USER MOD reduce.3.24.130724 H: found=0, std=0, add=513, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 514 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 NoAdj-H: A 382 HIS HE2 : A 382 HIS NE2 : A 402 ZNZN :(H bumps) USER MOD Set 1.1: A 364 ASN : amide:sc= 1.47 K(o=2.4,f=-3!) USER MOD Set 1.2: A 366 ASN : amide:sc= 0.886 K(o=2.4,f=0.69) USER MOD Single : A 324 SER OG : rot 180:sc= 0 USER MOD Single : A 325 LYS NZ :NH3+ -170:sc=-0.00249 (180deg=-0.19) USER MOD Single : A 326 LYS NZ :NH3+ 167:sc= -0.0116 (180deg=-0.166) USER MOD Single : A 327 CYS SG : rot -8:sc= 0.00609 USER MOD Single : A 331 SER OG : rot 180:sc= 0 USER MOD Single : A 333 THR OG1 : rot -156:sc= 1.27 USER MOD Single : A 334 SER OG : rot 86:sc= 1.2 USER MOD Single : A 335 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 340 ASN : amide:sc= 1.23 K(o=1.2,f=-0.026) USER MOD Single : A 341 THR OG1 : rot -130:sc= -0.928 USER MOD Single : A 342 LYS NZ :NH3+ -172:sc= 1.19 (180deg=1.04) USER MOD Single : A 346 LYS NZ :NH3+ -129:sc= -0.616 (180deg=-1.95!) USER MOD Single : A 348 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 350 THR OG1 : rot 180:sc= 0 USER MOD Single : A 353 LYS NZ :NH3+ -163:sc= -0.307 (180deg=-1.07) USER MOD Single : A 357 SER OG : rot 180:sc= 0 USER MOD Single : A 358 ASN : amide:sc= 0.0263 K(o=0.026,f=-5.6!) USER MOD Single : A 359 HIS : no HD1:sc= 0.729 K(o=0.73,f=-3.1!) USER MOD Single : A 360 MET CE :methyl -131:sc= -1.65 (180deg=-6.34!) USER MOD Single : A 365 GLN : amide:sc= -3.17! K(o=-3.2!,f=-0.54) USER MOD Single : A 368 LYS NZ :NH3+ -131:sc= -0.688 (180deg=-1.9!) USER MOD Single : A 384 SER OG : rot 180:sc= 0 USER MOD Single : A 387 TYR OH : rot 180:sc= 0 USER MOD Single : A 388 ASN : amide:sc=-0.00774 X(o=-0.0077,f=0) USER MOD Single : A 390 ASN : amide:sc= 0.825 K(o=0.83,f=0) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 393 ASN : amide:sc= 0 X(o=0,f=-0.035) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 323 0.828 13.472 -9.305 1.00 0.00 N ATOM 2 CA GLY A 323 0.924 12.136 -8.684 1.00 0.00 C ATOM 3 C GLY A 323 2.262 11.923 -8.023 1.00 0.00 C ATOM 4 O GLY A 323 3.024 12.873 -7.840 1.00 0.00 O ATOM 0 HA2 GLY A 323 0.131 12.020 -7.945 1.00 0.00 H new ATOM 0 HA3 GLY A 323 0.767 11.370 -9.443 1.00 0.00 H new ATOM 10 N SER A 324 2.553 10.687 -7.662 1.00 0.00 N ATOM 11 CA SER A 324 3.815 10.349 -7.033 1.00 0.00 C ATOM 12 C SER A 324 4.893 10.157 -8.093 1.00 0.00 C ATOM 13 O SER A 324 4.618 9.644 -9.175 1.00 0.00 O ATOM 14 CB SER A 324 3.658 9.074 -6.212 1.00 0.00 C ATOM 15 OG SER A 324 2.623 9.213 -5.249 1.00 0.00 O ATOM 0 H SER A 324 1.925 9.894 -7.796 1.00 0.00 H new ATOM 0 HA SER A 324 4.112 11.164 -6.373 1.00 0.00 H new ATOM 0 HB2 SER A 324 3.434 8.237 -6.873 1.00 0.00 H new ATOM 0 HB3 SER A 324 4.598 8.842 -5.710 1.00 0.00 H new ATOM 0 HG SER A 324 2.540 8.382 -4.736 1.00 0.00 H new ATOM 21 N LYS A 325 6.120 10.547 -7.779 1.00 0.00 N ATOM 22 CA LYS A 325 7.220 10.439 -8.734 1.00 0.00 C ATOM 23 C LYS A 325 7.723 9.012 -8.886 1.00 0.00 C ATOM 24 O LYS A 325 8.648 8.754 -9.649 1.00 0.00 O ATOM 25 CB LYS A 325 8.363 11.383 -8.376 1.00 0.00 C ATOM 26 CG LYS A 325 8.265 12.734 -9.067 1.00 0.00 C ATOM 27 CD LYS A 325 6.985 13.472 -8.701 1.00 0.00 C ATOM 28 CE LYS A 325 6.818 14.731 -9.532 1.00 0.00 C ATOM 29 NZ LYS A 325 7.993 15.630 -9.422 1.00 0.00 N1+ ATOM 0 H LYS A 325 6.381 10.940 -6.875 1.00 0.00 H new ATOM 0 HA LYS A 325 6.819 10.740 -9.702 1.00 0.00 H new ATOM 0 HB2 LYS A 325 8.375 11.535 -7.297 1.00 0.00 H new ATOM 0 HB3 LYS A 325 9.310 10.914 -8.643 1.00 0.00 H new ATOM 0 HG2 LYS A 325 9.126 13.344 -8.793 1.00 0.00 H new ATOM 0 HG3 LYS A 325 8.305 12.592 -10.147 1.00 0.00 H new ATOM 0 HD2 LYS A 325 6.128 12.816 -8.854 1.00 0.00 H new ATOM 0 HD3 LYS A 325 7.002 13.732 -7.643 1.00 0.00 H new ATOM 0 HE2 LYS A 325 6.667 14.458 -10.576 1.00 0.00 H new ATOM 0 HE3 LYS A 325 5.923 15.263 -9.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 325 7.772 16.546 -9.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 325 8.226 15.775 -8.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 325 8.806 15.200 -9.907 1.00 0.00 H new ATOM 43 N LYS A 326 7.124 8.088 -8.152 1.00 0.00 N ATOM 44 CA LYS A 326 7.460 6.680 -8.300 1.00 0.00 C ATOM 45 C LYS A 326 6.975 6.212 -9.660 1.00 0.00 C ATOM 46 O LYS A 326 7.647 5.453 -10.356 1.00 0.00 O ATOM 47 CB LYS A 326 6.798 5.843 -7.204 1.00 0.00 C ATOM 48 CG LYS A 326 7.101 6.318 -5.794 1.00 0.00 C ATOM 49 CD LYS A 326 6.490 5.394 -4.760 1.00 0.00 C ATOM 50 CE LYS A 326 6.702 5.916 -3.346 1.00 0.00 C ATOM 51 NZ LYS A 326 5.961 7.183 -3.102 1.00 0.00 N1+ ATOM 0 H LYS A 326 6.408 8.285 -7.453 1.00 0.00 H new ATOM 0 HA LYS A 326 8.540 6.557 -8.215 1.00 0.00 H new ATOM 0 HB2 LYS A 326 5.719 5.854 -7.356 1.00 0.00 H new ATOM 0 HB3 LYS A 326 7.124 4.808 -7.305 1.00 0.00 H new ATOM 0 HG2 LYS A 326 8.180 6.368 -5.648 1.00 0.00 H new ATOM 0 HG3 LYS A 326 6.714 7.328 -5.657 1.00 0.00 H new ATOM 0 HD2 LYS A 326 5.422 5.287 -4.953 1.00 0.00 H new ATOM 0 HD3 LYS A 326 6.932 4.402 -4.852 1.00 0.00 H new ATOM 0 HE2 LYS A 326 6.377 5.162 -2.629 1.00 0.00 H new ATOM 0 HE3 LYS A 326 7.766 6.080 -3.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 326 5.949 7.387 -2.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 326 6.430 7.962 -3.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 326 4.985 7.086 -3.447 1.00 0.00 H new ATOM 65 N CYS A 327 5.799 6.692 -10.021 1.00 0.00 N ATOM 66 CA CYS A 327 5.175 6.404 -11.289 1.00 0.00 C ATOM 67 C CYS A 327 4.317 7.598 -11.675 1.00 0.00 C ATOM 68 O CYS A 327 3.232 7.783 -11.128 1.00 0.00 O ATOM 69 CB CYS A 327 4.293 5.150 -11.181 1.00 0.00 C ATOM 70 SG CYS A 327 5.146 3.674 -10.570 1.00 0.00 S ATOM 0 H CYS A 327 5.243 7.305 -9.425 1.00 0.00 H new ATOM 0 HA CYS A 327 5.940 6.220 -12.043 1.00 0.00 H new ATOM 0 HB2 CYS A 327 3.455 5.368 -10.520 1.00 0.00 H new ATOM 0 HB3 CYS A 327 3.875 4.931 -12.164 1.00 0.00 H new ATOM 0 HG CYS A 327 6.422 3.910 -10.494 1.00 0.00 H new ATOM 76 N ASP A 328 4.811 8.425 -12.580 1.00 0.00 N ATOM 77 CA ASP A 328 4.087 9.620 -12.981 1.00 0.00 C ATOM 78 C ASP A 328 2.942 9.275 -13.925 1.00 0.00 C ATOM 79 O ASP A 328 3.072 9.284 -15.150 1.00 0.00 O ATOM 80 CB ASP A 328 5.029 10.700 -13.572 1.00 0.00 C ATOM 81 CG ASP A 328 5.708 10.295 -14.867 1.00 0.00 C ATOM 82 OD1 ASP A 328 6.525 9.353 -14.856 1.00 0.00 O1- ATOM 83 OD2 ASP A 328 5.426 10.928 -15.910 1.00 0.00 O ATOM 0 H ASP A 328 5.707 8.293 -13.050 1.00 0.00 H new ATOM 0 HA ASP A 328 3.648 10.056 -12.083 1.00 0.00 H new ATOM 0 HB2 ASP A 328 4.455 11.610 -13.745 1.00 0.00 H new ATOM 0 HB3 ASP A 328 5.794 10.941 -12.834 1.00 0.00 H new ATOM 88 N ASP A 329 1.839 8.916 -13.330 1.00 0.00 N ATOM 89 CA ASP A 329 0.639 8.550 -14.058 1.00 0.00 C ATOM 90 C ASP A 329 -0.281 9.756 -14.237 1.00 0.00 C ATOM 91 O ASP A 329 0.148 10.910 -14.102 1.00 0.00 O ATOM 92 CB ASP A 329 -0.101 7.410 -13.330 1.00 0.00 C ATOM 93 CG ASP A 329 -0.668 7.814 -11.978 1.00 0.00 C ATOM 94 OD1 ASP A 329 -0.016 8.598 -11.261 1.00 0.00 O1- ATOM 95 OD2 ASP A 329 -1.764 7.339 -11.631 1.00 0.00 O ATOM 0 H ASP A 329 1.739 8.866 -12.316 1.00 0.00 H new ATOM 0 HA ASP A 329 0.933 8.201 -15.048 1.00 0.00 H new ATOM 0 HB2 ASP A 329 -0.914 7.054 -13.963 1.00 0.00 H new ATOM 0 HB3 ASP A 329 0.585 6.574 -13.191 1.00 0.00 H new ATOM 100 N ASP A 330 -1.530 9.491 -14.551 1.00 0.00 N ATOM 101 CA ASP A 330 -2.506 10.542 -14.784 1.00 0.00 C ATOM 102 C ASP A 330 -3.352 10.750 -13.525 1.00 0.00 C ATOM 103 O ASP A 330 -3.126 10.105 -12.510 1.00 0.00 O ATOM 104 CB ASP A 330 -3.404 10.144 -15.964 1.00 0.00 C ATOM 105 CG ASP A 330 -4.070 11.324 -16.644 1.00 0.00 C ATOM 106 OD1 ASP A 330 -5.012 11.891 -16.073 1.00 0.00 O ATOM 107 OD2 ASP A 330 -3.656 11.673 -17.764 1.00 0.00 O1- ATOM 0 H ASP A 330 -1.900 8.546 -14.653 1.00 0.00 H new ATOM 0 HA ASP A 330 -1.993 11.474 -15.020 1.00 0.00 H new ATOM 0 HB2 ASP A 330 -2.807 9.602 -16.697 1.00 0.00 H new ATOM 0 HB3 ASP A 330 -4.173 9.458 -15.609 1.00 0.00 H new ATOM 112 N SER A 331 -4.308 11.648 -13.593 1.00 0.00 N ATOM 113 CA SER A 331 -5.205 11.893 -12.486 1.00 0.00 C ATOM 114 C SER A 331 -6.500 11.117 -12.707 1.00 0.00 C ATOM 115 O SER A 331 -7.321 10.970 -11.798 1.00 0.00 O ATOM 116 CB SER A 331 -5.482 13.388 -12.349 1.00 0.00 C ATOM 117 OG SER A 331 -4.280 14.107 -12.117 1.00 0.00 O ATOM 0 H SER A 331 -4.486 12.227 -14.414 1.00 0.00 H new ATOM 0 HA SER A 331 -4.742 11.553 -11.559 1.00 0.00 H new ATOM 0 HB2 SER A 331 -5.962 13.757 -13.255 1.00 0.00 H new ATOM 0 HB3 SER A 331 -6.177 13.559 -11.527 1.00 0.00 H new ATOM 0 HG SER A 331 -4.481 15.063 -12.034 1.00 0.00 H new ATOM 123 N GLU A 332 -6.662 10.604 -13.926 1.00 0.00 N ATOM 124 CA GLU A 332 -7.826 9.798 -14.293 1.00 0.00 C ATOM 125 C GLU A 332 -7.764 8.416 -13.634 1.00 0.00 C ATOM 126 O GLU A 332 -8.681 7.608 -13.764 1.00 0.00 O ATOM 127 CB GLU A 332 -7.906 9.644 -15.813 1.00 0.00 C ATOM 128 CG GLU A 332 -8.120 10.950 -16.559 1.00 0.00 C ATOM 129 CD GLU A 332 -9.403 11.639 -16.155 1.00 0.00 C ATOM 130 OE1 GLU A 332 -10.480 11.058 -16.366 1.00 0.00 O ATOM 131 OE2 GLU A 332 -9.342 12.763 -15.621 1.00 0.00 O1- ATOM 0 H GLU A 332 -5.993 10.735 -14.685 1.00 0.00 H new ATOM 0 HA GLU A 332 -8.719 10.312 -13.937 1.00 0.00 H new ATOM 0 HB2 GLU A 332 -6.986 9.181 -16.169 1.00 0.00 H new ATOM 0 HB3 GLU A 332 -8.721 8.962 -16.056 1.00 0.00 H new ATOM 0 HG2 GLU A 332 -7.278 11.616 -16.370 1.00 0.00 H new ATOM 0 HG3 GLU A 332 -8.137 10.755 -17.631 1.00 0.00 H new ATOM 138 N THR A 333 -6.679 8.160 -12.925 1.00 0.00 N ATOM 139 CA THR A 333 -6.477 6.908 -12.245 1.00 0.00 C ATOM 140 C THR A 333 -7.151 6.915 -10.872 1.00 0.00 C ATOM 141 O THR A 333 -7.111 5.923 -10.146 1.00 0.00 O ATOM 142 CB THR A 333 -4.982 6.641 -12.079 1.00 0.00 C ATOM 143 OG1 THR A 333 -4.352 7.810 -11.550 1.00 0.00 O ATOM 144 CG2 THR A 333 -4.350 6.281 -13.415 1.00 0.00 C ATOM 0 H THR A 333 -5.913 8.823 -12.809 1.00 0.00 H new ATOM 0 HA THR A 333 -6.926 6.118 -12.847 1.00 0.00 H new ATOM 0 HB THR A 333 -4.846 5.803 -11.395 1.00 0.00 H new ATOM 0 HG1 THR A 333 -3.401 7.803 -11.785 1.00 0.00 H new ATOM 0 HG21 THR A 333 -3.285 6.095 -13.275 1.00 0.00 H new ATOM 0 HG22 THR A 333 -4.826 5.385 -13.813 1.00 0.00 H new ATOM 0 HG23 THR A 333 -4.485 7.105 -14.115 1.00 0.00 H new ATOM 152 N SER A 334 -7.799 8.026 -10.540 1.00 0.00 N ATOM 153 CA SER A 334 -8.471 8.186 -9.251 1.00 0.00 C ATOM 154 C SER A 334 -9.799 7.433 -9.208 1.00 0.00 C ATOM 155 O SER A 334 -10.755 7.869 -8.565 1.00 0.00 O ATOM 156 CB SER A 334 -8.706 9.665 -8.972 1.00 0.00 C ATOM 157 OG SER A 334 -7.503 10.407 -9.105 1.00 0.00 O ATOM 0 H SER A 334 -7.875 8.839 -11.152 1.00 0.00 H new ATOM 0 HA SER A 334 -7.824 7.763 -8.482 1.00 0.00 H new ATOM 0 HB2 SER A 334 -9.455 10.054 -9.662 1.00 0.00 H new ATOM 0 HB3 SER A 334 -9.105 9.790 -7.965 1.00 0.00 H new ATOM 0 HG SER A 334 -7.376 10.658 -10.044 1.00 0.00 H new ATOM 163 N ASN A 335 -9.837 6.281 -9.845 1.00 0.00 N ATOM 164 CA ASN A 335 -11.042 5.481 -9.889 1.00 0.00 C ATOM 165 C ASN A 335 -11.244 4.756 -8.564 1.00 0.00 C ATOM 166 O ASN A 335 -12.334 4.279 -8.265 1.00 0.00 O ATOM 167 CB ASN A 335 -10.988 4.465 -11.040 1.00 0.00 C ATOM 168 CG ASN A 335 -10.002 3.330 -10.786 1.00 0.00 C ATOM 169 OD1 ASN A 335 -10.353 2.311 -10.193 1.00 0.00 O ATOM 170 ND2 ASN A 335 -8.771 3.491 -11.243 1.00 0.00 N ATOM 0 H ASN A 335 -9.043 5.877 -10.341 1.00 0.00 H new ATOM 0 HA ASN A 335 -11.885 6.151 -10.062 1.00 0.00 H new ATOM 0 HB2 ASN A 335 -11.983 4.047 -11.196 1.00 0.00 H new ATOM 0 HB3 ASN A 335 -10.711 4.980 -11.960 1.00 0.00 H new ATOM 0 HD21 ASN A 335 -8.077 2.756 -11.108 1.00 0.00 H new ATOM 0 HD22 ASN A 335 -8.516 4.350 -11.730 1.00 0.00 H new ATOM 177 N TRP A 336 -10.188 4.684 -7.773 1.00 0.00 N ATOM 178 CA TRP A 336 -10.252 4.002 -6.491 1.00 0.00 C ATOM 179 C TRP A 336 -10.305 5.012 -5.356 1.00 0.00 C ATOM 180 O TRP A 336 -10.973 4.791 -4.345 1.00 0.00 O ATOM 181 CB TRP A 336 -9.065 3.040 -6.317 1.00 0.00 C ATOM 182 CG TRP A 336 -7.713 3.694 -6.418 1.00 0.00 C ATOM 183 CD1 TRP A 336 -7.058 4.056 -7.559 1.00 0.00 C ATOM 184 CD2 TRP A 336 -6.845 4.044 -5.330 1.00 0.00 C ATOM 185 NE1 TRP A 336 -5.849 4.622 -7.250 1.00 0.00 N ATOM 186 CE2 TRP A 336 -5.691 4.623 -5.889 1.00 0.00 C ATOM 187 CE3 TRP A 336 -6.935 3.928 -3.942 1.00 0.00 C ATOM 188 CZ2 TRP A 336 -4.637 5.085 -5.106 1.00 0.00 C ATOM 189 CZ3 TRP A 336 -5.887 4.384 -3.167 1.00 0.00 C ATOM 190 CH2 TRP A 336 -4.751 4.957 -3.750 1.00 0.00 C ATOM 0 H TRP A 336 -9.278 5.088 -7.994 1.00 0.00 H new ATOM 0 HA TRP A 336 -11.165 3.408 -6.465 1.00 0.00 H new ATOM 0 HB2 TRP A 336 -9.148 2.553 -5.345 1.00 0.00 H new ATOM 0 HB3 TRP A 336 -9.134 2.258 -7.073 1.00 0.00 H new ATOM 0 HD1 TRP A 336 -7.437 3.917 -8.560 1.00 0.00 H new ATOM 0 HE1 TRP A 336 -5.175 4.984 -7.925 1.00 0.00 H new ATOM 0 HE3 TRP A 336 -7.808 3.490 -3.482 1.00 0.00 H new ATOM 0 HZ2 TRP A 336 -3.760 5.529 -5.554 1.00 0.00 H new ATOM 0 HZ3 TRP A 336 -5.945 4.297 -2.092 1.00 0.00 H new ATOM 0 HH2 TRP A 336 -3.949 5.305 -3.116 1.00 0.00 H new ATOM 201 N ILE A 337 -9.618 6.128 -5.549 1.00 0.00 N ATOM 202 CA ILE A 337 -9.569 7.212 -4.573 1.00 0.00 C ATOM 203 C ILE A 337 -10.973 7.676 -4.207 1.00 0.00 C ATOM 204 O ILE A 337 -11.230 8.066 -3.073 1.00 0.00 O ATOM 205 CB ILE A 337 -8.750 8.399 -5.138 1.00 0.00 C ATOM 206 CG1 ILE A 337 -7.283 7.987 -5.283 1.00 0.00 C ATOM 207 CG2 ILE A 337 -8.885 9.644 -4.259 1.00 0.00 C ATOM 208 CD1 ILE A 337 -6.452 8.945 -6.101 1.00 0.00 C ATOM 0 H ILE A 337 -9.074 6.310 -6.392 1.00 0.00 H new ATOM 0 HA ILE A 337 -9.084 6.839 -3.671 1.00 0.00 H new ATOM 0 HB ILE A 337 -9.147 8.657 -6.120 1.00 0.00 H new ATOM 0 HG12 ILE A 337 -6.842 7.897 -4.290 1.00 0.00 H new ATOM 0 HG13 ILE A 337 -7.238 7.000 -5.743 1.00 0.00 H new ATOM 0 HG21 ILE A 337 -8.297 10.456 -4.686 1.00 0.00 H new ATOM 0 HG22 ILE A 337 -9.932 9.942 -4.208 1.00 0.00 H new ATOM 0 HG23 ILE A 337 -8.522 9.422 -3.256 1.00 0.00 H new ATOM 0 HD11 ILE A 337 -5.426 8.581 -6.156 1.00 0.00 H new ATOM 0 HD12 ILE A 337 -6.865 9.018 -7.107 1.00 0.00 H new ATOM 0 HD13 ILE A 337 -6.464 9.929 -5.632 1.00 0.00 H new ATOM 220 N ALA A 338 -11.880 7.570 -5.171 1.00 0.00 N ATOM 221 CA ALA A 338 -13.274 7.986 -5.015 1.00 0.00 C ATOM 222 C ALA A 338 -13.908 7.486 -3.708 1.00 0.00 C ATOM 223 O ALA A 338 -14.745 8.175 -3.119 1.00 0.00 O ATOM 224 CB ALA A 338 -14.089 7.512 -6.208 1.00 0.00 C ATOM 0 H ALA A 338 -11.669 7.189 -6.093 1.00 0.00 H new ATOM 0 HA ALA A 338 -13.279 9.075 -4.967 1.00 0.00 H new ATOM 0 HB1 ALA A 338 -15.126 7.824 -6.087 1.00 0.00 H new ATOM 0 HB2 ALA A 338 -13.683 7.947 -7.122 1.00 0.00 H new ATOM 0 HB3 ALA A 338 -14.042 6.425 -6.272 1.00 0.00 H new ATOM 230 N ALA A 339 -13.512 6.299 -3.253 1.00 0.00 N ATOM 231 CA ALA A 339 -14.079 5.744 -2.027 1.00 0.00 C ATOM 232 C ALA A 339 -13.039 5.008 -1.186 1.00 0.00 C ATOM 233 O ALA A 339 -13.386 4.287 -0.255 1.00 0.00 O ATOM 234 CB ALA A 339 -15.240 4.820 -2.358 1.00 0.00 C ATOM 0 H ALA A 339 -12.812 5.711 -3.706 1.00 0.00 H new ATOM 0 HA ALA A 339 -14.440 6.581 -1.430 1.00 0.00 H new ATOM 0 HB1 ALA A 339 -15.655 4.412 -1.436 1.00 0.00 H new ATOM 0 HB2 ALA A 339 -16.012 5.380 -2.886 1.00 0.00 H new ATOM 0 HB3 ALA A 339 -14.887 4.004 -2.989 1.00 0.00 H new ATOM 240 N ASN A 340 -11.770 5.193 -1.505 1.00 0.00 N ATOM 241 CA ASN A 340 -10.705 4.519 -0.757 1.00 0.00 C ATOM 242 C ASN A 340 -9.709 5.510 -0.213 1.00 0.00 C ATOM 243 O ASN A 340 -8.830 5.157 0.576 1.00 0.00 O ATOM 244 CB ASN A 340 -9.986 3.491 -1.631 1.00 0.00 C ATOM 245 CG ASN A 340 -10.861 2.313 -1.982 1.00 0.00 C ATOM 246 OD1 ASN A 340 -10.890 1.313 -1.269 1.00 0.00 O ATOM 247 ND2 ASN A 340 -11.582 2.424 -3.078 1.00 0.00 N ATOM 0 H ASN A 340 -11.447 5.793 -2.264 1.00 0.00 H new ATOM 0 HA ASN A 340 -11.175 4.002 0.080 1.00 0.00 H new ATOM 0 HB2 ASN A 340 -9.647 3.973 -2.548 1.00 0.00 H new ATOM 0 HB3 ASN A 340 -9.097 3.136 -1.110 1.00 0.00 H new ATOM 0 HD21 ASN A 340 -12.195 1.661 -3.364 1.00 0.00 H new ATOM 0 HD22 ASN A 340 -11.527 3.273 -3.641 1.00 0.00 H new ATOM 254 N THR A 341 -9.833 6.741 -0.634 1.00 0.00 N ATOM 255 CA THR A 341 -8.930 7.781 -0.199 1.00 0.00 C ATOM 256 C THR A 341 -9.657 9.116 -0.169 1.00 0.00 C ATOM 257 O THR A 341 -10.780 9.224 -0.660 1.00 0.00 O ATOM 258 CB THR A 341 -7.711 7.878 -1.134 1.00 0.00 C ATOM 259 OG1 THR A 341 -7.663 6.733 -1.996 1.00 0.00 O ATOM 260 CG2 THR A 341 -6.432 7.939 -0.326 1.00 0.00 C ATOM 0 H THR A 341 -10.556 7.052 -1.283 1.00 0.00 H new ATOM 0 HA THR A 341 -8.579 7.532 0.802 1.00 0.00 H new ATOM 0 HB THR A 341 -7.806 8.785 -1.731 1.00 0.00 H new ATOM 0 HG1 THR A 341 -6.763 6.345 -1.975 1.00 0.00 H new ATOM 0 HG21 THR A 341 -5.578 8.007 -1.000 1.00 0.00 H new ATOM 0 HG22 THR A 341 -6.453 8.815 0.323 1.00 0.00 H new ATOM 0 HG23 THR A 341 -6.343 7.039 0.282 1.00 0.00 H new ATOM 268 N LYS A 342 -9.032 10.125 0.407 1.00 0.00 N ATOM 269 CA LYS A 342 -9.639 11.440 0.488 1.00 0.00 C ATOM 270 C LYS A 342 -8.587 12.506 0.294 1.00 0.00 C ATOM 271 O LYS A 342 -7.407 12.194 0.103 1.00 0.00 O ATOM 272 CB LYS A 342 -10.379 11.635 1.827 1.00 0.00 C ATOM 273 CG LYS A 342 -11.466 10.596 2.068 1.00 0.00 C ATOM 274 CD LYS A 342 -12.432 10.990 3.176 1.00 0.00 C ATOM 275 CE LYS A 342 -11.772 10.989 4.544 1.00 0.00 C ATOM 276 NZ LYS A 342 -12.778 11.022 5.637 1.00 0.00 N1+ ATOM 0 H LYS A 342 -8.104 10.059 0.826 1.00 0.00 H new ATOM 0 HA LYS A 342 -10.378 11.526 -0.308 1.00 0.00 H new ATOM 0 HB2 LYS A 342 -9.658 11.593 2.643 1.00 0.00 H new ATOM 0 HB3 LYS A 342 -10.825 12.629 1.847 1.00 0.00 H new ATOM 0 HG2 LYS A 342 -12.025 10.442 1.145 1.00 0.00 H new ATOM 0 HG3 LYS A 342 -11.000 9.644 2.321 1.00 0.00 H new ATOM 0 HD2 LYS A 342 -12.833 11.982 2.969 1.00 0.00 H new ATOM 0 HD3 LYS A 342 -13.276 10.300 3.182 1.00 0.00 H new ATOM 0 HE2 LYS A 342 -11.150 10.100 4.648 1.00 0.00 H new ATOM 0 HE3 LYS A 342 -11.112 11.852 4.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 342 -12.296 11.157 6.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 342 -13.440 11.808 5.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 342 -13.303 10.124 5.653 1.00 0.00 H new ATOM 290 N GLU A 343 -8.998 13.750 0.334 1.00 0.00 N ATOM 291 CA GLU A 343 -8.074 14.850 0.136 1.00 0.00 C ATOM 292 C GLU A 343 -8.055 15.773 1.336 1.00 0.00 C ATOM 293 O GLU A 343 -8.898 15.667 2.232 1.00 0.00 O ATOM 294 CB GLU A 343 -8.431 15.645 -1.123 1.00 0.00 C ATOM 295 CG GLU A 343 -8.437 14.818 -2.395 1.00 0.00 C ATOM 296 CD GLU A 343 -8.607 15.656 -3.634 1.00 0.00 C ATOM 297 OE1 GLU A 343 -9.750 16.047 -3.935 1.00 0.00 O1- ATOM 298 OE2 GLU A 343 -7.591 15.932 -4.312 1.00 0.00 O ATOM 0 H GLU A 343 -9.964 14.030 0.501 1.00 0.00 H new ATOM 0 HA GLU A 343 -7.080 14.421 0.012 1.00 0.00 H new ATOM 0 HB2 GLU A 343 -9.415 16.094 -0.989 1.00 0.00 H new ATOM 0 HB3 GLU A 343 -7.720 16.463 -1.237 1.00 0.00 H new ATOM 0 HG2 GLU A 343 -7.503 14.260 -2.465 1.00 0.00 H new ATOM 0 HG3 GLU A 343 -9.243 14.086 -2.343 1.00 0.00 H new ATOM 305 N CYS A 344 -7.078 16.667 1.348 1.00 0.00 N ATOM 306 CA CYS A 344 -6.941 17.652 2.397 1.00 0.00 C ATOM 307 C CYS A 344 -8.065 18.667 2.296 1.00 0.00 C ATOM 308 O CYS A 344 -8.269 19.264 1.248 1.00 0.00 O ATOM 309 CB CYS A 344 -5.584 18.350 2.269 1.00 0.00 C ATOM 310 SG CYS A 344 -5.288 19.704 3.462 1.00 0.00 S ATOM 0 H CYS A 344 -6.359 16.726 0.627 1.00 0.00 H new ATOM 0 HA CYS A 344 -6.997 17.161 3.368 1.00 0.00 H new ATOM 0 HB2 CYS A 344 -4.798 17.605 2.388 1.00 0.00 H new ATOM 0 HB3 CYS A 344 -5.494 18.751 1.259 1.00 0.00 H new ATOM 315 N PRO A 345 -8.801 18.878 3.379 1.00 0.00 N ATOM 316 CA PRO A 345 -9.899 19.836 3.401 1.00 0.00 C ATOM 317 C PRO A 345 -9.401 21.280 3.448 1.00 0.00 C ATOM 318 O PRO A 345 -10.194 22.220 3.509 1.00 0.00 O ATOM 319 CB PRO A 345 -10.654 19.483 4.683 1.00 0.00 C ATOM 320 CG PRO A 345 -9.628 18.868 5.573 1.00 0.00 C ATOM 321 CD PRO A 345 -8.631 18.192 4.670 1.00 0.00 C ATOM 0 HA PRO A 345 -10.514 19.776 2.503 1.00 0.00 H new ATOM 0 HB2 PRO A 345 -11.094 20.370 5.140 1.00 0.00 H new ATOM 0 HB3 PRO A 345 -11.471 18.789 4.483 1.00 0.00 H new ATOM 0 HG2 PRO A 345 -9.143 19.626 6.188 1.00 0.00 H new ATOM 0 HG3 PRO A 345 -10.085 18.150 6.254 1.00 0.00 H new ATOM 0 HD2 PRO A 345 -7.614 18.298 5.048 1.00 0.00 H new ATOM 0 HD3 PRO A 345 -8.830 17.124 4.584 1.00 0.00 H new ATOM 329 N LYS A 346 -8.087 21.452 3.413 1.00 0.00 N ATOM 330 CA LYS A 346 -7.500 22.764 3.459 1.00 0.00 C ATOM 331 C LYS A 346 -6.941 23.182 2.098 1.00 0.00 C ATOM 332 O LYS A 346 -7.305 24.234 1.573 1.00 0.00 O ATOM 333 CB LYS A 346 -6.425 22.840 4.554 1.00 0.00 C ATOM 334 CG LYS A 346 -5.418 23.950 4.338 1.00 0.00 C ATOM 335 CD LYS A 346 -4.665 24.336 5.620 1.00 0.00 C ATOM 336 CE LYS A 346 -5.599 24.834 6.731 1.00 0.00 C ATOM 337 NZ LYS A 346 -6.016 23.740 7.663 1.00 0.00 N1+ ATOM 0 H LYS A 346 -7.413 20.689 3.353 1.00 0.00 H new ATOM 0 HA LYS A 346 -8.289 23.472 3.710 1.00 0.00 H new ATOM 0 HB2 LYS A 346 -6.911 22.984 5.519 1.00 0.00 H new ATOM 0 HB3 LYS A 346 -5.898 21.887 4.601 1.00 0.00 H new ATOM 0 HG2 LYS A 346 -4.699 23.638 3.581 1.00 0.00 H new ATOM 0 HG3 LYS A 346 -5.932 24.828 3.947 1.00 0.00 H new ATOM 0 HD2 LYS A 346 -4.106 23.473 5.981 1.00 0.00 H new ATOM 0 HD3 LYS A 346 -3.937 25.113 5.388 1.00 0.00 H new ATOM 0 HE2 LYS A 346 -5.098 25.618 7.298 1.00 0.00 H new ATOM 0 HE3 LYS A 346 -6.486 25.282 6.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 346 -7.051 23.744 7.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 346 -5.708 22.823 7.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 346 -5.579 23.892 8.594 1.00 0.00 H new ATOM 351 N CYS A 347 -6.070 22.365 1.525 1.00 0.00 N ATOM 352 CA CYS A 347 -5.460 22.713 0.244 1.00 0.00 C ATOM 353 C CYS A 347 -6.017 21.866 -0.887 1.00 0.00 C ATOM 354 O CYS A 347 -5.848 22.200 -2.066 1.00 0.00 O ATOM 355 CB CYS A 347 -3.943 22.562 0.311 1.00 0.00 C ATOM 356 SG CYS A 347 -3.370 20.870 0.592 1.00 0.00 S ATOM 0 H CYS A 347 -5.772 21.471 1.915 1.00 0.00 H new ATOM 0 HA CYS A 347 -5.704 23.755 0.039 1.00 0.00 H new ATOM 0 HB2 CYS A 347 -3.513 22.928 -0.621 1.00 0.00 H new ATOM 0 HB3 CYS A 347 -3.562 23.199 1.110 1.00 0.00 H new ATOM 361 N HIS A 348 -6.683 20.786 -0.516 1.00 0.00 N ATOM 362 CA HIS A 348 -7.262 19.837 -1.454 1.00 0.00 C ATOM 363 C HIS A 348 -6.191 19.106 -2.228 1.00 0.00 C ATOM 364 O HIS A 348 -5.946 19.376 -3.410 1.00 0.00 O ATOM 365 CB HIS A 348 -8.290 20.480 -2.393 1.00 0.00 C ATOM 366 CG HIS A 348 -9.514 20.988 -1.690 1.00 0.00 C ATOM 367 ND1 HIS A 348 -10.728 20.360 -1.829 1.00 0.00 N ATOM 368 CD2 HIS A 348 -9.660 22.052 -0.864 1.00 0.00 C ATOM 369 CE1 HIS A 348 -11.578 21.045 -1.085 1.00 0.00 C ATOM 370 NE2 HIS A 348 -10.976 22.077 -0.484 1.00 0.00 N ATOM 0 H HIS A 348 -6.840 20.539 0.461 1.00 0.00 H new ATOM 0 HA HIS A 348 -7.806 19.105 -0.857 1.00 0.00 H new ATOM 0 HB2 HIS A 348 -7.817 21.306 -2.924 1.00 0.00 H new ATOM 0 HB3 HIS A 348 -8.590 19.749 -3.144 1.00 0.00 H new ATOM 0 HD2 HIS A 348 -8.889 22.746 -0.563 1.00 0.00 H new ATOM 0 HE1 HIS A 348 -12.625 20.803 -0.976 1.00 0.00 H new ATOM 0 HE2 HIS A 348 -11.414 22.755 0.140 1.00 0.00 H new ATOM 378 N VAL A 349 -5.521 18.220 -1.538 1.00 0.00 N ATOM 379 CA VAL A 349 -4.518 17.373 -2.130 1.00 0.00 C ATOM 380 C VAL A 349 -4.808 15.935 -1.743 1.00 0.00 C ATOM 381 O VAL A 349 -5.211 15.668 -0.609 1.00 0.00 O ATOM 382 CB VAL A 349 -3.080 17.759 -1.673 1.00 0.00 C ATOM 383 CG1 VAL A 349 -2.943 17.633 -0.176 1.00 0.00 C ATOM 384 CG2 VAL A 349 -2.032 16.911 -2.381 1.00 0.00 C ATOM 0 H VAL A 349 -5.658 18.064 -0.539 1.00 0.00 H new ATOM 0 HA VAL A 349 -4.558 17.499 -3.212 1.00 0.00 H new ATOM 0 HB VAL A 349 -2.911 18.800 -1.947 1.00 0.00 H new ATOM 0 HG11 VAL A 349 -1.931 17.907 0.121 1.00 0.00 H new ATOM 0 HG12 VAL A 349 -3.657 18.297 0.312 1.00 0.00 H new ATOM 0 HG13 VAL A 349 -3.142 16.604 0.122 1.00 0.00 H new ATOM 0 HG21 VAL A 349 -1.038 17.203 -2.042 1.00 0.00 H new ATOM 0 HG22 VAL A 349 -2.199 15.859 -2.151 1.00 0.00 H new ATOM 0 HG23 VAL A 349 -2.107 17.063 -3.458 1.00 0.00 H new ATOM 394 N THR A 350 -4.647 15.023 -2.674 1.00 0.00 N ATOM 395 CA THR A 350 -4.888 13.628 -2.404 1.00 0.00 C ATOM 396 C THR A 350 -3.938 13.112 -1.336 1.00 0.00 C ATOM 397 O THR A 350 -2.719 13.095 -1.521 1.00 0.00 O ATOM 398 CB THR A 350 -4.740 12.791 -3.675 1.00 0.00 C ATOM 399 OG1 THR A 350 -5.518 13.389 -4.723 1.00 0.00 O ATOM 400 CG2 THR A 350 -5.229 11.373 -3.435 1.00 0.00 C ATOM 0 H THR A 350 -4.349 15.225 -3.628 1.00 0.00 H new ATOM 0 HA THR A 350 -5.911 13.535 -2.041 1.00 0.00 H new ATOM 0 HB THR A 350 -3.688 12.758 -3.959 1.00 0.00 H new ATOM 0 HG1 THR A 350 -5.427 12.858 -5.542 1.00 0.00 H new ATOM 0 HG21 THR A 350 -5.117 10.790 -4.349 1.00 0.00 H new ATOM 0 HG22 THR A 350 -4.642 10.916 -2.639 1.00 0.00 H new ATOM 0 HG23 THR A 350 -6.279 11.395 -3.145 1.00 0.00 H new ATOM 408 N ILE A 351 -4.499 12.721 -0.215 1.00 0.00 N ATOM 409 CA ILE A 351 -3.728 12.191 0.871 1.00 0.00 C ATOM 410 C ILE A 351 -3.920 10.689 0.912 1.00 0.00 C ATOM 411 O ILE A 351 -4.393 10.101 -0.053 1.00 0.00 O ATOM 412 CB ILE A 351 -4.157 12.818 2.231 1.00 0.00 C ATOM 413 CG1 ILE A 351 -5.590 12.409 2.586 1.00 0.00 C ATOM 414 CG2 ILE A 351 -4.033 14.343 2.191 1.00 0.00 C ATOM 415 CD1 ILE A 351 -6.155 13.129 3.786 1.00 0.00 C ATOM 0 H ILE A 351 -5.502 12.764 -0.036 1.00 0.00 H new ATOM 0 HA ILE A 351 -2.678 12.436 0.712 1.00 0.00 H new ATOM 0 HB ILE A 351 -3.487 12.440 3.003 1.00 0.00 H new ATOM 0 HG12 ILE A 351 -6.234 12.596 1.727 1.00 0.00 H new ATOM 0 HG13 ILE A 351 -5.614 11.336 2.775 1.00 0.00 H new ATOM 0 HG21 ILE A 351 -4.338 14.758 3.152 1.00 0.00 H new ATOM 0 HG22 ILE A 351 -2.998 14.619 1.989 1.00 0.00 H new ATOM 0 HG23 ILE A 351 -4.675 14.740 1.404 1.00 0.00 H new ATOM 0 HD11 ILE A 351 -7.172 12.784 3.972 1.00 0.00 H new ATOM 0 HD12 ILE A 351 -5.536 12.922 4.659 1.00 0.00 H new ATOM 0 HD13 ILE A 351 -6.165 14.202 3.595 1.00 0.00 H new ATOM 427 N GLU A 352 -3.554 10.079 2.010 1.00 0.00 N ATOM 428 CA GLU A 352 -3.732 8.656 2.182 1.00 0.00 C ATOM 429 C GLU A 352 -3.572 8.314 3.637 1.00 0.00 C ATOM 430 O GLU A 352 -2.622 8.757 4.280 1.00 0.00 O ATOM 431 CB GLU A 352 -2.737 7.869 1.341 1.00 0.00 C ATOM 432 CG GLU A 352 -3.080 6.398 1.223 1.00 0.00 C ATOM 433 CD GLU A 352 -2.069 5.633 0.413 1.00 0.00 C ATOM 434 OE1 GLU A 352 -2.102 5.730 -0.828 1.00 0.00 O ATOM 435 OE2 GLU A 352 -1.232 4.923 1.017 1.00 0.00 O1- ATOM 0 H GLU A 352 -3.126 10.550 2.807 1.00 0.00 H new ATOM 0 HA GLU A 352 -4.733 8.383 1.846 1.00 0.00 H new ATOM 0 HB2 GLU A 352 -2.691 8.305 0.343 1.00 0.00 H new ATOM 0 HB3 GLU A 352 -1.744 7.969 1.778 1.00 0.00 H new ATOM 0 HG2 GLU A 352 -3.146 5.963 2.220 1.00 0.00 H new ATOM 0 HG3 GLU A 352 -4.063 6.293 0.764 1.00 0.00 H new ATOM 442 N LYS A 353 -4.503 7.553 4.162 1.00 0.00 N ATOM 443 CA LYS A 353 -4.483 7.211 5.564 1.00 0.00 C ATOM 444 C LYS A 353 -3.361 6.234 5.888 1.00 0.00 C ATOM 445 O LYS A 353 -3.077 5.313 5.122 1.00 0.00 O ATOM 446 CB LYS A 353 -5.832 6.662 6.012 1.00 0.00 C ATOM 447 CG LYS A 353 -5.982 6.615 7.520 1.00 0.00 C ATOM 448 CD LYS A 353 -5.794 8.001 8.117 1.00 0.00 C ATOM 449 CE LYS A 353 -5.996 8.000 9.607 1.00 0.00 C ATOM 450 NZ LYS A 353 -5.538 9.269 10.222 1.00 0.00 N1+ ATOM 0 H LYS A 353 -5.285 7.159 3.639 1.00 0.00 H new ATOM 0 HA LYS A 353 -4.289 8.128 6.121 1.00 0.00 H new ATOM 0 HB2 LYS A 353 -6.627 7.279 5.593 1.00 0.00 H new ATOM 0 HB3 LYS A 353 -5.962 5.658 5.608 1.00 0.00 H new ATOM 0 HG2 LYS A 353 -6.968 6.231 7.782 1.00 0.00 H new ATOM 0 HG3 LYS A 353 -5.249 5.928 7.943 1.00 0.00 H new ATOM 0 HD2 LYS A 353 -4.792 8.363 7.886 1.00 0.00 H new ATOM 0 HD3 LYS A 353 -6.497 8.694 7.655 1.00 0.00 H new ATOM 0 HE2 LYS A 353 -7.052 7.847 9.831 1.00 0.00 H new ATOM 0 HE3 LYS A 353 -5.452 7.165 10.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 353 -5.420 9.135 11.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 353 -4.629 9.550 9.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 353 -6.244 10.013 10.049 1.00 0.00 H new ATOM 464 N ASP A 354 -2.737 6.452 7.034 1.00 0.00 N ATOM 465 CA ASP A 354 -1.617 5.639 7.473 1.00 0.00 C ATOM 466 C ASP A 354 -2.079 4.474 8.331 1.00 0.00 C ATOM 467 O ASP A 354 -1.656 3.336 8.123 1.00 0.00 O ATOM 468 CB ASP A 354 -0.620 6.498 8.250 1.00 0.00 C ATOM 469 CG ASP A 354 0.496 5.687 8.874 1.00 0.00 C ATOM 470 OD1 ASP A 354 1.456 5.343 8.161 1.00 0.00 O1- ATOM 471 OD2 ASP A 354 0.423 5.403 10.085 1.00 0.00 O ATOM 0 H ASP A 354 -2.992 7.196 7.684 1.00 0.00 H new ATOM 0 HA ASP A 354 -1.131 5.231 6.587 1.00 0.00 H new ATOM 0 HB2 ASP A 354 -0.190 7.243 7.580 1.00 0.00 H new ATOM 0 HB3 ASP A 354 -1.149 7.041 9.033 1.00 0.00 H new ATOM 476 N GLY A 355 -2.965 4.747 9.276 1.00 0.00 N ATOM 477 CA GLY A 355 -3.422 3.718 10.149 1.00 0.00 C ATOM 478 C GLY A 355 -4.639 4.119 10.944 1.00 0.00 C ATOM 479 O GLY A 355 -5.413 4.976 10.516 1.00 0.00 O ATOM 0 H GLY A 355 -3.369 5.668 9.444 1.00 0.00 H new ATOM 0 HA2 GLY A 355 -3.654 2.828 9.563 1.00 0.00 H new ATOM 0 HA3 GLY A 355 -2.619 3.448 10.835 1.00 0.00 H new ATOM 483 N GLY A 356 -4.788 3.515 12.112 1.00 0.00 N ATOM 484 CA GLY A 356 -5.947 3.749 12.954 1.00 0.00 C ATOM 485 C GLY A 356 -5.937 5.105 13.627 1.00 0.00 C ATOM 486 O GLY A 356 -7.001 5.666 13.911 1.00 0.00 O ATOM 0 H GLY A 356 -4.114 2.854 12.499 1.00 0.00 H new ATOM 0 HA2 GLY A 356 -6.850 3.658 12.350 1.00 0.00 H new ATOM 0 HA3 GLY A 356 -5.995 2.973 13.718 1.00 0.00 H new ATOM 490 N SER A 357 -4.748 5.635 13.892 1.00 0.00 N ATOM 491 CA SER A 357 -4.617 6.943 14.517 1.00 0.00 C ATOM 492 C SER A 357 -5.342 7.995 13.680 1.00 0.00 C ATOM 493 O SER A 357 -5.136 8.083 12.480 1.00 0.00 O ATOM 494 CB SER A 357 -3.140 7.302 14.671 1.00 0.00 C ATOM 495 OG SER A 357 -2.450 6.285 15.384 1.00 0.00 O ATOM 0 H SER A 357 -3.861 5.177 13.683 1.00 0.00 H new ATOM 0 HA SER A 357 -5.071 6.915 15.507 1.00 0.00 H new ATOM 0 HB2 SER A 357 -2.688 7.435 13.688 1.00 0.00 H new ATOM 0 HB3 SER A 357 -3.044 8.252 15.197 1.00 0.00 H new ATOM 0 HG SER A 357 -1.505 6.531 15.472 1.00 0.00 H new ATOM 501 N ASN A 358 -6.176 8.795 14.323 1.00 0.00 N ATOM 502 CA ASN A 358 -7.008 9.766 13.631 1.00 0.00 C ATOM 503 C ASN A 358 -6.183 10.932 13.160 1.00 0.00 C ATOM 504 O ASN A 358 -6.559 11.619 12.205 1.00 0.00 O ATOM 505 CB ASN A 358 -8.126 10.271 14.547 1.00 0.00 C ATOM 506 CG ASN A 358 -9.022 9.168 15.076 1.00 0.00 C ATOM 507 OD1 ASN A 358 -9.538 9.261 16.186 1.00 0.00 O ATOM 508 ND2 ASN A 358 -9.215 8.122 14.294 1.00 0.00 N ATOM 0 H ASN A 358 -6.296 8.790 15.336 1.00 0.00 H new ATOM 0 HA ASN A 358 -7.451 9.270 12.767 1.00 0.00 H new ATOM 0 HB2 ASN A 358 -7.682 10.802 15.389 1.00 0.00 H new ATOM 0 HB3 ASN A 358 -8.735 10.991 14.000 1.00 0.00 H new ATOM 0 HD21 ASN A 358 -9.810 7.355 14.606 1.00 0.00 H new ATOM 0 HD22 ASN A 358 -8.769 8.081 13.378 1.00 0.00 H new ATOM 515 N HIS A 359 -5.049 11.134 13.822 1.00 0.00 N ATOM 516 CA HIS A 359 -4.139 12.227 13.518 1.00 0.00 C ATOM 517 C HIS A 359 -3.584 12.097 12.100 1.00 0.00 C ATOM 518 O HIS A 359 -2.544 11.488 11.874 1.00 0.00 O ATOM 519 CB HIS A 359 -2.996 12.251 14.537 1.00 0.00 C ATOM 520 CG HIS A 359 -2.255 13.555 14.618 1.00 0.00 C ATOM 521 ND1 HIS A 359 -1.470 13.854 15.703 1.00 0.00 N ATOM 522 CD2 HIS A 359 -2.219 14.594 13.745 1.00 0.00 C ATOM 523 CE1 HIS A 359 -0.980 15.059 15.473 1.00 0.00 C ATOM 524 NE2 HIS A 359 -1.402 15.543 14.302 1.00 0.00 N ATOM 0 H HIS A 359 -4.735 10.539 14.589 1.00 0.00 H new ATOM 0 HA HIS A 359 -4.692 13.165 13.579 1.00 0.00 H new ATOM 0 HB2 HIS A 359 -3.400 12.017 15.522 1.00 0.00 H new ATOM 0 HB3 HIS A 359 -2.288 11.461 14.287 1.00 0.00 H new ATOM 0 HD2 HIS A 359 -2.733 14.660 12.798 1.00 0.00 H new ATOM 0 HE1 HIS A 359 -0.321 15.586 16.147 1.00 0.00 H new ATOM 0 HE2 HIS A 359 -1.162 16.448 13.898 1.00 0.00 H new ATOM 532 N MET A 360 -4.320 12.624 11.160 1.00 0.00 N ATOM 533 CA MET A 360 -3.923 12.633 9.765 1.00 0.00 C ATOM 534 C MET A 360 -3.355 13.992 9.374 1.00 0.00 C ATOM 535 O MET A 360 -3.977 15.023 9.596 1.00 0.00 O ATOM 536 CB MET A 360 -5.122 12.260 8.873 1.00 0.00 C ATOM 537 CG MET A 360 -5.102 12.882 7.480 1.00 0.00 C ATOM 538 SD MET A 360 -3.736 12.306 6.459 1.00 0.00 S ATOM 539 CE MET A 360 -4.304 10.672 6.047 1.00 0.00 C ATOM 0 H MET A 360 -5.223 13.066 11.335 1.00 0.00 H new ATOM 0 HA MET A 360 -3.139 11.890 9.619 1.00 0.00 H new ATOM 0 HB2 MET A 360 -5.157 11.175 8.771 1.00 0.00 H new ATOM 0 HB3 MET A 360 -6.040 12.562 9.377 1.00 0.00 H new ATOM 0 HG2 MET A 360 -6.042 12.657 6.976 1.00 0.00 H new ATOM 0 HG3 MET A 360 -5.043 13.966 7.575 1.00 0.00 H new ATOM 0 HE1 MET A 360 -3.507 9.952 6.234 1.00 0.00 H new ATOM 0 HE2 MET A 360 -5.170 10.422 6.660 1.00 0.00 H new ATOM 0 HE3 MET A 360 -4.584 10.639 4.994 1.00 0.00 H new ATOM 549 N VAL A 361 -2.180 13.985 8.796 1.00 0.00 N ATOM 550 CA VAL A 361 -1.552 15.209 8.361 1.00 0.00 C ATOM 551 C VAL A 361 -1.353 15.211 6.848 1.00 0.00 C ATOM 552 O VAL A 361 -0.986 14.186 6.247 1.00 0.00 O ATOM 553 CB VAL A 361 -0.212 15.476 9.107 1.00 0.00 C ATOM 554 CG1 VAL A 361 0.700 14.273 9.050 1.00 0.00 C ATOM 555 CG2 VAL A 361 0.493 16.713 8.559 1.00 0.00 C ATOM 0 H VAL A 361 -1.636 13.141 8.615 1.00 0.00 H new ATOM 0 HA VAL A 361 -2.225 16.027 8.616 1.00 0.00 H new ATOM 0 HB VAL A 361 -0.457 15.663 10.153 1.00 0.00 H new ATOM 0 HG11 VAL A 361 1.626 14.493 9.580 1.00 0.00 H new ATOM 0 HG12 VAL A 361 0.208 13.421 9.518 1.00 0.00 H new ATOM 0 HG13 VAL A 361 0.925 14.036 8.010 1.00 0.00 H new ATOM 0 HG21 VAL A 361 1.425 16.871 9.102 1.00 0.00 H new ATOM 0 HG22 VAL A 361 0.709 16.569 7.500 1.00 0.00 H new ATOM 0 HG23 VAL A 361 -0.151 17.584 8.683 1.00 0.00 H new ATOM 565 N CYS A 362 -1.634 16.360 6.246 1.00 0.00 N ATOM 566 CA CYS A 362 -1.543 16.569 4.810 1.00 0.00 C ATOM 567 C CYS A 362 -0.187 16.137 4.251 1.00 0.00 C ATOM 568 O CYS A 362 0.835 16.162 4.951 1.00 0.00 O ATOM 569 CB CYS A 362 -1.784 18.040 4.506 1.00 0.00 C ATOM 570 SG CYS A 362 -1.813 18.454 2.746 1.00 0.00 S ATOM 0 H CYS A 362 -1.938 17.190 6.756 1.00 0.00 H new ATOM 0 HA CYS A 362 -2.302 15.953 4.329 1.00 0.00 H new ATOM 0 HB2 CYS A 362 -2.733 18.338 4.951 1.00 0.00 H new ATOM 0 HB3 CYS A 362 -1.006 18.629 4.991 1.00 0.00 H new ATOM 575 N ARG A 363 -0.185 15.758 2.986 1.00 0.00 N ATOM 576 CA ARG A 363 1.028 15.301 2.331 1.00 0.00 C ATOM 577 C ARG A 363 1.667 16.456 1.593 1.00 0.00 C ATOM 578 O ARG A 363 2.876 16.466 1.357 1.00 0.00 O ATOM 579 CB ARG A 363 0.731 14.174 1.332 1.00 0.00 C ATOM 580 CG ARG A 363 -0.477 13.310 1.675 1.00 0.00 C ATOM 581 CD ARG A 363 -0.403 12.722 3.086 1.00 0.00 C ATOM 582 NE ARG A 363 0.707 11.791 3.254 1.00 0.00 N ATOM 583 CZ ARG A 363 1.300 11.533 4.425 1.00 0.00 C ATOM 584 NH1 ARG A 363 0.907 12.158 5.535 1.00 0.00 N1+ ATOM 585 NH2 ARG A 363 2.287 10.656 4.487 1.00 0.00 N ATOM 0 H ARG A 363 -1.013 15.758 2.390 1.00 0.00 H new ATOM 0 HA ARG A 363 1.703 14.918 3.097 1.00 0.00 H new ATOM 0 HB2 ARG A 363 0.576 14.614 0.347 1.00 0.00 H new ATOM 0 HB3 ARG A 363 1.609 13.532 1.260 1.00 0.00 H new ATOM 0 HG2 ARG A 363 -1.384 13.908 1.582 1.00 0.00 H new ATOM 0 HG3 ARG A 363 -0.555 12.498 0.952 1.00 0.00 H new ATOM 0 HD2 ARG A 363 -0.303 13.533 3.808 1.00 0.00 H new ATOM 0 HD3 ARG A 363 -1.338 12.209 3.310 1.00 0.00 H new ATOM 0 HE ARG A 363 1.053 11.306 2.426 1.00 0.00 H new ATOM 0 HH11 ARG A 363 0.149 12.839 5.496 1.00 0.00 H new ATOM 0 HH12 ARG A 363 1.365 11.955 6.424 1.00 0.00 H new ATOM 0 HH21 ARG A 363 2.597 10.176 3.642 1.00 0.00 H new ATOM 0 HH22 ARG A 363 2.739 10.459 5.380 1.00 0.00 H new ATOM 599 N ASN A 364 0.841 17.427 1.221 1.00 0.00 N ATOM 600 CA ASN A 364 1.307 18.593 0.497 1.00 0.00 C ATOM 601 C ASN A 364 2.315 19.367 1.327 1.00 0.00 C ATOM 602 O ASN A 364 1.996 19.875 2.393 1.00 0.00 O ATOM 603 CB ASN A 364 0.124 19.492 0.102 1.00 0.00 C ATOM 604 CG ASN A 364 0.541 20.753 -0.631 1.00 0.00 C ATOM 605 OD1 ASN A 364 1.622 20.819 -1.223 1.00 0.00 O ATOM 606 ND2 ASN A 364 -0.323 21.751 -0.616 1.00 0.00 N ATOM 0 H ASN A 364 -0.161 17.425 1.413 1.00 0.00 H new ATOM 0 HA ASN A 364 1.800 18.258 -0.415 1.00 0.00 H new ATOM 0 HB2 ASN A 364 -0.559 18.924 -0.529 1.00 0.00 H new ATOM 0 HB3 ASN A 364 -0.428 19.769 1.000 1.00 0.00 H new ATOM 0 HD21 ASN A 364 -0.108 22.619 -1.107 1.00 0.00 H new ATOM 0 HD22 ASN A 364 -1.206 21.654 -0.114 1.00 0.00 H new ATOM 613 N GLN A 365 3.535 19.439 0.823 1.00 0.00 N ATOM 614 CA GLN A 365 4.627 20.149 1.494 1.00 0.00 C ATOM 615 C GLN A 365 4.369 21.650 1.552 1.00 0.00 C ATOM 616 O GLN A 365 5.048 22.382 2.264 1.00 0.00 O ATOM 617 CB GLN A 365 5.965 19.872 0.798 1.00 0.00 C ATOM 618 CG GLN A 365 5.864 19.775 -0.717 1.00 0.00 C ATOM 619 CD GLN A 365 5.747 18.334 -1.207 1.00 0.00 C ATOM 620 OE1 GLN A 365 6.140 18.018 -2.325 1.00 0.00 O ATOM 621 NE2 GLN A 365 5.232 17.453 -0.363 1.00 0.00 N ATOM 0 H GLN A 365 3.803 19.009 -0.062 1.00 0.00 H new ATOM 0 HA GLN A 365 4.676 19.775 2.517 1.00 0.00 H new ATOM 0 HB2 GLN A 365 6.668 20.664 1.055 1.00 0.00 H new ATOM 0 HB3 GLN A 365 6.379 18.941 1.185 1.00 0.00 H new ATOM 0 HG2 GLN A 365 4.997 20.342 -1.057 1.00 0.00 H new ATOM 0 HG3 GLN A 365 6.743 20.237 -1.166 1.00 0.00 H new ATOM 0 HE21 GLN A 365 4.916 17.754 0.559 1.00 0.00 H new ATOM 0 HE22 GLN A 365 5.151 16.473 -0.635 1.00 0.00 H new ATOM 630 N ASN A 366 3.391 22.098 0.798 1.00 0.00 N ATOM 631 CA ASN A 366 3.005 23.501 0.793 1.00 0.00 C ATOM 632 C ASN A 366 1.824 23.707 1.731 1.00 0.00 C ATOM 633 O ASN A 366 1.198 24.765 1.746 1.00 0.00 O ATOM 634 CB ASN A 366 2.619 23.942 -0.623 1.00 0.00 C ATOM 635 CG ASN A 366 3.711 23.695 -1.638 1.00 0.00 C ATOM 636 OD1 ASN A 366 4.581 24.535 -1.857 1.00 0.00 O ATOM 637 ND2 ASN A 366 3.666 22.543 -2.280 1.00 0.00 N ATOM 0 H ASN A 366 2.841 21.509 0.173 1.00 0.00 H new ATOM 0 HA ASN A 366 3.850 24.101 1.130 1.00 0.00 H new ATOM 0 HB2 ASN A 366 1.718 23.410 -0.930 1.00 0.00 H new ATOM 0 HB3 ASN A 366 2.374 25.004 -0.612 1.00 0.00 H new ATOM 0 HD21 ASN A 366 4.369 22.325 -2.986 1.00 0.00 H new ATOM 0 HD22 ASN A 366 2.928 21.871 -2.070 1.00 0.00 H new ATOM 644 N CYS A 367 1.534 22.684 2.522 1.00 0.00 N ATOM 645 CA CYS A 367 0.405 22.709 3.430 1.00 0.00 C ATOM 646 C CYS A 367 0.783 22.087 4.756 1.00 0.00 C ATOM 647 O CYS A 367 1.020 22.799 5.734 1.00 0.00 O ATOM 648 CB CYS A 367 -0.765 21.947 2.818 1.00 0.00 C ATOM 649 SG CYS A 367 -2.280 21.934 3.833 1.00 0.00 S ATOM 0 H CYS A 367 2.074 21.819 2.550 1.00 0.00 H new ATOM 0 HA CYS A 367 0.113 23.745 3.599 1.00 0.00 H new ATOM 0 HB2 CYS A 367 -0.998 22.385 1.847 1.00 0.00 H new ATOM 0 HB3 CYS A 367 -0.456 20.917 2.638 1.00 0.00 H new ATOM 654 N LYS A 368 0.860 20.750 4.773 1.00 0.00 N ATOM 655 CA LYS A 368 1.211 19.988 5.972 1.00 0.00 C ATOM 656 C LYS A 368 0.236 20.275 7.107 1.00 0.00 C ATOM 657 O LYS A 368 0.623 20.378 8.274 1.00 0.00 O ATOM 658 CB LYS A 368 2.641 20.307 6.386 1.00 0.00 C ATOM 659 CG LYS A 368 3.657 19.947 5.318 1.00 0.00 C ATOM 660 CD LYS A 368 4.928 20.765 5.445 1.00 0.00 C ATOM 661 CE LYS A 368 4.651 22.256 5.285 1.00 0.00 C ATOM 662 NZ LYS A 368 4.541 22.955 6.591 1.00 0.00 N1+ ATOM 0 H LYS A 368 0.680 20.169 3.954 1.00 0.00 H new ATOM 0 HA LYS A 368 1.142 18.924 5.743 1.00 0.00 H new ATOM 0 HB2 LYS A 368 2.720 21.370 6.612 1.00 0.00 H new ATOM 0 HB3 LYS A 368 2.878 19.767 7.303 1.00 0.00 H new ATOM 0 HG2 LYS A 368 3.899 18.887 5.391 1.00 0.00 H new ATOM 0 HG3 LYS A 368 3.220 20.107 4.333 1.00 0.00 H new ATOM 0 HD2 LYS A 368 5.385 20.581 6.417 1.00 0.00 H new ATOM 0 HD3 LYS A 368 5.646 20.444 4.690 1.00 0.00 H new ATOM 0 HE2 LYS A 368 5.450 22.710 4.699 1.00 0.00 H new ATOM 0 HE3 LYS A 368 3.727 22.393 4.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 368 3.681 23.540 6.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 368 4.491 22.253 7.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 368 5.374 23.562 6.731 1.00 0.00 H new ATOM 676 N ALA A 369 -1.027 20.406 6.747 1.00 0.00 N ATOM 677 CA ALA A 369 -2.078 20.654 7.708 1.00 0.00 C ATOM 678 C ALA A 369 -2.448 19.384 8.451 1.00 0.00 C ATOM 679 O ALA A 369 -2.651 18.338 7.843 1.00 0.00 O ATOM 680 CB ALA A 369 -3.296 21.212 7.005 1.00 0.00 C ATOM 0 H ALA A 369 -1.350 20.343 5.781 1.00 0.00 H new ATOM 0 HA ALA A 369 -1.713 21.380 8.434 1.00 0.00 H new ATOM 0 HB1 ALA A 369 -4.084 21.397 7.735 1.00 0.00 H new ATOM 0 HB2 ALA A 369 -3.034 22.147 6.510 1.00 0.00 H new ATOM 0 HB3 ALA A 369 -3.649 20.495 6.264 1.00 0.00 H new ATOM 686 N GLU A 370 -2.523 19.476 9.755 1.00 0.00 N ATOM 687 CA GLU A 370 -2.908 18.344 10.571 1.00 0.00 C ATOM 688 C GLU A 370 -4.398 18.411 10.872 1.00 0.00 C ATOM 689 O GLU A 370 -4.888 19.408 11.412 1.00 0.00 O ATOM 690 CB GLU A 370 -2.094 18.321 11.863 1.00 0.00 C ATOM 691 CG GLU A 370 -0.598 18.146 11.643 1.00 0.00 C ATOM 692 CD GLU A 370 0.209 18.421 12.885 1.00 0.00 C ATOM 693 OE1 GLU A 370 0.357 17.505 13.713 1.00 0.00 O1- ATOM 694 OE2 GLU A 370 0.699 19.560 13.045 1.00 0.00 O ATOM 0 H GLU A 370 -2.322 20.327 10.280 1.00 0.00 H new ATOM 0 HA GLU A 370 -2.703 17.423 10.026 1.00 0.00 H new ATOM 0 HB2 GLU A 370 -2.266 19.250 12.406 1.00 0.00 H new ATOM 0 HB3 GLU A 370 -2.456 17.510 12.495 1.00 0.00 H new ATOM 0 HG2 GLU A 370 -0.401 17.129 11.305 1.00 0.00 H new ATOM 0 HG3 GLU A 370 -0.271 18.815 10.847 1.00 0.00 H new ATOM 701 N PHE A 371 -5.116 17.372 10.505 1.00 0.00 N ATOM 702 CA PHE A 371 -6.555 17.322 10.708 1.00 0.00 C ATOM 703 C PHE A 371 -7.005 15.926 11.087 1.00 0.00 C ATOM 704 O PHE A 371 -6.199 14.994 11.185 1.00 0.00 O ATOM 705 CB PHE A 371 -7.313 17.791 9.445 1.00 0.00 C ATOM 706 CG PHE A 371 -6.822 17.191 8.155 1.00 0.00 C ATOM 707 CD1 PHE A 371 -5.799 17.790 7.442 1.00 0.00 C ATOM 708 CD2 PHE A 371 -7.393 16.033 7.653 1.00 0.00 C ATOM 709 CE1 PHE A 371 -5.351 17.248 6.257 1.00 0.00 C ATOM 710 CE2 PHE A 371 -6.949 15.488 6.466 1.00 0.00 C ATOM 711 CZ PHE A 371 -5.925 16.095 5.769 1.00 0.00 C ATOM 0 H PHE A 371 -4.726 16.541 10.060 1.00 0.00 H new ATOM 0 HA PHE A 371 -6.790 18.000 11.529 1.00 0.00 H new ATOM 0 HB2 PHE A 371 -8.370 17.550 9.562 1.00 0.00 H new ATOM 0 HB3 PHE A 371 -7.239 18.876 9.376 1.00 0.00 H new ATOM 0 HD1 PHE A 371 -5.345 18.695 7.819 1.00 0.00 H new ATOM 0 HD2 PHE A 371 -8.193 15.552 8.196 1.00 0.00 H new ATOM 0 HE1 PHE A 371 -4.551 17.727 5.712 1.00 0.00 H new ATOM 0 HE2 PHE A 371 -7.403 14.586 6.082 1.00 0.00 H new ATOM 0 HZ PHE A 371 -5.574 15.667 4.842 1.00 0.00 H new ATOM 721 N CYS A 372 -8.287 15.785 11.311 1.00 0.00 N ATOM 722 CA CYS A 372 -8.853 14.506 11.617 1.00 0.00 C ATOM 723 C CYS A 372 -9.335 13.871 10.344 1.00 0.00 C ATOM 724 O CYS A 372 -10.222 14.388 9.695 1.00 0.00 O ATOM 725 CB CYS A 372 -10.008 14.654 12.593 1.00 0.00 C ATOM 726 SG CYS A 372 -10.753 13.069 13.106 1.00 0.00 S ATOM 0 H CYS A 372 -8.960 16.551 11.286 1.00 0.00 H new ATOM 0 HA CYS A 372 -8.093 13.877 12.081 1.00 0.00 H new ATOM 0 HB2 CYS A 372 -9.656 15.182 13.479 1.00 0.00 H new ATOM 0 HB3 CYS A 372 -10.779 15.275 12.137 1.00 0.00 H new ATOM 731 N TRP A 373 -8.736 12.766 9.978 1.00 0.00 N ATOM 732 CA TRP A 373 -9.116 12.060 8.763 1.00 0.00 C ATOM 733 C TRP A 373 -10.584 11.645 8.784 1.00 0.00 C ATOM 734 O TRP A 373 -11.270 11.727 7.762 1.00 0.00 O ATOM 735 CB TRP A 373 -8.229 10.824 8.577 1.00 0.00 C ATOM 736 CG TRP A 373 -8.819 9.771 7.680 1.00 0.00 C ATOM 737 CD1 TRP A 373 -9.709 8.804 8.040 1.00 0.00 C ATOM 738 CD2 TRP A 373 -8.559 9.576 6.289 1.00 0.00 C ATOM 739 NE1 TRP A 373 -10.019 8.019 6.966 1.00 0.00 N ATOM 740 CE2 TRP A 373 -9.325 8.466 5.874 1.00 0.00 C ATOM 741 CE3 TRP A 373 -7.757 10.224 5.352 1.00 0.00 C ATOM 742 CZ2 TRP A 373 -9.308 7.998 4.567 1.00 0.00 C ATOM 743 CZ3 TRP A 373 -7.743 9.755 4.053 1.00 0.00 C ATOM 744 CH2 TRP A 373 -8.513 8.654 3.672 1.00 0.00 C ATOM 0 H TRP A 373 -7.978 12.328 10.502 1.00 0.00 H new ATOM 0 HA TRP A 373 -8.975 12.743 7.926 1.00 0.00 H new ATOM 0 HB2 TRP A 373 -7.269 11.138 8.167 1.00 0.00 H new ATOM 0 HB3 TRP A 373 -8.030 10.383 9.554 1.00 0.00 H new ATOM 0 HD1 TRP A 373 -10.112 8.676 9.034 1.00 0.00 H new ATOM 0 HE1 TRP A 373 -10.663 7.228 6.976 1.00 0.00 H new ATOM 0 HE3 TRP A 373 -7.158 11.077 5.636 1.00 0.00 H new ATOM 0 HZ2 TRP A 373 -9.902 7.146 4.269 1.00 0.00 H new ATOM 0 HZ3 TRP A 373 -7.125 10.249 3.318 1.00 0.00 H new ATOM 0 HH2 TRP A 373 -8.479 8.314 2.647 1.00 0.00 H new ATOM 755 N VAL A 374 -11.048 11.199 9.940 1.00 0.00 N ATOM 756 CA VAL A 374 -12.400 10.672 10.090 1.00 0.00 C ATOM 757 C VAL A 374 -13.454 11.656 9.594 1.00 0.00 C ATOM 758 O VAL A 374 -14.121 11.411 8.585 1.00 0.00 O ATOM 759 CB VAL A 374 -12.695 10.296 11.561 1.00 0.00 C ATOM 760 CG1 VAL A 374 -14.080 9.684 11.696 1.00 0.00 C ATOM 761 CG2 VAL A 374 -11.635 9.339 12.088 1.00 0.00 C ATOM 0 H VAL A 374 -10.501 11.191 10.801 1.00 0.00 H new ATOM 0 HA VAL A 374 -12.453 9.774 9.475 1.00 0.00 H new ATOM 0 HB VAL A 374 -12.667 11.208 12.158 1.00 0.00 H new ATOM 0 HG11 VAL A 374 -14.264 9.428 12.739 1.00 0.00 H new ATOM 0 HG12 VAL A 374 -14.829 10.401 11.361 1.00 0.00 H new ATOM 0 HG13 VAL A 374 -14.141 8.783 11.085 1.00 0.00 H new ATOM 0 HG21 VAL A 374 -11.857 9.084 13.124 1.00 0.00 H new ATOM 0 HG22 VAL A 374 -11.632 8.432 11.484 1.00 0.00 H new ATOM 0 HG23 VAL A 374 -10.656 9.815 12.033 1.00 0.00 H new ATOM 771 N CYS A 375 -13.577 12.774 10.275 1.00 0.00 N ATOM 772 CA CYS A 375 -14.573 13.769 9.933 1.00 0.00 C ATOM 773 C CYS A 375 -14.007 14.829 8.996 1.00 0.00 C ATOM 774 O CYS A 375 -14.734 15.721 8.553 1.00 0.00 O ATOM 775 CB CYS A 375 -15.104 14.422 11.208 1.00 0.00 C ATOM 776 SG CYS A 375 -13.800 15.012 12.337 1.00 0.00 S ATOM 0 H CYS A 375 -12.995 13.019 11.076 1.00 0.00 H new ATOM 0 HA CYS A 375 -15.388 13.269 9.411 1.00 0.00 H new ATOM 0 HB2 CYS A 375 -15.742 15.263 10.935 1.00 0.00 H new ATOM 0 HB3 CYS A 375 -15.731 13.705 11.737 1.00 0.00 H new ATOM 781 N LEU A 376 -12.709 14.726 8.697 1.00 0.00 N ATOM 782 CA LEU A 376 -12.011 15.724 7.865 1.00 0.00 C ATOM 783 C LEU A 376 -12.123 17.108 8.484 1.00 0.00 C ATOM 784 O LEU A 376 -12.101 18.124 7.783 1.00 0.00 O ATOM 785 CB LEU A 376 -12.541 15.728 6.422 1.00 0.00 C ATOM 786 CG LEU A 376 -12.076 14.576 5.531 1.00 0.00 C ATOM 787 CD1 LEU A 376 -12.705 14.693 4.153 1.00 0.00 C ATOM 788 CD2 LEU A 376 -10.556 14.561 5.423 1.00 0.00 C ATOM 0 H LEU A 376 -12.115 13.961 9.017 1.00 0.00 H new ATOM 0 HA LEU A 376 -10.958 15.445 7.827 1.00 0.00 H new ATOM 0 HB2 LEU A 376 -13.630 15.717 6.457 1.00 0.00 H new ATOM 0 HB3 LEU A 376 -12.247 16.666 5.951 1.00 0.00 H new ATOM 0 HG LEU A 376 -12.396 13.637 5.983 1.00 0.00 H new ATOM 0 HD11 LEU A 376 -12.367 13.867 3.527 1.00 0.00 H new ATOM 0 HD12 LEU A 376 -13.791 14.658 4.244 1.00 0.00 H new ATOM 0 HD13 LEU A 376 -12.410 15.638 3.697 1.00 0.00 H new ATOM 0 HD21 LEU A 376 -10.245 13.734 4.785 1.00 0.00 H new ATOM 0 HD22 LEU A 376 -10.213 15.501 4.992 1.00 0.00 H new ATOM 0 HD23 LEU A 376 -10.122 14.437 6.415 1.00 0.00 H new ATOM 800 N GLY A 377 -12.228 17.140 9.801 1.00 0.00 N ATOM 801 CA GLY A 377 -12.334 18.386 10.500 1.00 0.00 C ATOM 802 C GLY A 377 -11.032 18.774 11.150 1.00 0.00 C ATOM 803 O GLY A 377 -10.021 18.102 10.964 1.00 0.00 O ATOM 0 H GLY A 377 -12.241 16.313 10.398 1.00 0.00 H new ATOM 0 HA2 GLY A 377 -12.641 19.168 9.805 1.00 0.00 H new ATOM 0 HA3 GLY A 377 -13.112 18.312 11.260 1.00 0.00 H new ATOM 807 N PRO A 378 -11.033 19.848 11.931 1.00 0.00 N ATOM 808 CA PRO A 378 -9.832 20.326 12.605 1.00 0.00 C ATOM 809 C PRO A 378 -9.402 19.378 13.717 1.00 0.00 C ATOM 810 O PRO A 378 -10.214 18.966 14.545 1.00 0.00 O ATOM 811 CB PRO A 378 -10.262 21.677 13.182 1.00 0.00 C ATOM 812 CG PRO A 378 -11.741 21.576 13.329 1.00 0.00 C ATOM 813 CD PRO A 378 -12.213 20.666 12.233 1.00 0.00 C ATOM 0 HA PRO A 378 -8.976 20.396 11.934 1.00 0.00 H new ATOM 0 HB2 PRO A 378 -9.781 21.868 14.142 1.00 0.00 H new ATOM 0 HB3 PRO A 378 -9.986 22.496 12.518 1.00 0.00 H new ATOM 0 HG2 PRO A 378 -12.008 21.177 14.308 1.00 0.00 H new ATOM 0 HG3 PRO A 378 -12.208 22.558 13.247 1.00 0.00 H new ATOM 0 HD2 PRO A 378 -13.054 20.052 12.556 1.00 0.00 H new ATOM 0 HD3 PRO A 378 -12.545 21.228 11.360 1.00 0.00 H new ATOM 821 N TRP A 379 -8.133 19.035 13.732 1.00 0.00 N ATOM 822 CA TRP A 379 -7.591 18.120 14.724 1.00 0.00 C ATOM 823 C TRP A 379 -7.553 18.754 16.115 1.00 0.00 C ATOM 824 O TRP A 379 -7.592 18.054 17.128 1.00 0.00 O ATOM 825 CB TRP A 379 -6.185 17.669 14.314 1.00 0.00 C ATOM 826 CG TRP A 379 -5.525 16.793 15.327 1.00 0.00 C ATOM 827 CD1 TRP A 379 -4.458 17.109 16.114 1.00 0.00 C ATOM 828 CD2 TRP A 379 -5.908 15.464 15.682 1.00 0.00 C ATOM 829 NE1 TRP A 379 -4.145 16.051 16.927 1.00 0.00 N ATOM 830 CE2 TRP A 379 -5.023 15.026 16.681 1.00 0.00 C ATOM 831 CE3 TRP A 379 -6.914 14.601 15.248 1.00 0.00 C ATOM 832 CZ2 TRP A 379 -5.114 13.762 17.254 1.00 0.00 C ATOM 833 CZ3 TRP A 379 -7.005 13.351 15.814 1.00 0.00 C ATOM 834 CH2 TRP A 379 -6.110 12.940 16.808 1.00 0.00 C ATOM 0 H TRP A 379 -7.446 19.379 13.061 1.00 0.00 H new ATOM 0 HA TRP A 379 -8.250 17.253 14.770 1.00 0.00 H new ATOM 0 HB2 TRP A 379 -6.245 17.134 13.366 1.00 0.00 H new ATOM 0 HB3 TRP A 379 -5.564 18.549 14.145 1.00 0.00 H new ATOM 0 HD1 TRP A 379 -3.936 18.054 16.099 1.00 0.00 H new ATOM 0 HE1 TRP A 379 -3.383 16.029 17.605 1.00 0.00 H new ATOM 0 HE3 TRP A 379 -7.609 14.909 14.481 1.00 0.00 H new ATOM 0 HZ2 TRP A 379 -4.424 13.443 18.021 1.00 0.00 H new ATOM 0 HZ3 TRP A 379 -7.781 12.675 15.486 1.00 0.00 H new ATOM 0 HH2 TRP A 379 -6.209 11.952 17.232 1.00 0.00 H new ATOM 845 N GLU A 380 -7.494 20.072 16.152 1.00 0.00 N ATOM 846 CA GLU A 380 -7.392 20.816 17.411 1.00 0.00 C ATOM 847 C GLU A 380 -8.453 20.380 18.469 1.00 0.00 C ATOM 848 O GLU A 380 -8.082 19.959 19.566 1.00 0.00 O ATOM 849 CB GLU A 380 -7.467 22.323 17.151 1.00 0.00 C ATOM 850 CG GLU A 380 -6.443 22.819 16.150 1.00 0.00 C ATOM 851 CD GLU A 380 -6.587 24.291 15.858 1.00 0.00 C ATOM 852 OE1 GLU A 380 -7.438 24.659 15.028 1.00 0.00 O ATOM 853 OE2 GLU A 380 -5.851 25.095 16.461 1.00 0.00 O1- ATOM 0 H GLU A 380 -7.515 20.662 15.320 1.00 0.00 H new ATOM 0 HA GLU A 380 -6.419 20.575 17.838 1.00 0.00 H new ATOM 0 HB2 GLU A 380 -8.465 22.571 16.790 1.00 0.00 H new ATOM 0 HB3 GLU A 380 -7.328 22.853 18.093 1.00 0.00 H new ATOM 0 HG2 GLU A 380 -5.441 22.624 16.533 1.00 0.00 H new ATOM 0 HG3 GLU A 380 -6.545 22.256 15.222 1.00 0.00 H new ATOM 860 N PRO A 381 -9.784 20.454 18.155 1.00 0.00 N ATOM 861 CA PRO A 381 -10.847 20.071 19.114 1.00 0.00 C ATOM 862 C PRO A 381 -10.912 18.560 19.392 1.00 0.00 C ATOM 863 O PRO A 381 -11.748 18.103 20.168 1.00 0.00 O ATOM 864 CB PRO A 381 -12.134 20.525 18.412 1.00 0.00 C ATOM 865 CG PRO A 381 -11.797 20.505 16.968 1.00 0.00 C ATOM 866 CD PRO A 381 -10.360 20.925 16.877 1.00 0.00 C ATOM 0 HA PRO A 381 -10.674 20.524 20.090 1.00 0.00 H new ATOM 0 HB2 PRO A 381 -12.965 19.856 18.635 1.00 0.00 H new ATOM 0 HB3 PRO A 381 -12.432 21.522 18.736 1.00 0.00 H new ATOM 0 HG2 PRO A 381 -11.941 19.510 16.547 1.00 0.00 H new ATOM 0 HG3 PRO A 381 -12.439 21.184 16.407 1.00 0.00 H new ATOM 0 HD2 PRO A 381 -9.862 20.471 16.020 1.00 0.00 H new ATOM 0 HD3 PRO A 381 -10.263 22.005 16.766 1.00 0.00 H new ATOM 874 N HIS A 382 -10.032 17.792 18.762 1.00 0.00 N ATOM 875 CA HIS A 382 -10.027 16.340 18.942 1.00 0.00 C ATOM 876 C HIS A 382 -9.205 15.916 20.145 1.00 0.00 C ATOM 877 O HIS A 382 -9.054 14.721 20.411 1.00 0.00 O ATOM 878 CB HIS A 382 -9.543 15.630 17.682 1.00 0.00 C ATOM 879 CG HIS A 382 -10.572 15.588 16.605 1.00 0.00 C ATOM 880 ND1 HIS A 382 -10.847 16.634 15.760 1.00 0.00 N ATOM 881 CD2 HIS A 382 -11.423 14.596 16.260 1.00 0.00 C ATOM 882 CE1 HIS A 382 -11.839 16.263 14.950 1.00 0.00 C ATOM 883 NE2 HIS A 382 -12.228 15.027 15.210 1.00 0.00 N ATOM 0 H HIS A 382 -9.316 18.144 18.126 1.00 0.00 H new ATOM 0 HA HIS A 382 -11.058 16.042 19.131 1.00 0.00 H new ATOM 0 HB2 HIS A 382 -8.653 16.135 17.307 1.00 0.00 H new ATOM 0 HB3 HIS A 382 -9.249 14.612 17.936 1.00 0.00 H new ATOM 0 HD1 HIS A 382 -10.375 17.538 15.753 1.00 0.00 H new ATOM 0 HD2 HIS A 382 -11.471 13.623 16.726 1.00 0.00 H new ATOM 0 HE1 HIS A 382 -12.268 16.890 14.182 1.00 0.00 H new ATOM 891 N GLY A 383 -8.672 16.883 20.863 1.00 0.00 N ATOM 892 CA GLY A 383 -7.937 16.580 22.068 1.00 0.00 C ATOM 893 C GLY A 383 -8.864 16.520 23.258 1.00 0.00 C ATOM 894 O GLY A 383 -9.967 15.964 23.164 1.00 0.00 O ATOM 0 H GLY A 383 -8.734 17.875 20.634 1.00 0.00 H new ATOM 0 HA2 GLY A 383 -7.420 15.627 21.955 1.00 0.00 H new ATOM 0 HA3 GLY A 383 -7.173 17.339 22.234 1.00 0.00 H new ATOM 898 N SER A 384 -8.441 17.076 24.367 1.00 0.00 N ATOM 899 CA SER A 384 -9.277 17.123 25.543 1.00 0.00 C ATOM 900 C SER A 384 -10.190 18.343 25.479 1.00 0.00 C ATOM 901 O SER A 384 -9.822 19.435 25.922 1.00 0.00 O ATOM 902 CB SER A 384 -8.418 17.160 26.802 1.00 0.00 C ATOM 903 OG SER A 384 -7.552 16.035 26.860 1.00 0.00 O ATOM 0 H SER A 384 -7.522 17.503 24.481 1.00 0.00 H new ATOM 0 HA SER A 384 -9.894 16.225 25.578 1.00 0.00 H new ATOM 0 HB2 SER A 384 -7.830 18.078 26.819 1.00 0.00 H new ATOM 0 HB3 SER A 384 -9.059 17.176 27.684 1.00 0.00 H new ATOM 0 HG SER A 384 -7.010 16.081 27.675 1.00 0.00 H new ATOM 909 N ALA A 385 -11.368 18.159 24.899 1.00 0.00 N ATOM 910 CA ALA A 385 -12.308 19.250 24.724 1.00 0.00 C ATOM 911 C ALA A 385 -13.741 18.738 24.679 1.00 0.00 C ATOM 912 O ALA A 385 -13.998 17.559 24.909 1.00 0.00 O ATOM 913 CB ALA A 385 -11.981 20.021 23.448 1.00 0.00 C ATOM 0 H ALA A 385 -11.693 17.261 24.542 1.00 0.00 H new ATOM 0 HA ALA A 385 -12.217 19.920 25.579 1.00 0.00 H new ATOM 0 HB1 ALA A 385 -12.692 20.838 23.324 1.00 0.00 H new ATOM 0 HB2 ALA A 385 -10.971 20.425 23.516 1.00 0.00 H new ATOM 0 HB3 ALA A 385 -12.046 19.351 22.591 1.00 0.00 H new ATOM 919 N TRP A 386 -14.664 19.639 24.372 1.00 0.00 N ATOM 920 CA TRP A 386 -16.095 19.325 24.286 1.00 0.00 C ATOM 921 C TRP A 386 -16.391 18.456 23.066 1.00 0.00 C ATOM 922 O TRP A 386 -17.392 17.742 23.014 1.00 0.00 O ATOM 923 CB TRP A 386 -16.892 20.633 24.151 1.00 0.00 C ATOM 924 CG TRP A 386 -16.678 21.318 22.821 1.00 0.00 C ATOM 925 CD1 TRP A 386 -15.628 22.112 22.461 1.00 0.00 C ATOM 926 CD2 TRP A 386 -17.531 21.244 21.669 1.00 0.00 C ATOM 927 NE1 TRP A 386 -15.778 22.538 21.167 1.00 0.00 N ATOM 928 CE2 TRP A 386 -16.937 22.020 20.659 1.00 0.00 C ATOM 929 CE3 TRP A 386 -18.739 20.595 21.398 1.00 0.00 C ATOM 930 CZ2 TRP A 386 -17.507 22.165 19.399 1.00 0.00 C ATOM 931 CZ3 TRP A 386 -19.303 20.740 20.147 1.00 0.00 C ATOM 932 CH2 TRP A 386 -18.688 21.519 19.163 1.00 0.00 C ATOM 0 H TRP A 386 -14.446 20.615 24.173 1.00 0.00 H new ATOM 0 HA TRP A 386 -16.381 18.785 25.189 1.00 0.00 H new ATOM 0 HB2 TRP A 386 -17.954 20.420 24.278 1.00 0.00 H new ATOM 0 HB3 TRP A 386 -16.605 21.312 24.954 1.00 0.00 H new ATOM 0 HD1 TRP A 386 -14.798 22.368 23.103 1.00 0.00 H new ATOM 0 HE1 TRP A 386 -15.130 23.144 20.664 1.00 0.00 H new ATOM 0 HE3 TRP A 386 -19.221 19.992 22.153 1.00 0.00 H new ATOM 0 HZ2 TRP A 386 -17.034 22.765 18.636 1.00 0.00 H new ATOM 0 HZ3 TRP A 386 -20.236 20.243 19.924 1.00 0.00 H new ATOM 0 HH2 TRP A 386 -19.157 21.613 18.194 1.00 0.00 H new ATOM 943 N TYR A 387 -15.515 18.540 22.093 1.00 0.00 N ATOM 944 CA TYR A 387 -15.704 17.886 20.824 1.00 0.00 C ATOM 945 C TYR A 387 -15.313 16.412 20.889 1.00 0.00 C ATOM 946 O TYR A 387 -14.278 16.057 21.460 1.00 0.00 O ATOM 947 CB TYR A 387 -14.878 18.621 19.772 1.00 0.00 C ATOM 948 CG TYR A 387 -15.224 18.279 18.341 1.00 0.00 C ATOM 949 CD1 TYR A 387 -16.284 18.901 17.697 1.00 0.00 C ATOM 950 CD2 TYR A 387 -14.482 17.346 17.631 1.00 0.00 C ATOM 951 CE1 TYR A 387 -16.595 18.604 16.384 1.00 0.00 C ATOM 952 CE2 TYR A 387 -14.788 17.043 16.320 1.00 0.00 C ATOM 953 CZ TYR A 387 -15.844 17.672 15.701 1.00 0.00 C ATOM 954 OH TYR A 387 -16.143 17.375 14.389 1.00 0.00 O ATOM 0 H TYR A 387 -14.645 19.068 22.162 1.00 0.00 H new ATOM 0 HA TYR A 387 -16.760 17.920 20.557 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -15.005 19.694 19.915 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -13.824 18.400 19.939 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -16.876 19.630 18.231 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -13.652 16.849 18.112 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -17.421 19.099 15.896 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -14.200 16.314 15.781 1.00 0.00 H new ATOM 0 HH TYR A 387 -15.517 16.699 14.056 1.00 0.00 H new ATOM 964 N ASN A 388 -16.153 15.567 20.319 1.00 0.00 N ATOM 965 CA ASN A 388 -15.899 14.134 20.272 1.00 0.00 C ATOM 966 C ASN A 388 -16.105 13.626 18.858 1.00 0.00 C ATOM 967 O ASN A 388 -17.084 13.985 18.199 1.00 0.00 O ATOM 968 CB ASN A 388 -16.819 13.380 21.247 1.00 0.00 C ATOM 969 CG ASN A 388 -16.622 11.868 21.198 1.00 0.00 C ATOM 970 OD1 ASN A 388 -15.744 11.326 21.866 1.00 0.00 O ATOM 971 ND2 ASN A 388 -17.445 11.182 20.424 1.00 0.00 N ATOM 0 H ASN A 388 -17.027 15.851 19.877 1.00 0.00 H new ATOM 0 HA ASN A 388 -14.867 13.954 20.574 1.00 0.00 H new ATOM 0 HB2 ASN A 388 -16.633 13.733 22.261 1.00 0.00 H new ATOM 0 HB3 ASN A 388 -17.858 13.614 21.014 1.00 0.00 H new ATOM 0 HD21 ASN A 388 -17.364 10.167 20.366 1.00 0.00 H new ATOM 0 HD22 ASN A 388 -18.161 11.668 19.884 1.00 0.00 H new ATOM 978 N CYS A 389 -15.185 12.809 18.386 1.00 0.00 N ATOM 979 CA CYS A 389 -15.278 12.273 17.045 1.00 0.00 C ATOM 980 C CYS A 389 -15.845 10.866 17.078 1.00 0.00 C ATOM 981 O CYS A 389 -15.688 10.141 18.062 1.00 0.00 O ATOM 982 CB CYS A 389 -13.908 12.279 16.375 1.00 0.00 C ATOM 983 SG CYS A 389 -13.950 11.992 14.580 1.00 0.00 S ATOM 0 H CYS A 389 -14.366 12.503 18.911 1.00 0.00 H new ATOM 0 HA CYS A 389 -15.950 12.904 16.464 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -13.427 13.238 16.566 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -13.287 11.513 16.839 1.00 0.00 H new ATOM 988 N ASN A 390 -16.491 10.485 16.007 1.00 0.00 N ATOM 989 CA ASN A 390 -17.107 9.181 15.917 1.00 0.00 C ATOM 990 C ASN A 390 -16.437 8.346 14.845 1.00 0.00 C ATOM 991 O ASN A 390 -16.683 8.520 13.650 1.00 0.00 O ATOM 992 CB ASN A 390 -18.609 9.311 15.655 1.00 0.00 C ATOM 993 CG ASN A 390 -19.364 9.809 16.876 1.00 0.00 C ATOM 994 OD1 ASN A 390 -19.491 11.012 17.098 1.00 0.00 O ATOM 995 ND2 ASN A 390 -19.887 8.888 17.664 1.00 0.00 N ATOM 0 H ASN A 390 -16.606 11.064 15.175 1.00 0.00 H new ATOM 0 HA ASN A 390 -16.975 8.671 16.871 1.00 0.00 H new ATOM 0 HB2 ASN A 390 -18.773 9.997 14.824 1.00 0.00 H new ATOM 0 HB3 ASN A 390 -19.008 8.343 15.353 1.00 0.00 H new ATOM 0 HD21 ASN A 390 -20.418 9.165 18.490 1.00 0.00 H new ATOM 0 HD22 ASN A 390 -19.760 7.899 17.447 1.00 0.00 H new ATOM 1002 N ARG A 391 -15.580 7.439 15.284 1.00 0.00 N ATOM 1003 CA ARG A 391 -14.827 6.587 14.376 1.00 0.00 C ATOM 1004 C ARG A 391 -15.607 5.325 14.051 1.00 0.00 C ATOM 1005 O ARG A 391 -15.806 4.983 12.890 1.00 0.00 O ATOM 1006 CB ARG A 391 -13.479 6.171 14.994 1.00 0.00 C ATOM 1007 CG ARG A 391 -12.575 7.303 15.451 1.00 0.00 C ATOM 1008 CD ARG A 391 -12.928 7.787 16.851 1.00 0.00 C ATOM 1009 NE ARG A 391 -11.903 8.702 17.370 1.00 0.00 N ATOM 1010 CZ ARG A 391 -11.999 9.426 18.491 1.00 0.00 C ATOM 1011 NH1 ARG A 391 -13.105 9.401 19.222 1.00 0.00 N1+ ATOM 1012 NH2 ARG A 391 -10.980 10.190 18.867 1.00 0.00 N ATOM 0 H ARG A 391 -15.387 7.273 16.272 1.00 0.00 H new ATOM 0 HA ARG A 391 -14.653 7.164 13.468 1.00 0.00 H new ATOM 0 HB2 ARG A 391 -13.678 5.525 15.849 1.00 0.00 H new ATOM 0 HB3 ARG A 391 -12.936 5.573 14.262 1.00 0.00 H new ATOM 0 HG2 ARG A 391 -11.538 6.968 15.434 1.00 0.00 H new ATOM 0 HG3 ARG A 391 -12.653 8.134 14.750 1.00 0.00 H new ATOM 0 HD2 ARG A 391 -13.894 8.292 16.831 1.00 0.00 H new ATOM 0 HD3 ARG A 391 -13.029 6.932 17.520 1.00 0.00 H new ATOM 0 HE ARG A 391 -11.043 8.793 16.829 1.00 0.00 H new ATOM 0 HH11 ARG A 391 -13.895 8.825 18.932 1.00 0.00 H new ATOM 0 HH12 ARG A 391 -13.165 9.958 20.075 1.00 0.00 H new ATOM 0 HH21 ARG A 391 -10.131 10.222 18.302 1.00 0.00 H new ATOM 0 HH22 ARG A 391 -11.046 10.745 19.720 1.00 0.00 H new ATOM 1026 N TYR A 392 -16.046 4.643 15.089 1.00 0.00 N ATOM 1027 CA TYR A 392 -16.723 3.361 14.942 1.00 0.00 C ATOM 1028 C TYR A 392 -18.133 3.392 15.527 1.00 0.00 C ATOM 1029 O TYR A 392 -19.024 2.677 15.067 1.00 0.00 O ATOM 1030 CB TYR A 392 -15.883 2.254 15.603 1.00 0.00 C ATOM 1031 CG TYR A 392 -15.484 2.549 17.045 1.00 0.00 C ATOM 1032 CD1 TYR A 392 -14.424 3.408 17.339 1.00 0.00 C ATOM 1033 CD2 TYR A 392 -16.167 1.973 18.104 1.00 0.00 C ATOM 1034 CE1 TYR A 392 -14.065 3.677 18.639 1.00 0.00 C ATOM 1035 CE2 TYR A 392 -15.812 2.238 19.411 1.00 0.00 C ATOM 1036 CZ TYR A 392 -14.761 3.089 19.673 1.00 0.00 C ATOM 1037 OH TYR A 392 -14.406 3.353 20.974 1.00 0.00 O ATOM 0 H TYR A 392 -15.947 4.955 16.055 1.00 0.00 H new ATOM 0 HA TYR A 392 -16.824 3.150 13.877 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -16.447 1.321 15.577 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -14.980 2.097 15.013 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -13.876 3.870 16.531 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -16.992 1.305 17.903 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -13.243 4.345 18.848 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -16.356 1.780 20.224 1.00 0.00 H new ATOM 0 HH TYR A 392 -14.997 2.860 21.581 1.00 0.00 H new ATOM 1047 N ASN A 393 -18.325 4.214 16.538 1.00 0.00 N ATOM 1048 CA ASN A 393 -19.624 4.345 17.179 1.00 0.00 C ATOM 1049 C ASN A 393 -20.424 5.453 16.507 1.00 0.00 C ATOM 1050 O ASN A 393 -19.875 6.507 16.190 1.00 0.00 O ATOM 1051 CB ASN A 393 -19.447 4.630 18.676 1.00 0.00 C ATOM 1052 CG ASN A 393 -20.763 4.803 19.405 1.00 0.00 C ATOM 1053 OD1 ASN A 393 -21.267 5.914 19.536 1.00 0.00 O ATOM 1054 ND2 ASN A 393 -21.322 3.711 19.884 1.00 0.00 N ATOM 0 H ASN A 393 -17.596 4.805 16.937 1.00 0.00 H new ATOM 0 HA ASN A 393 -20.173 3.409 17.072 1.00 0.00 H new ATOM 0 HB2 ASN A 393 -18.890 3.812 19.133 1.00 0.00 H new ATOM 0 HB3 ASN A 393 -18.848 5.532 18.800 1.00 0.00 H new ATOM 0 HD21 ASN A 393 -22.208 3.770 20.386 1.00 0.00 H new ATOM 0 HD22 ASN A 393 -20.869 2.807 19.753 1.00 0.00 H new ATOM 1061 N GLU A 394 -21.706 5.201 16.280 1.00 0.00 N ATOM 1062 CA GLU A 394 -22.588 6.157 15.602 1.00 0.00 C ATOM 1063 C GLU A 394 -22.733 7.448 16.400 1.00 0.00 C ATOM 1064 O GLU A 394 -22.852 7.419 17.628 1.00 0.00 O ATOM 1065 CB GLU A 394 -23.990 5.564 15.380 1.00 0.00 C ATOM 1066 CG GLU A 394 -24.018 4.137 14.857 1.00 0.00 C ATOM 1067 CD GLU A 394 -23.829 3.115 15.956 1.00 0.00 C ATOM 1068 OE1 GLU A 394 -24.822 2.765 16.626 1.00 0.00 O ATOM 1069 OE2 GLU A 394 -22.695 2.668 16.166 1.00 0.00 O1- ATOM 0 H GLU A 394 -22.167 4.334 16.557 1.00 0.00 H new ATOM 0 HA GLU A 394 -22.125 6.375 14.640 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -24.534 5.598 16.324 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -24.529 6.201 14.678 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -24.969 3.955 14.356 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -23.235 4.012 14.110 1.00 0.00 H new ATOM 1076 N ASP A 395 -22.741 8.572 15.700 1.00 0.00 N ATOM 1077 CA ASP A 395 -22.927 9.866 16.341 1.00 0.00 C ATOM 1078 C ASP A 395 -24.364 9.990 16.796 1.00 0.00 C ATOM 1079 O ASP A 395 -24.657 10.516 17.870 1.00 0.00 O ATOM 1080 CB ASP A 395 -22.577 11.003 15.378 1.00 0.00 C ATOM 1081 CG ASP A 395 -22.923 12.366 15.940 1.00 0.00 C ATOM 1082 OD1 ASP A 395 -22.080 12.954 16.651 1.00 0.00 O ATOM 1083 OD2 ASP A 395 -24.043 12.852 15.683 1.00 0.00 O1- ATOM 0 H ASP A 395 -22.621 8.615 14.688 1.00 0.00 H new ATOM 0 HA ASP A 395 -22.262 9.938 17.202 1.00 0.00 H new ATOM 0 HB2 ASP A 395 -21.512 10.967 15.150 1.00 0.00 H new ATOM 0 HB3 ASP A 395 -23.109 10.855 14.438 1.00 0.00 H new ATOM 1088 N ASP A 396 -25.251 9.487 15.970 1.00 0.00 N ATOM 1089 CA ASP A 396 -26.662 9.468 16.262 1.00 0.00 C ATOM 1090 C ASP A 396 -27.033 8.136 16.873 1.00 0.00 C ATOM 1091 O ASP A 396 -27.129 7.148 16.120 1.00 0.00 O ATOM 1092 CB ASP A 396 -27.467 9.698 14.989 1.00 0.00 C ATOM 1093 CG ASP A 396 -28.957 9.528 15.198 1.00 0.00 C ATOM 1094 OD1 ASP A 396 -29.597 10.469 15.706 1.00 0.00 O ATOM 1095 OD2 ASP A 396 -29.501 8.460 14.835 1.00 0.00 O1- ATOM 1096 OXT ASP A 396 -27.206 8.068 18.111 1.00 0.00 O ATOM 0 H ASP A 396 -25.010 9.076 15.068 1.00 0.00 H new ATOM 0 HA ASP A 396 -26.891 10.266 16.968 1.00 0.00 H new ATOM 0 HB2 ASP A 396 -27.269 10.703 14.616 1.00 0.00 H new ATOM 0 HB3 ASP A 396 -27.131 9.001 14.221 1.00 0.00 H new TER 1101 ASP A 396 HETATM 1102 ZN ZN A 401 -3.222 20.216 2.702 1.00 0.00 ZN HETATM 1103 ZN ZN A 402 -12.799 13.622 13.692 1.00 0.00 ZN