8.244 1.00 53.35 C ATOM 1242 C ARG A 254 5.950 2.251 -9.213 1.00 31.23 C ATOM 1243 O ARG A 254 5.956 1.082 -8.812 1.00 75.54 O ATOM 1244 CB ARG A 254 7.645 3.228 -7.623 1.00 31.21 C ATOM 1245 CG ARG A 254 8.115 4.376 -6.714 1.00 14.03 C ATOM 1246 CD ARG A 254 8.137 5.751 -7.401 1.00 24.40 C ATOM 1247 NE ARG A 254 9.037 5.768 -8.572 1.00 41.23 N ATOM 1248 CZ ARG A 254 9.659 6.849 -9.072 1.00 42.33 C ATOM 1249 NH1 ARG A 254 9.502 8.052 -8.523 1.00 22.21 N ATOM 1250 NH2 ARG A 254 10.446 6.713 -10.132 1.00 75.41 N ATOM 0 H ARG A 254 5.011 2.479 -6.817 1.00 2.40 H new ATOM 0 HA ARG A 254 6.219 4.366 -8.756 1.00 53.35 H new ATOM 0 HB2 ARG A 254 7.658 2.303 -7.047 1.00 31.21 H new ATOM 0 HB3 ARG A 254 8.366 3.110 -8.432 1.00 31.21 H new ATOM 0 HG2 ARG A 254 7.461 4.427 -5.844 1.00 14.03 H new ATOM 0 HG3 ARG A 254 9.116 4.149 -6.348 1.00 14.03 H new ATOM 0 HD2 ARG A 254 7.127 6.016 -7.715 1.00 24.40 H new ATOM 0 HD3 ARG A 254 8.457 6.509 -6.686 1.00 24.40 H new ATOM 0 HE ARG A 254 9.201 4.879 -9.044 1.00 41.23 H new ATOM 0 HH11 ARG A 254 8.900 8.166 -7.707 1.00 22.21 H new ATOM 0 HH12 ARG A 254 9.983 8.860 -8.918 1.00 22.21 H new ATOM 0 HH21 ARG A 254 10.573 5.795 -10.558 1.00 75.41 H new ATOM 0 HH22 ARG A 254 10.923 7.526 -10.520 1.00 75.41 H new ATOM 1264 N ILE A 255 5.682 2.602 -10.473 1.00 21.12 N ATOM 1265 CA ILE A 255 5.465 1.633 -11.550 1.00 4.23 C ATOM 1266 C ILE A 255 6.815 1.070 -12.018 1.00 35.11 C ATOM 1267 O ILE A 255 7.718 1.839 -12.345 1.00 34.22 O ATOM 1268 CB ILE A 255 4.688 2.283 -12.766 1.00 60.54 C ATOM 1269 CG1 ILE A 255 3.198 2.541 -12.380 1.00 12.31 C ATOM 1270 CG2 ILE A 255 4.799 1.435 -14.061 1.00 75.23 C ATOM 1271 CD1 ILE A 255 2.351 3.118 -13.499 1.00 52.04 C ATOM 0 H ILE A 255 5.609 3.573 -10.777 1.00 21.12 H new ATOM 0 HA ILE A 255 4.849 0.822 -11.162 1.00 4.23 H new ATOM 0 HB ILE A 255 5.162 3.240 -12.985 1.00 60.54 H new ATOM 0 HG12 ILE A 255 2.753 1.602 -12.051 1.00 12.31 H new ATOM 0 HG13 ILE A 255 3.168 3.223 -11.530 1.00 12.31 H new ATOM 0 HG21 ILE A 255 4.249 1.924 -14.865 1.00 75.23 H new ATOM 0 HG22 ILE A 255 5.847 1.339 -14.345 1.00 75.23 H new ATOM 0 HG23 ILE A 255 4.379 0.445 -13.885 1.00 75.23 H new ATOM 0 HD11 ILE A 255 1.331 3.265 -13.144 1.00 52.04 H new ATOM 0 HD12 ILE A 255 2.767 4.075 -13.814 1.00 52.04 H new ATOM 0 HD13 ILE A 255 2.345 2.429 -14.343 1.00 52.04 H new ATOM 1283 N THR A 256 6.943 -0.263 -12.034 1.00 72.13 N ATOM 1284 CA THR A 256 8.109 -0.957 -12.590 1.00 72.31 C ATOM 1285 C THR A 256 7.770 -1.396 -14.038 1.00 1.32 C ATOM 1286 O THR A 256 6.952 -2.329 -14.219 1.00 14.14 O ATOM 1287 CB THR A 256 8.521 -2.186 -11.689 1.00 14.40 C ATOM 1288 OG1 THR A 256 7.381 -3.017 -11.416 1.00 12.12 O ATOM 1289 CG2 THR A 256 9.131 -1.737 -10.355 1.00 2.32 C ATOM 1290 OXT THR A 256 8.288 -0.776 -14.986 1.00 36.54 O ATOM 0 H THR A 256 6.235 -0.894 -11.659 1.00 72.13 H new ATOM 0 HA THR A 256 8.968 -0.286 -12.608 1.00 72.31 H new ATOM 0 HB THR A 256 9.270 -2.748 -12.247 1.00 14.40 H new ATOM 0 HG1 THR A 256 7.655 -3.775 -10.858 1.00 12.12 H new ATOM 0 HG21 THR A 256 9.401 -2.613 -9.765 1.00 2.32 H new ATOM 0 HG22 THR A 256 10.022 -1.139 -10.545 1.00 2.32 H new ATOM 0 HG23 THR A 256 8.404 -1.139 -9.805 1.00 2.32 H new