USER MOD reduce.3.24.130724 H: found=0, std=0, add=692, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 677 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 464 CYS SG : rot -168:sc= 0.926 USER MOD Set 1.2: A 467 CYS SG : rot 78:sc= -0.659 USER MOD Set 1.3: A 469 THR OG1 : rot 80:sc= 2.05 USER MOD Set 1.4: A 475 CYS SG : rot -106:sc= 0.902 USER MOD Set 1.5: A 479 HIS : no HE2:sc= -2 K(o=1.2,f=-11!) USER MOD Set 2.1: A 436 CYS SG : rot 145:sc= -0.664! USER MOD Set 2.2: A 439 CYS SG : rot -32:sc= 1.5 USER MOD Set 2.3: A 441 THR OG1 : rot -105:sc= 1.37 USER MOD Set 2.4: A 443 THR OG1 : rot 180:sc= 0 USER MOD Set 2.5: A 454 CYS SG : rot -140:sc= -1.43! USER MOD Set 2.6: A 459 CYS SG : rot 144:sc= -0.791 USER MOD Set 3.1: A 382 CYS SG : rot 153:sc= 0.761 USER MOD Set 3.2: A 384 ASN : amide:sc= -0.723 X(o=-0.5,f=-0.49) USER MOD Set 3.3: A 385 CYS SG : rot -38:sc= 0.606 USER MOD Set 3.4: A 390 HIS : no HD1:sc= 1.02 K(o=-0.5,f=-11!) USER MOD Set 3.5: A 394 CYS SG : rot -137:sc= -2.16! USER MOD Set 4.1: A 353 CYS SG : rot 131:sc= -0.738 USER MOD Set 4.2: A 355 GLN : amide:sc= -0.393 K(o=-0.31,f=-2.1) USER MOD Set 4.3: A 358 CYS SG : rot 177:sc= 0.305 USER MOD Set 4.4: A 360 MET CE :methyl -176:sc= -1.89! (180deg=-1.48!) USER MOD Set 4.5: A 373 CYS SG : rot 111:sc= 1.27 USER MOD Set 4.6: A 377 CYS SG : rot -22:sc= 1.14 USER MOD Single : A 368 CYS SG : rot 150:sc= 0 USER MOD Single : A 370 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 372 THR OG1 : rot 180:sc= -0.0728 USER MOD Single : A 374 GLN : amide:sc= -1.1 K(o=-1.1,f=-2.5!) USER MOD Single : A 375 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 379 TYR OH : rot 180:sc= 0 USER MOD Single : A 387 GLN : amide:sc= -0.0935 K(o=-0.094,f=-0.6) USER MOD Single : A 389 TYR OH : rot 180:sc= 0 USER MOD Single : A 432 SER OG : rot 180:sc= 0 USER MOD Single : A 433 THR OG1 : rot 180:sc= 0.0631 USER MOD Single : A 434 LYS NZ :NH3+ 142:sc= 1.26 (180deg=-0.142) USER MOD Single : A 438 LYS NZ :NH3+ 169:sc=-0.00696 (180deg=-0.166) USER MOD Single : A 449 CYS SG : rot -99:sc= 0.568 USER MOD Single : A 450 MET CE :methyl -160:sc= -0.225 (180deg=-0.845) USER MOD Single : A 451 HIS : no HD1:sc= 1.15 K(o=1.2,f=-3.8!) USER MOD Single : A 452 MET CE :methyl -118:sc= -1.65 (180deg=-3.11!) USER MOD Single : A 455 THR OG1 : rot 49:sc= 0.0681 USER MOD Single : A 468 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 472 THR OG1 : rot -78:sc= 1.25 USER MOD Single : A 476 MET CE :methyl 156:sc= -0.297 (180deg=-0.676) USER MOD ----------------------------------------------------------------- ATOM 123 N GLY A 350 61.101 -62.257 -4.212 1.00 0.00 N ATOM 124 CA GLY A 350 62.384 -61.610 -4.302 1.00 0.00 C ATOM 125 C GLY A 350 62.649 -61.028 -5.667 1.00 0.00 C ATOM 126 O GLY A 350 62.003 -61.396 -6.649 1.00 0.00 O ATOM 0 HA2 GLY A 350 62.439 -60.817 -3.557 1.00 0.00 H new ATOM 0 HA3 GLY A 350 63.167 -62.329 -4.060 1.00 0.00 H new ATOM 130 N VAL A 351 63.605 -60.129 -5.723 1.00 0.00 N ATOM 131 CA VAL A 351 63.995 -59.461 -6.941 1.00 0.00 C ATOM 132 C VAL A 351 65.464 -59.736 -7.235 1.00 0.00 C ATOM 133 O VAL A 351 66.107 -60.500 -6.531 1.00 0.00 O ATOM 134 CB VAL A 351 63.740 -57.936 -6.870 1.00 0.00 C ATOM 135 CG1 VAL A 351 62.250 -57.639 -6.762 1.00 0.00 C ATOM 136 CG2 VAL A 351 64.494 -57.307 -5.709 1.00 0.00 C ATOM 0 H VAL A 351 64.143 -59.837 -4.907 1.00 0.00 H new ATOM 0 HA VAL A 351 63.381 -59.857 -7.750 1.00 0.00 H new ATOM 0 HB VAL A 351 64.112 -57.495 -7.794 1.00 0.00 H new ATOM 0 HG11 VAL A 351 62.096 -56.561 -6.714 1.00 0.00 H new ATOM 0 HG12 VAL A 351 61.735 -58.040 -7.635 1.00 0.00 H new ATOM 0 HG13 VAL A 351 61.851 -58.103 -5.860 1.00 0.00 H new ATOM 0 HG21 VAL A 351 64.296 -56.235 -5.684 1.00 0.00 H new ATOM 0 HG22 VAL A 351 64.164 -57.759 -4.773 1.00 0.00 H new ATOM 0 HG23 VAL A 351 65.563 -57.475 -5.836 1.00 0.00 H new ATOM 146 N LEU A 352 65.963 -59.164 -8.291 1.00 0.00 N ATOM 147 CA LEU A 352 67.348 -59.354 -8.697 1.00 0.00 C ATOM 148 C LEU A 352 68.026 -58.009 -8.874 1.00 0.00 C ATOM 149 O LEU A 352 67.370 -57.017 -9.204 1.00 0.00 O ATOM 150 CB LEU A 352 67.397 -60.120 -10.015 1.00 0.00 C ATOM 151 CG LEU A 352 66.993 -61.586 -9.944 1.00 0.00 C ATOM 152 CD1 LEU A 352 66.542 -62.070 -11.304 1.00 0.00 C ATOM 153 CD2 LEU A 352 68.154 -62.426 -9.445 1.00 0.00 C ATOM 0 H LEU A 352 65.430 -58.548 -8.905 1.00 0.00 H new ATOM 0 HA LEU A 352 67.868 -59.921 -7.925 1.00 0.00 H new ATOM 0 HB2 LEU A 352 66.746 -59.617 -10.730 1.00 0.00 H new ATOM 0 HB3 LEU A 352 68.411 -60.061 -10.411 1.00 0.00 H new ATOM 0 HG LEU A 352 66.163 -61.687 -9.245 1.00 0.00 H new ATOM 0 HD11 LEU A 352 66.256 -63.120 -11.240 1.00 0.00 H new ATOM 0 HD12 LEU A 352 65.687 -61.480 -11.635 1.00 0.00 H new ATOM 0 HD13 LEU A 352 67.358 -61.959 -12.019 1.00 0.00 H new ATOM 0 HD21 LEU A 352 67.852 -63.472 -9.399 1.00 0.00 H new ATOM 0 HD22 LEU A 352 68.998 -62.321 -10.127 1.00 0.00 H new ATOM 0 HD23 LEU A 352 68.447 -62.088 -8.451 1.00 0.00 H new ATOM 165 N CYS A 353 69.332 -57.977 -8.642 1.00 0.00 N ATOM 166 CA CYS A 353 70.118 -56.768 -8.823 1.00 0.00 C ATOM 167 C CYS A 353 69.995 -56.263 -10.255 1.00 0.00 C ATOM 168 O CYS A 353 70.019 -57.055 -11.208 1.00 0.00 O ATOM 169 CB CYS A 353 71.590 -57.037 -8.484 1.00 0.00 C ATOM 170 SG CYS A 353 72.684 -55.588 -8.655 1.00 0.00 S ATOM 0 H CYS A 353 69.871 -58.783 -8.325 1.00 0.00 H new ATOM 0 HA CYS A 353 69.735 -56.002 -8.149 1.00 0.00 H new ATOM 0 HB2 CYS A 353 71.652 -57.404 -7.460 1.00 0.00 H new ATOM 0 HB3 CYS A 353 71.959 -57.833 -9.131 1.00 0.00 H new ATOM 0 HG CYS A 353 73.407 -55.461 -7.582 1.00 0.00 H new ATOM 175 N PRO A 354 69.841 -54.950 -10.423 1.00 0.00 N ATOM 176 CA PRO A 354 69.728 -54.324 -11.739 1.00 0.00 C ATOM 177 C PRO A 354 71.021 -54.424 -12.540 1.00 0.00 C ATOM 178 O PRO A 354 71.018 -54.238 -13.760 1.00 0.00 O ATOM 179 CB PRO A 354 69.415 -52.861 -11.414 1.00 0.00 C ATOM 180 CG PRO A 354 69.936 -52.662 -10.038 1.00 0.00 C ATOM 181 CD PRO A 354 69.748 -53.965 -9.334 1.00 0.00 C ATOM 0 HA PRO A 354 68.971 -54.809 -12.355 1.00 0.00 H new ATOM 0 HB2 PRO A 354 69.897 -52.186 -12.122 1.00 0.00 H new ATOM 0 HB3 PRO A 354 68.344 -52.664 -11.464 1.00 0.00 H new ATOM 0 HG2 PRO A 354 70.988 -52.377 -10.057 1.00 0.00 H new ATOM 0 HG3 PRO A 354 69.398 -51.862 -9.529 1.00 0.00 H new ATOM 0 HD2 PRO A 354 70.515 -54.128 -8.577 1.00 0.00 H new ATOM 0 HD3 PRO A 354 68.784 -54.014 -8.828 1.00 0.00 H new ATOM 189 N GLN A 355 72.127 -54.715 -11.857 1.00 0.00 N ATOM 190 CA GLN A 355 73.410 -54.841 -12.521 1.00 0.00 C ATOM 191 C GLN A 355 73.456 -56.131 -13.334 1.00 0.00 C ATOM 192 O GLN A 355 73.275 -57.225 -12.793 1.00 0.00 O ATOM 193 CB GLN A 355 74.560 -54.813 -11.510 1.00 0.00 C ATOM 194 CG GLN A 355 75.940 -54.914 -12.152 1.00 0.00 C ATOM 195 CD GLN A 355 77.063 -54.995 -11.138 1.00 0.00 C ATOM 196 OE1 GLN A 355 77.466 -56.083 -10.726 1.00 0.00 O ATOM 197 NE2 GLN A 355 77.579 -53.855 -10.736 1.00 0.00 N ATOM 0 H GLN A 355 72.154 -54.866 -10.849 1.00 0.00 H new ATOM 0 HA GLN A 355 73.529 -53.991 -13.193 1.00 0.00 H new ATOM 0 HB2 GLN A 355 74.503 -53.890 -10.933 1.00 0.00 H new ATOM 0 HB3 GLN A 355 74.435 -55.636 -10.807 1.00 0.00 H new ATOM 0 HG2 GLN A 355 75.973 -55.795 -12.792 1.00 0.00 H new ATOM 0 HG3 GLN A 355 76.100 -54.048 -12.794 1.00 0.00 H new ATOM 0 HE21 GLN A 355 77.217 -52.974 -11.101 1.00 0.00 H new ATOM 0 HE22 GLN A 355 78.342 -53.851 -10.059 1.00 0.00 H new ATOM 206 N PRO A 356 73.682 -56.013 -14.653 1.00 0.00 N ATOM 207 CA PRO A 356 73.752 -57.168 -15.563 1.00 0.00 C ATOM 208 C PRO A 356 74.803 -58.192 -15.133 1.00 0.00 C ATOM 209 O PRO A 356 74.579 -59.401 -15.217 1.00 0.00 O ATOM 210 CB PRO A 356 74.154 -56.536 -16.899 1.00 0.00 C ATOM 211 CG PRO A 356 73.690 -55.129 -16.804 1.00 0.00 C ATOM 212 CD PRO A 356 73.869 -54.738 -15.370 1.00 0.00 C ATOM 0 HA PRO A 356 72.811 -57.718 -15.591 1.00 0.00 H new ATOM 0 HB2 PRO A 356 75.232 -56.588 -17.054 1.00 0.00 H new ATOM 0 HB3 PRO A 356 73.686 -57.052 -17.738 1.00 0.00 H new ATOM 0 HG2 PRO A 356 74.269 -54.481 -17.462 1.00 0.00 H new ATOM 0 HG3 PRO A 356 72.647 -55.040 -17.107 1.00 0.00 H new ATOM 0 HD2 PRO A 356 74.856 -54.313 -15.188 1.00 0.00 H new ATOM 0 HD3 PRO A 356 73.138 -53.990 -15.061 1.00 0.00 H new ATOM 220 N GLY A 357 75.939 -57.698 -14.662 1.00 0.00 N ATOM 221 CA GLY A 357 77.018 -58.575 -14.248 1.00 0.00 C ATOM 222 C GLY A 357 76.802 -59.189 -12.873 1.00 0.00 C ATOM 223 O GLY A 357 77.527 -60.103 -12.477 1.00 0.00 O ATOM 0 H GLY A 357 76.134 -56.702 -14.558 1.00 0.00 H new ATOM 0 HA2 GLY A 357 77.129 -59.374 -14.981 1.00 0.00 H new ATOM 0 HA3 GLY A 357 77.952 -58.013 -14.245 1.00 0.00 H new ATOM 227 N CYS A 358 75.808 -58.696 -12.148 1.00 0.00 N ATOM 228 CA CYS A 358 75.526 -59.196 -10.812 1.00 0.00 C ATOM 229 C CYS A 358 74.568 -60.370 -10.888 1.00 0.00 C ATOM 230 O CYS A 358 74.974 -61.529 -10.773 1.00 0.00 O ATOM 231 CB CYS A 358 74.925 -58.085 -9.948 1.00 0.00 C ATOM 232 SG CYS A 358 75.026 -58.372 -8.153 1.00 0.00 S ATOM 0 H CYS A 358 75.185 -57.952 -12.462 1.00 0.00 H new ATOM 0 HA CYS A 358 76.459 -59.529 -10.358 1.00 0.00 H new ATOM 0 HB2 CYS A 358 75.432 -57.149 -10.181 1.00 0.00 H new ATOM 0 HB3 CYS A 358 73.878 -57.957 -10.223 1.00 0.00 H new ATOM 0 HG CYS A 358 74.557 -57.337 -7.521 1.00 0.00 H new ATOM 237 N GLY A 359 73.300 -60.065 -11.108 1.00 0.00 N ATOM 238 CA GLY A 359 72.292 -61.093 -11.195 1.00 0.00 C ATOM 239 C GLY A 359 72.038 -61.772 -9.870 1.00 0.00 C ATOM 240 O GLY A 359 71.628 -62.934 -9.831 1.00 0.00 O ATOM 0 H GLY A 359 72.951 -59.114 -11.229 1.00 0.00 H new ATOM 0 HA2 GLY A 359 71.362 -60.655 -11.559 1.00 0.00 H new ATOM 0 HA3 GLY A 359 72.601 -61.839 -11.928 1.00 0.00 H new ATOM 244 N MET A 360 72.277 -61.062 -8.780 1.00 0.00 N ATOM 245 CA MET A 360 72.067 -61.600 -7.483 1.00 0.00 C ATOM 246 C MET A 360 70.638 -61.339 -7.057 1.00 0.00 C ATOM 247 O MET A 360 70.010 -60.385 -7.498 1.00 0.00 O ATOM 248 CB MET A 360 73.042 -60.988 -6.479 1.00 0.00 C ATOM 249 CG MET A 360 73.066 -61.698 -5.134 1.00 0.00 C ATOM 250 SD MET A 360 73.963 -60.779 -3.875 1.00 0.00 S ATOM 251 CE MET A 360 72.997 -59.276 -3.848 1.00 0.00 C ATOM 0 H MET A 360 72.620 -60.102 -8.789 1.00 0.00 H new ATOM 0 HA MET A 360 72.245 -62.675 -7.511 1.00 0.00 H new ATOM 0 HB2 MET A 360 74.045 -61.004 -6.905 1.00 0.00 H new ATOM 0 HB3 MET A 360 72.778 -59.942 -6.322 1.00 0.00 H new ATOM 0 HG2 MET A 360 72.043 -61.862 -4.797 1.00 0.00 H new ATOM 0 HG3 MET A 360 73.523 -62.680 -5.255 1.00 0.00 H new ATOM 0 HE1 MET A 360 73.458 -58.560 -3.168 1.00 0.00 H new ATOM 0 HE2 MET A 360 72.958 -58.851 -4.851 1.00 0.00 H new ATOM 0 HE3 MET A 360 71.985 -59.500 -3.509 1.00 0.00 H new ATOM 261 N GLY A 361 70.156 -62.181 -6.216 1.00 0.00 N ATOM 262 CA GLY A 361 68.809 -62.110 -5.743 1.00 0.00 C ATOM 263 C GLY A 361 68.672 -61.244 -4.526 1.00 0.00 C ATOM 264 O GLY A 361 69.219 -61.541 -3.465 1.00 0.00 O ATOM 0 H GLY A 361 70.692 -62.956 -5.826 1.00 0.00 H new ATOM 0 HA2 GLY A 361 68.169 -61.721 -6.535 1.00 0.00 H new ATOM 0 HA3 GLY A 361 68.455 -63.115 -5.512 1.00 0.00 H new ATOM 268 N LEU A 362 67.960 -60.176 -4.687 1.00 0.00 N ATOM 269 CA LEU A 362 67.688 -59.252 -3.620 1.00 0.00 C ATOM 270 C LEU A 362 66.358 -59.591 -2.979 1.00 0.00 C ATOM 271 O LEU A 362 65.366 -59.836 -3.667 1.00 0.00 O ATOM 272 CB LEU A 362 67.672 -57.818 -4.148 1.00 0.00 C ATOM 273 CG LEU A 362 69.027 -57.095 -4.234 1.00 0.00 C ATOM 274 CD1 LEU A 362 69.662 -56.973 -2.858 1.00 0.00 C ATOM 275 CD2 LEU A 362 69.967 -57.805 -5.195 1.00 0.00 C ATOM 0 H LEU A 362 67.541 -59.911 -5.578 1.00 0.00 H new ATOM 0 HA LEU A 362 68.476 -59.333 -2.871 1.00 0.00 H new ATOM 0 HB2 LEU A 362 67.228 -57.828 -5.144 1.00 0.00 H new ATOM 0 HB3 LEU A 362 67.012 -57.229 -3.511 1.00 0.00 H new ATOM 0 HG LEU A 362 68.845 -56.092 -4.619 1.00 0.00 H new ATOM 0 HD11 LEU A 362 70.619 -56.459 -2.943 1.00 0.00 H new ATOM 0 HD12 LEU A 362 69.002 -56.405 -2.202 1.00 0.00 H new ATOM 0 HD13 LEU A 362 69.821 -57.968 -2.441 1.00 0.00 H new ATOM 0 HD21 LEU A 362 70.917 -57.272 -5.236 1.00 0.00 H new ATOM 0 HD22 LEU A 362 70.138 -58.825 -4.850 1.00 0.00 H new ATOM 0 HD23 LEU A 362 69.521 -57.828 -6.189 1.00 0.00 H new ATOM 287 N LEU A 363 66.337 -59.606 -1.678 1.00 0.00 N ATOM 288 CA LEU A 363 65.140 -59.948 -0.942 1.00 0.00 C ATOM 289 C LEU A 363 64.370 -58.675 -0.620 1.00 0.00 C ATOM 290 O LEU A 363 64.967 -57.643 -0.309 1.00 0.00 O ATOM 291 CB LEU A 363 65.521 -60.715 0.345 1.00 0.00 C ATOM 292 CG LEU A 363 64.452 -61.653 0.962 1.00 0.00 C ATOM 293 CD1 LEU A 363 63.316 -60.874 1.603 1.00 0.00 C ATOM 294 CD2 LEU A 363 63.912 -62.623 -0.084 1.00 0.00 C ATOM 0 H LEU A 363 67.142 -59.383 -1.093 1.00 0.00 H new ATOM 0 HA LEU A 363 64.502 -60.596 -1.543 1.00 0.00 H new ATOM 0 HB2 LEU A 363 66.408 -61.311 0.131 1.00 0.00 H new ATOM 0 HB3 LEU A 363 65.803 -59.983 1.102 1.00 0.00 H new ATOM 0 HG LEU A 363 64.942 -62.226 1.749 1.00 0.00 H new ATOM 0 HD11 LEU A 363 62.589 -61.570 2.023 1.00 0.00 H new ATOM 0 HD12 LEU A 363 63.712 -60.240 2.396 1.00 0.00 H new ATOM 0 HD13 LEU A 363 62.831 -60.253 0.850 1.00 0.00 H new ATOM 0 HD21 LEU A 363 63.164 -63.271 0.372 1.00 0.00 H new ATOM 0 HD22 LEU A 363 63.457 -62.062 -0.900 1.00 0.00 H new ATOM 0 HD23 LEU A 363 64.729 -63.231 -0.473 1.00 0.00 H new ATOM 306 N VAL A 364 63.060 -58.736 -0.734 1.00 0.00 N ATOM 307 CA VAL A 364 62.230 -57.590 -0.445 1.00 0.00 C ATOM 308 C VAL A 364 61.456 -57.812 0.847 1.00 0.00 C ATOM 309 O VAL A 364 60.375 -58.409 0.843 1.00 0.00 O ATOM 310 CB VAL A 364 61.237 -57.291 -1.599 1.00 0.00 C ATOM 311 CG1 VAL A 364 60.441 -56.022 -1.317 1.00 0.00 C ATOM 312 CG2 VAL A 364 61.976 -57.177 -2.928 1.00 0.00 C ATOM 0 H VAL A 364 62.548 -59.569 -1.025 1.00 0.00 H new ATOM 0 HA VAL A 364 62.891 -56.730 -0.335 1.00 0.00 H new ATOM 0 HB VAL A 364 60.536 -58.123 -1.666 1.00 0.00 H new ATOM 0 HG11 VAL A 364 59.752 -55.834 -2.141 1.00 0.00 H new ATOM 0 HG12 VAL A 364 59.877 -56.144 -0.393 1.00 0.00 H new ATOM 0 HG13 VAL A 364 61.124 -55.179 -1.216 1.00 0.00 H new ATOM 0 HG21 VAL A 364 61.262 -56.967 -3.724 1.00 0.00 H new ATOM 0 HG22 VAL A 364 62.704 -56.368 -2.871 1.00 0.00 H new ATOM 0 HG23 VAL A 364 62.491 -58.114 -3.140 1.00 0.00 H new ATOM 322 N GLU A 365 62.036 -57.382 1.959 1.00 0.00 N ATOM 323 CA GLU A 365 61.378 -57.498 3.252 1.00 0.00 C ATOM 324 C GLU A 365 60.217 -56.511 3.330 1.00 0.00 C ATOM 325 O GLU A 365 60.292 -55.420 2.767 1.00 0.00 O ATOM 326 CB GLU A 365 62.351 -57.196 4.416 1.00 0.00 C ATOM 327 CG GLU A 365 63.640 -58.008 4.429 1.00 0.00 C ATOM 328 CD GLU A 365 64.704 -57.438 3.515 1.00 0.00 C ATOM 329 OE1 GLU A 365 65.175 -56.304 3.767 1.00 0.00 O ATOM 330 OE2 GLU A 365 65.085 -58.115 2.553 1.00 0.00 O1- ATOM 0 H GLU A 365 62.960 -56.950 1.991 1.00 0.00 H new ATOM 0 HA GLU A 365 61.022 -58.524 3.346 1.00 0.00 H new ATOM 0 HB2 GLU A 365 62.610 -56.138 4.383 1.00 0.00 H new ATOM 0 HB3 GLU A 365 61.827 -57.366 5.356 1.00 0.00 H new ATOM 0 HG2 GLU A 365 64.027 -58.050 5.447 1.00 0.00 H new ATOM 0 HG3 GLU A 365 63.421 -59.033 4.129 1.00 0.00 H new ATOM 337 N PRO A 366 59.126 -56.872 4.020 1.00 0.00 N ATOM 338 CA PRO A 366 58.003 -55.955 4.230 1.00 0.00 C ATOM 339 C PRO A 366 58.436 -54.775 5.101 1.00 0.00 C ATOM 340 O PRO A 366 57.836 -53.700 5.072 1.00 0.00 O ATOM 341 CB PRO A 366 56.960 -56.814 4.959 1.00 0.00 C ATOM 342 CG PRO A 366 57.736 -57.939 5.554 1.00 0.00 C ATOM 343 CD PRO A 366 58.887 -58.193 4.624 1.00 0.00 C ATOM 0 HA PRO A 366 57.622 -55.529 3.302 1.00 0.00 H new ATOM 0 HB2 PRO A 366 56.444 -56.240 5.728 1.00 0.00 H new ATOM 0 HB3 PRO A 366 56.199 -57.180 4.270 1.00 0.00 H new ATOM 0 HG2 PRO A 366 58.091 -57.682 6.552 1.00 0.00 H new ATOM 0 HG3 PRO A 366 57.115 -58.829 5.657 1.00 0.00 H new ATOM 0 HD2 PRO A 366 59.765 -58.557 5.159 1.00 0.00 H new ATOM 0 HD3 PRO A 366 58.640 -58.942 3.871 1.00 0.00 H new ATOM 351 N ASP A 367 59.497 -55.000 5.860 1.00 0.00 N ATOM 352 CA ASP A 367 60.077 -53.994 6.731 1.00 0.00 C ATOM 353 C ASP A 367 61.410 -53.519 6.166 1.00 0.00 C ATOM 354 O ASP A 367 62.263 -53.009 6.896 1.00 0.00 O ATOM 355 CB ASP A 367 60.278 -54.568 8.141 1.00 0.00 C ATOM 356 CG ASP A 367 61.199 -55.776 8.162 1.00 0.00 C ATOM 357 OD1 ASP A 367 60.819 -56.827 7.603 1.00 0.00 O1- ATOM 358 OD2 ASP A 367 62.299 -55.687 8.740 1.00 0.00 O ATOM 0 H ASP A 367 59.984 -55.896 5.888 1.00 0.00 H new ATOM 0 HA ASP A 367 59.396 -53.145 6.790 1.00 0.00 H new ATOM 0 HB2 ASP A 367 60.689 -53.793 8.788 1.00 0.00 H new ATOM 0 HB3 ASP A 367 59.310 -54.849 8.555 1.00 0.00 H new ATOM 363 N CYS A 368 61.580 -53.690 4.854 1.00 0.00 N ATOM 364 CA CYS A 368 62.800 -53.276 4.168 1.00 0.00 C ATOM 365 C CYS A 368 63.063 -51.797 4.398 1.00 0.00 C ATOM 366 O CYS A 368 62.204 -50.953 4.128 1.00 0.00 O ATOM 367 CB CYS A 368 62.698 -53.560 2.664 1.00 0.00 C ATOM 368 SG CYS A 368 64.153 -53.084 1.701 1.00 0.00 S ATOM 0 H CYS A 368 60.882 -54.115 4.244 1.00 0.00 H new ATOM 0 HA CYS A 368 63.631 -53.851 4.577 1.00 0.00 H new ATOM 0 HB2 CYS A 368 62.518 -54.626 2.521 1.00 0.00 H new ATOM 0 HB3 CYS A 368 61.829 -53.034 2.267 1.00 0.00 H new ATOM 0 HG CYS A 368 64.271 -53.873 0.675 1.00 0.00 H new ATOM 374 N ARG A 369 64.235 -51.495 4.915 1.00 0.00 N ATOM 375 CA ARG A 369 64.610 -50.121 5.182 1.00 0.00 C ATOM 376 C ARG A 369 65.141 -49.480 3.913 1.00 0.00 C ATOM 377 O ARG A 369 64.719 -48.392 3.528 1.00 0.00 O ATOM 378 CB ARG A 369 65.669 -50.061 6.291 1.00 0.00 C ATOM 379 CG ARG A 369 65.248 -50.743 7.587 1.00 0.00 C ATOM 380 CD ARG A 369 64.000 -50.106 8.174 1.00 0.00 C ATOM 381 NE ARG A 369 63.511 -50.828 9.348 1.00 0.00 N ATOM 382 CZ ARG A 369 62.250 -50.788 9.779 1.00 0.00 C ATOM 383 NH1 ARG A 369 61.358 -50.020 9.159 1.00 0.00 N1+ ATOM 384 NH2 ARG A 369 61.883 -51.502 10.836 1.00 0.00 N ATOM 0 H ARG A 369 64.947 -52.184 5.160 1.00 0.00 H new ATOM 0 HA ARG A 369 63.730 -49.573 5.518 1.00 0.00 H new ATOM 0 HB2 ARG A 369 66.586 -50.526 5.929 1.00 0.00 H new ATOM 0 HB3 ARG A 369 65.902 -49.017 6.501 1.00 0.00 H new ATOM 0 HG2 ARG A 369 65.063 -51.801 7.399 1.00 0.00 H new ATOM 0 HG3 ARG A 369 66.061 -50.685 8.310 1.00 0.00 H new ATOM 0 HD2 ARG A 369 64.216 -49.073 8.449 1.00 0.00 H new ATOM 0 HD3 ARG A 369 63.218 -50.077 7.415 1.00 0.00 H new ATOM 0 HE ARG A 369 64.177 -51.398 9.870 1.00 0.00 H new ATOM 0 HH11 ARG A 369 61.639 -49.461 8.353 1.00 0.00 H new ATOM 0 HH12 ARG A 369 60.393 -49.990 9.489 1.00 0.00 H new ATOM 0 HH21 ARG A 369 62.566 -52.083 11.321 1.00 0.00 H new ATOM 0 HH22 ARG A 369 60.917 -51.469 11.163 1.00 0.00 H new ATOM 398 N LYS A 370 66.052 -50.183 3.257 1.00 0.00 N ATOM 399 CA LYS A 370 66.671 -49.712 2.026 1.00 0.00 C ATOM 400 C LYS A 370 67.015 -50.893 1.146 1.00 0.00 C ATOM 401 O LYS A 370 67.794 -51.758 1.545 1.00 0.00 O ATOM 402 CB LYS A 370 67.967 -48.925 2.322 1.00 0.00 C ATOM 403 CG LYS A 370 67.772 -47.598 3.047 1.00 0.00 C ATOM 404 CD LYS A 370 67.064 -46.566 2.177 1.00 0.00 C ATOM 405 CE LYS A 370 67.898 -46.174 0.964 1.00 0.00 C ATOM 406 NZ LYS A 370 67.279 -45.056 0.210 1.00 0.00 N1+ ATOM 0 H LYS A 370 66.384 -51.098 3.563 1.00 0.00 H new ATOM 0 HA LYS A 370 65.962 -49.054 1.523 1.00 0.00 H new ATOM 0 HB2 LYS A 370 68.626 -49.554 2.921 1.00 0.00 H new ATOM 0 HB3 LYS A 370 68.479 -48.733 1.379 1.00 0.00 H new ATOM 0 HG2 LYS A 370 67.193 -47.764 3.955 1.00 0.00 H new ATOM 0 HG3 LYS A 370 68.742 -47.208 3.354 1.00 0.00 H new ATOM 0 HD2 LYS A 370 66.107 -46.968 1.844 1.00 0.00 H new ATOM 0 HD3 LYS A 370 66.848 -45.678 2.771 1.00 0.00 H new ATOM 0 HE2 LYS A 370 68.898 -45.885 1.288 1.00 0.00 H new ATOM 0 HE3 LYS A 370 68.013 -47.036 0.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 370 67.875 -44.817 -0.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 370 66.335 -45.341 -0.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 370 67.193 -44.225 0.830 1.00 0.00 H new ATOM 420 N VAL A 371 66.425 -50.956 -0.031 1.00 0.00 N ATOM 421 CA VAL A 371 66.763 -52.010 -0.961 1.00 0.00 C ATOM 422 C VAL A 371 67.995 -51.610 -1.757 1.00 0.00 C ATOM 423 O VAL A 371 67.971 -50.661 -2.553 1.00 0.00 O ATOM 424 CB VAL A 371 65.579 -52.379 -1.900 1.00 0.00 C ATOM 425 CG1 VAL A 371 64.907 -51.152 -2.458 1.00 0.00 C ATOM 426 CG2 VAL A 371 66.031 -53.310 -3.016 1.00 0.00 C ATOM 0 H VAL A 371 65.719 -50.299 -0.361 1.00 0.00 H new ATOM 0 HA VAL A 371 66.983 -52.909 -0.385 1.00 0.00 H new ATOM 0 HB VAL A 371 64.842 -52.909 -1.297 1.00 0.00 H new ATOM 0 HG11 VAL A 371 64.085 -51.451 -3.109 1.00 0.00 H new ATOM 0 HG12 VAL A 371 64.519 -50.546 -1.640 1.00 0.00 H new ATOM 0 HG13 VAL A 371 65.629 -50.570 -3.030 1.00 0.00 H new ATOM 0 HG21 VAL A 371 65.182 -53.550 -3.656 1.00 0.00 H new ATOM 0 HG22 VAL A 371 66.804 -52.820 -3.608 1.00 0.00 H new ATOM 0 HG23 VAL A 371 66.431 -54.228 -2.585 1.00 0.00 H new ATOM 436 N THR A 372 69.078 -52.307 -1.511 1.00 0.00 N ATOM 437 CA THR A 372 70.339 -52.012 -2.141 1.00 0.00 C ATOM 438 C THR A 372 71.183 -53.271 -2.227 1.00 0.00 C ATOM 439 O THR A 372 71.139 -54.118 -1.329 1.00 0.00 O ATOM 440 CB THR A 372 71.106 -50.934 -1.332 1.00 0.00 C ATOM 441 OG1 THR A 372 70.305 -49.753 -1.218 1.00 0.00 O ATOM 442 CG2 THR A 372 72.435 -50.582 -1.989 1.00 0.00 C ATOM 0 H THR A 372 69.108 -53.097 -0.866 1.00 0.00 H new ATOM 0 HA THR A 372 70.144 -51.635 -3.145 1.00 0.00 H new ATOM 0 HB THR A 372 71.312 -51.343 -0.343 1.00 0.00 H new ATOM 0 HG1 THR A 372 70.793 -49.075 -0.705 1.00 0.00 H new ATOM 0 HG21 THR A 372 72.945 -49.824 -1.395 1.00 0.00 H new ATOM 0 HG22 THR A 372 73.058 -51.474 -2.051 1.00 0.00 H new ATOM 0 HG23 THR A 372 72.254 -50.196 -2.992 1.00 0.00 H new ATOM 450 N CYS A 373 71.937 -53.406 -3.306 1.00 0.00 N ATOM 451 CA CYS A 373 72.817 -54.543 -3.467 1.00 0.00 C ATOM 452 C CYS A 373 74.049 -54.380 -2.584 1.00 0.00 C ATOM 453 O CYS A 373 75.147 -54.142 -3.063 1.00 0.00 O ATOM 454 CB CYS A 373 73.225 -54.709 -4.928 1.00 0.00 C ATOM 455 SG CYS A 373 74.053 -56.289 -5.293 1.00 0.00 S ATOM 0 H CYS A 373 71.955 -52.742 -4.080 1.00 0.00 H new ATOM 0 HA CYS A 373 72.281 -55.442 -3.161 1.00 0.00 H new ATOM 0 HB2 CYS A 373 72.337 -54.623 -5.554 1.00 0.00 H new ATOM 0 HB3 CYS A 373 73.890 -53.890 -5.204 1.00 0.00 H new ATOM 0 HG CYS A 373 73.275 -57.027 -6.028 1.00 0.00 H new ATOM 460 N GLN A 374 73.843 -54.481 -1.289 1.00 0.00 N ATOM 461 CA GLN A 374 74.924 -54.361 -0.327 1.00 0.00 C ATOM 462 C GLN A 374 75.641 -55.689 -0.162 1.00 0.00 C ATOM 463 O GLN A 374 76.664 -55.775 0.510 1.00 0.00 O ATOM 464 CB GLN A 374 74.386 -53.893 1.029 1.00 0.00 C ATOM 465 CG GLN A 374 73.891 -52.456 1.047 1.00 0.00 C ATOM 466 CD GLN A 374 74.992 -51.447 0.762 1.00 0.00 C ATOM 467 OE1 GLN A 374 74.739 -50.378 0.212 1.00 0.00 O ATOM 468 NE2 GLN A 374 76.213 -51.771 1.139 1.00 0.00 N ATOM 0 H GLN A 374 72.927 -54.648 -0.872 1.00 0.00 H new ATOM 0 HA GLN A 374 75.631 -53.621 -0.703 1.00 0.00 H new ATOM 0 HB2 GLN A 374 73.569 -54.550 1.328 1.00 0.00 H new ATOM 0 HB3 GLN A 374 75.173 -54.003 1.776 1.00 0.00 H new ATOM 0 HG2 GLN A 374 73.099 -52.341 0.307 1.00 0.00 H new ATOM 0 HG3 GLN A 374 73.451 -52.241 2.021 1.00 0.00 H new ATOM 0 HE21 GLN A 374 76.385 -52.668 1.593 1.00 0.00 H new ATOM 0 HE22 GLN A 374 76.985 -51.125 0.977 1.00 0.00 H new ATOM 477 N ASN A 375 75.102 -56.721 -0.785 1.00 0.00 N ATOM 478 CA ASN A 375 75.670 -58.055 -0.669 1.00 0.00 C ATOM 479 C ASN A 375 76.281 -58.502 -1.988 1.00 0.00 C ATOM 480 O ASN A 375 76.723 -59.639 -2.125 1.00 0.00 O ATOM 481 CB ASN A 375 74.605 -59.062 -0.205 1.00 0.00 C ATOM 482 CG ASN A 375 73.990 -58.691 1.137 1.00 0.00 C ATOM 483 OD1 ASN A 375 74.527 -59.021 2.194 1.00 0.00 O ATOM 484 ND2 ASN A 375 72.851 -58.018 1.104 1.00 0.00 N ATOM 0 H ASN A 375 74.273 -56.663 -1.376 1.00 0.00 H new ATOM 0 HA ASN A 375 76.461 -58.018 0.080 1.00 0.00 H new ATOM 0 HB2 ASN A 375 73.818 -59.124 -0.956 1.00 0.00 H new ATOM 0 HB3 ASN A 375 75.055 -60.052 -0.133 1.00 0.00 H new ATOM 0 HD21 ASN A 375 72.388 -57.755 1.974 1.00 0.00 H new ATOM 0 HD22 ASN A 375 72.436 -57.762 0.208 1.00 0.00 H new ATOM 491 N GLY A 376 76.308 -57.602 -2.952 1.00 0.00 N ATOM 492 CA GLY A 376 76.879 -57.922 -4.241 1.00 0.00 C ATOM 493 C GLY A 376 77.799 -56.832 -4.725 1.00 0.00 C ATOM 494 O GLY A 376 79.025 -56.966 -4.663 1.00 0.00 O ATOM 0 H GLY A 376 75.944 -56.653 -2.867 1.00 0.00 H new ATOM 0 HA2 GLY A 376 77.430 -58.860 -4.173 1.00 0.00 H new ATOM 0 HA3 GLY A 376 76.080 -58.073 -4.966 1.00 0.00 H new ATOM 498 N CYS A 377 77.215 -55.749 -5.189 1.00 0.00 N ATOM 499 CA CYS A 377 77.979 -54.617 -5.666 1.00 0.00 C ATOM 500 C CYS A 377 77.564 -53.349 -4.930 1.00 0.00 C ATOM 501 O CYS A 377 77.972 -53.117 -3.787 1.00 0.00 O ATOM 502 CB CYS A 377 77.807 -54.456 -7.185 1.00 0.00 C ATOM 503 SG CYS A 377 76.080 -54.546 -7.766 1.00 0.00 S ATOM 0 H CYS A 377 76.204 -55.628 -5.246 1.00 0.00 H new ATOM 0 HA CYS A 377 79.035 -54.796 -5.463 1.00 0.00 H new ATOM 0 HB2 CYS A 377 78.228 -53.497 -7.486 1.00 0.00 H new ATOM 0 HB3 CYS A 377 78.387 -55.230 -7.687 1.00 0.00 H new ATOM 0 HG CYS A 377 75.361 -55.188 -6.893 1.00 0.00 H new ATOM 508 N GLY A 378 76.781 -52.534 -5.591 1.00 0.00 N ATOM 509 CA GLY A 378 76.258 -51.343 -4.981 1.00 0.00 C ATOM 510 C GLY A 378 75.256 -50.664 -5.876 1.00 0.00 C ATOM 511 O GLY A 378 75.629 -50.074 -6.890 1.00 0.00 O ATOM 0 H GLY A 378 76.492 -52.677 -6.558 1.00 0.00 H new ATOM 0 HA2 GLY A 378 75.788 -51.595 -4.031 1.00 0.00 H new ATOM 0 HA3 GLY A 378 77.075 -50.656 -4.760 1.00 0.00 H new ATOM 515 N TYR A 379 73.986 -50.771 -5.532 1.00 0.00 N ATOM 516 CA TYR A 379 72.938 -50.123 -6.299 1.00 0.00 C ATOM 517 C TYR A 379 71.653 -50.056 -5.488 1.00 0.00 C ATOM 518 O TYR A 379 71.155 -51.084 -5.027 1.00 0.00 O ATOM 519 CB TYR A 379 72.687 -50.877 -7.612 1.00 0.00 C ATOM 520 CG TYR A 379 71.997 -50.050 -8.684 1.00 0.00 C ATOM 521 CD1 TYR A 379 70.636 -49.773 -8.619 1.00 0.00 C ATOM 522 CD2 TYR A 379 72.713 -49.554 -9.766 1.00 0.00 C ATOM 523 CE1 TYR A 379 70.012 -49.027 -9.601 1.00 0.00 C ATOM 524 CE2 TYR A 379 72.095 -48.809 -10.753 1.00 0.00 C ATOM 525 CZ TYR A 379 70.745 -48.548 -10.664 1.00 0.00 C ATOM 526 OH TYR A 379 70.124 -47.807 -11.646 1.00 0.00 O ATOM 0 H TYR A 379 73.655 -51.301 -4.726 1.00 0.00 H new ATOM 0 HA TYR A 379 73.263 -49.109 -6.533 1.00 0.00 H new ATOM 0 HB2 TYR A 379 73.641 -51.233 -8.001 1.00 0.00 H new ATOM 0 HB3 TYR A 379 72.080 -51.758 -7.402 1.00 0.00 H new ATOM 0 HD1 TYR A 379 70.057 -50.147 -7.788 1.00 0.00 H new ATOM 0 HD2 TYR A 379 73.772 -49.754 -9.838 1.00 0.00 H new ATOM 0 HE1 TYR A 379 68.954 -48.821 -9.535 1.00 0.00 H new ATOM 0 HE2 TYR A 379 72.667 -48.434 -11.589 1.00 0.00 H new ATOM 0 HH TYR A 379 70.782 -47.545 -12.323 1.00 0.00 H new ATOM 536 N VAL A 380 71.126 -48.865 -5.299 1.00 0.00 N ATOM 537 CA VAL A 380 69.852 -48.709 -4.617 1.00 0.00 C ATOM 538 C VAL A 380 68.752 -48.536 -5.660 1.00 0.00 C ATOM 539 O VAL A 380 68.877 -47.716 -6.573 1.00 0.00 O ATOM 540 CB VAL A 380 69.856 -47.509 -3.617 1.00 0.00 C ATOM 541 CG1 VAL A 380 70.227 -46.207 -4.305 1.00 0.00 C ATOM 542 CG2 VAL A 380 68.509 -47.380 -2.917 1.00 0.00 C ATOM 0 H VAL A 380 71.555 -47.992 -5.605 1.00 0.00 H new ATOM 0 HA VAL A 380 69.669 -49.605 -4.024 1.00 0.00 H new ATOM 0 HB VAL A 380 70.618 -47.715 -2.865 1.00 0.00 H new ATOM 0 HG11 VAL A 380 70.219 -45.396 -3.577 1.00 0.00 H new ATOM 0 HG12 VAL A 380 71.223 -46.296 -4.739 1.00 0.00 H new ATOM 0 HG13 VAL A 380 69.506 -45.994 -5.094 1.00 0.00 H new ATOM 0 HG21 VAL A 380 68.537 -46.537 -2.226 1.00 0.00 H new ATOM 0 HG22 VAL A 380 67.728 -47.215 -3.659 1.00 0.00 H new ATOM 0 HG23 VAL A 380 68.297 -48.295 -2.364 1.00 0.00 H new ATOM 552 N PHE A 381 67.691 -49.312 -5.552 1.00 0.00 N ATOM 553 CA PHE A 381 66.638 -49.250 -6.543 1.00 0.00 C ATOM 554 C PHE A 381 65.284 -49.349 -5.894 1.00 0.00 C ATOM 555 O PHE A 381 65.187 -49.375 -4.685 1.00 0.00 O ATOM 556 CB PHE A 381 66.833 -50.324 -7.642 1.00 0.00 C ATOM 557 CG PHE A 381 66.970 -51.747 -7.147 1.00 0.00 C ATOM 558 CD1 PHE A 381 68.119 -52.168 -6.491 1.00 0.00 C ATOM 559 CD2 PHE A 381 65.954 -52.665 -7.354 1.00 0.00 C ATOM 560 CE1 PHE A 381 68.247 -53.471 -6.051 1.00 0.00 C ATOM 561 CE2 PHE A 381 66.078 -53.970 -6.919 1.00 0.00 C ATOM 562 CZ PHE A 381 67.224 -54.373 -6.266 1.00 0.00 C ATOM 0 H PHE A 381 67.537 -49.983 -4.799 1.00 0.00 H new ATOM 0 HA PHE A 381 66.694 -48.279 -7.035 1.00 0.00 H new ATOM 0 HB2 PHE A 381 65.986 -50.276 -8.326 1.00 0.00 H new ATOM 0 HB3 PHE A 381 67.723 -50.071 -8.218 1.00 0.00 H new ATOM 0 HD1 PHE A 381 68.923 -51.467 -6.323 1.00 0.00 H new ATOM 0 HD2 PHE A 381 65.053 -52.356 -7.862 1.00 0.00 H new ATOM 0 HE1 PHE A 381 69.146 -53.784 -5.540 1.00 0.00 H new ATOM 0 HE2 PHE A 381 65.278 -54.675 -7.090 1.00 0.00 H new ATOM 0 HZ PHE A 381 67.321 -55.393 -5.923 1.00 0.00 H new ATOM 572 N CYS A 382 64.241 -49.359 -6.695 1.00 0.00 N ATOM 573 CA CYS A 382 62.897 -49.433 -6.172 1.00 0.00 C ATOM 574 C CYS A 382 62.548 -50.888 -5.894 1.00 0.00 C ATOM 575 O CYS A 382 63.308 -51.782 -6.225 1.00 0.00 O ATOM 576 CB CYS A 382 61.913 -48.813 -7.176 1.00 0.00 C ATOM 577 SG CYS A 382 60.210 -48.559 -6.555 1.00 0.00 S ATOM 0 H CYS A 382 64.299 -49.317 -7.712 1.00 0.00 H new ATOM 0 HA CYS A 382 62.829 -48.872 -5.240 1.00 0.00 H new ATOM 0 HB2 CYS A 382 62.310 -47.851 -7.501 1.00 0.00 H new ATOM 0 HB3 CYS A 382 61.868 -49.453 -8.057 1.00 0.00 H new ATOM 0 HG CYS A 382 59.658 -47.570 -7.194 1.00 0.00 H new ATOM 582 N ARG A 383 61.420 -51.120 -5.281 1.00 0.00 N ATOM 583 CA ARG A 383 61.008 -52.478 -4.998 1.00 0.00 C ATOM 584 C ARG A 383 59.984 -52.949 -6.014 1.00 0.00 C ATOM 585 O ARG A 383 59.692 -54.137 -6.114 1.00 0.00 O ATOM 586 CB ARG A 383 60.462 -52.610 -3.576 1.00 0.00 C ATOM 587 CG ARG A 383 59.248 -51.747 -3.277 1.00 0.00 C ATOM 588 CD ARG A 383 58.735 -52.022 -1.879 1.00 0.00 C ATOM 589 NE ARG A 383 57.537 -51.248 -1.553 1.00 0.00 N ATOM 590 CZ ARG A 383 56.512 -51.723 -0.835 1.00 0.00 C ATOM 591 NH1 ARG A 383 56.517 -52.985 -0.415 1.00 0.00 N1+ ATOM 592 NH2 ARG A 383 55.482 -50.943 -0.549 1.00 0.00 N ATOM 0 H ARG A 383 60.771 -50.398 -4.968 1.00 0.00 H new ATOM 0 HA ARG A 383 61.888 -53.116 -5.075 1.00 0.00 H new ATOM 0 HB2 ARG A 383 60.202 -53.653 -3.397 1.00 0.00 H new ATOM 0 HB3 ARG A 383 61.254 -52.354 -2.872 1.00 0.00 H new ATOM 0 HG2 ARG A 383 59.510 -50.693 -3.374 1.00 0.00 H new ATOM 0 HG3 ARG A 383 58.463 -51.948 -4.005 1.00 0.00 H new ATOM 0 HD2 ARG A 383 58.514 -53.085 -1.781 1.00 0.00 H new ATOM 0 HD3 ARG A 383 59.519 -51.792 -1.157 1.00 0.00 H new ATOM 0 HE ARG A 383 57.479 -50.288 -1.893 1.00 0.00 H new ATOM 0 HH11 ARG A 383 57.304 -53.594 -0.640 1.00 0.00 H new ATOM 0 HH12 ARG A 383 55.734 -53.344 0.132 1.00 0.00 H new ATOM 0 HH21 ARG A 383 55.468 -49.977 -0.876 1.00 0.00 H new ATOM 0 HH22 ARG A 383 54.702 -51.308 -0.002 1.00 0.00 H new ATOM 606 N ASN A 384 59.431 -52.006 -6.755 1.00 0.00 N ATOM 607 CA ASN A 384 58.457 -52.318 -7.783 1.00 0.00 C ATOM 608 C ASN A 384 59.105 -52.192 -9.149 1.00 0.00 C ATOM 609 O ASN A 384 58.705 -52.850 -10.115 1.00 0.00 O ATOM 610 CB ASN A 384 57.242 -51.386 -7.669 1.00 0.00 C ATOM 611 CG ASN A 384 56.170 -51.674 -8.711 1.00 0.00 C ATOM 612 OD1 ASN A 384 55.294 -52.511 -8.500 1.00 0.00 O ATOM 613 ND2 ASN A 384 56.216 -50.962 -9.820 1.00 0.00 N ATOM 0 H ASN A 384 59.642 -51.012 -6.662 1.00 0.00 H new ATOM 0 HA ASN A 384 58.109 -53.342 -7.650 1.00 0.00 H new ATOM 0 HB2 ASN A 384 56.809 -51.484 -6.674 1.00 0.00 H new ATOM 0 HB3 ASN A 384 57.573 -50.353 -7.773 1.00 0.00 H new ATOM 0 HD21 ASN A 384 55.508 -51.096 -10.542 1.00 0.00 H new ATOM 0 HD22 ASN A 384 56.960 -50.277 -9.956 1.00 0.00 H new ATOM 620 N CYS A 385 60.126 -51.348 -9.218 1.00 0.00 N ATOM 621 CA CYS A 385 60.831 -51.103 -10.453 1.00 0.00 C ATOM 622 C CYS A 385 62.313 -50.912 -10.196 1.00 0.00 C ATOM 623 O CYS A 385 62.798 -51.127 -9.095 1.00 0.00 O ATOM 624 CB CYS A 385 60.269 -49.870 -11.145 1.00 0.00 C ATOM 625 SG CYS A 385 60.434 -48.338 -10.188 1.00 0.00 S ATOM 0 H CYS A 385 60.481 -50.821 -8.420 1.00 0.00 H new ATOM 0 HA CYS A 385 60.696 -51.971 -11.099 1.00 0.00 H new ATOM 0 HB2 CYS A 385 60.774 -49.743 -12.102 1.00 0.00 H new ATOM 0 HB3 CYS A 385 59.214 -50.038 -11.361 1.00 0.00 H new ATOM 0 HG CYS A 385 60.223 -48.587 -8.930 1.00 0.00 H new ATOM 630 N LEU A 386 63.015 -50.481 -11.212 1.00 0.00 N ATOM 631 CA LEU A 386 64.445 -50.272 -11.135 1.00 0.00 C ATOM 632 C LEU A 386 64.784 -48.793 -11.339 1.00 0.00 C ATOM 633 O LEU A 386 65.894 -48.454 -11.750 1.00 0.00 O ATOM 634 CB LEU A 386 65.150 -51.125 -12.199 1.00 0.00 C ATOM 635 CG LEU A 386 65.454 -52.592 -11.825 1.00 0.00 C ATOM 636 CD1 LEU A 386 64.181 -53.371 -11.530 1.00 0.00 C ATOM 637 CD2 LEU A 386 66.236 -53.270 -12.937 1.00 0.00 C ATOM 0 H LEU A 386 62.612 -50.263 -12.123 1.00 0.00 H new ATOM 0 HA LEU A 386 64.791 -50.571 -10.146 1.00 0.00 H new ATOM 0 HB2 LEU A 386 64.534 -51.124 -13.098 1.00 0.00 H new ATOM 0 HB3 LEU A 386 66.091 -50.638 -12.457 1.00 0.00 H new ATOM 0 HG LEU A 386 66.058 -52.582 -10.917 1.00 0.00 H new ATOM 0 HD11 LEU A 386 64.435 -54.399 -11.271 1.00 0.00 H new ATOM 0 HD12 LEU A 386 63.655 -52.906 -10.696 1.00 0.00 H new ATOM 0 HD13 LEU A 386 63.540 -53.367 -12.411 1.00 0.00 H new ATOM 0 HD21 LEU A 386 66.443 -54.303 -12.659 1.00 0.00 H new ATOM 0 HD22 LEU A 386 65.651 -53.252 -13.856 1.00 0.00 H new ATOM 0 HD23 LEU A 386 67.176 -52.742 -13.095 1.00 0.00 H new ATOM 649 N GLN A 387 63.833 -47.918 -11.008 1.00 0.00 N ATOM 650 CA GLN A 387 63.995 -46.467 -11.211 1.00 0.00 C ATOM 651 C GLN A 387 64.905 -45.802 -10.163 1.00 0.00 C ATOM 652 O GLN A 387 64.952 -44.580 -10.071 1.00 0.00 O ATOM 653 CB GLN A 387 62.629 -45.777 -11.241 1.00 0.00 C ATOM 654 CG GLN A 387 61.754 -46.210 -12.407 1.00 0.00 C ATOM 655 CD GLN A 387 62.340 -45.827 -13.752 1.00 0.00 C ATOM 656 OE1 GLN A 387 63.006 -44.805 -13.885 1.00 0.00 O ATOM 657 NE2 GLN A 387 62.113 -46.655 -14.750 1.00 0.00 N ATOM 0 H GLN A 387 62.938 -48.184 -10.597 1.00 0.00 H new ATOM 0 HA GLN A 387 64.490 -46.345 -12.174 1.00 0.00 H new ATOM 0 HB2 GLN A 387 62.106 -45.985 -10.308 1.00 0.00 H new ATOM 0 HB3 GLN A 387 62.777 -44.698 -11.290 1.00 0.00 H new ATOM 0 HG2 GLN A 387 61.615 -47.290 -12.370 1.00 0.00 H new ATOM 0 HG3 GLN A 387 60.768 -45.758 -12.303 1.00 0.00 H new ATOM 0 HE21 GLN A 387 61.554 -47.495 -14.599 1.00 0.00 H new ATOM 0 HE22 GLN A 387 62.496 -46.457 -15.674 1.00 0.00 H new ATOM 666 N GLY A 388 65.609 -46.599 -9.373 1.00 0.00 N ATOM 667 CA GLY A 388 66.553 -46.035 -8.414 1.00 0.00 C ATOM 668 C GLY A 388 65.917 -45.668 -7.088 1.00 0.00 C ATOM 669 O GLY A 388 66.466 -44.857 -6.341 1.00 0.00 O ATOM 0 H GLY A 388 65.549 -47.617 -9.373 1.00 0.00 H new ATOM 0 HA2 GLY A 388 67.354 -46.753 -8.238 1.00 0.00 H new ATOM 0 HA3 GLY A 388 67.012 -45.146 -8.847 1.00 0.00 H new ATOM 673 N TYR A 389 64.762 -46.278 -6.806 1.00 0.00 N ATOM 674 CA TYR A 389 64.010 -46.068 -5.555 1.00 0.00 C ATOM 675 C TYR A 389 63.332 -44.697 -5.528 1.00 0.00 C ATOM 676 O TYR A 389 63.984 -43.662 -5.618 1.00 0.00 O ATOM 677 CB TYR A 389 64.915 -46.243 -4.315 1.00 0.00 C ATOM 678 CG TYR A 389 64.186 -46.708 -3.061 1.00 0.00 C ATOM 679 CD1 TYR A 389 62.867 -46.349 -2.814 1.00 0.00 C ATOM 680 CD2 TYR A 389 64.826 -47.513 -2.131 1.00 0.00 C ATOM 681 CE1 TYR A 389 62.210 -46.776 -1.679 1.00 0.00 C ATOM 682 CE2 TYR A 389 64.176 -47.947 -0.993 1.00 0.00 C ATOM 683 CZ TYR A 389 62.868 -47.575 -0.772 1.00 0.00 C ATOM 684 OH TYR A 389 62.216 -48.004 0.363 1.00 0.00 O ATOM 0 H TYR A 389 64.315 -46.938 -7.442 1.00 0.00 H new ATOM 0 HA TYR A 389 63.233 -46.831 -5.521 1.00 0.00 H new ATOM 0 HB2 TYR A 389 65.699 -46.962 -4.552 1.00 0.00 H new ATOM 0 HB3 TYR A 389 65.407 -45.294 -4.103 1.00 0.00 H new ATOM 0 HD1 TYR A 389 62.346 -45.724 -3.524 1.00 0.00 H new ATOM 0 HD2 TYR A 389 65.852 -47.806 -2.300 1.00 0.00 H new ATOM 0 HE1 TYR A 389 61.185 -46.485 -1.503 1.00 0.00 H new ATOM 0 HE2 TYR A 389 64.690 -48.575 -0.280 1.00 0.00 H new ATOM 0 HH TYR A 389 62.821 -48.560 0.897 1.00 0.00 H new ATOM 694 N HIS A 390 62.019 -44.709 -5.400 1.00 0.00 N ATOM 695 CA HIS A 390 61.233 -43.488 -5.330 1.00 0.00 C ATOM 696 C HIS A 390 59.978 -43.729 -4.499 1.00 0.00 C ATOM 697 O HIS A 390 59.634 -44.879 -4.209 1.00 0.00 O ATOM 698 CB HIS A 390 60.864 -42.987 -6.742 1.00 0.00 C ATOM 699 CG HIS A 390 60.104 -43.982 -7.567 1.00 0.00 C ATOM 700 ND1 HIS A 390 58.764 -43.876 -7.854 1.00 0.00 N ATOM 701 CD2 HIS A 390 60.526 -45.122 -8.165 1.00 0.00 C ATOM 702 CE1 HIS A 390 58.418 -44.931 -8.597 1.00 0.00 C ATOM 703 NE2 HIS A 390 59.453 -45.720 -8.815 1.00 0.00 N ATOM 0 H HIS A 390 61.466 -45.564 -5.341 1.00 0.00 H new ATOM 0 HA HIS A 390 61.832 -42.715 -4.850 1.00 0.00 H new ATOM 0 HB2 HIS A 390 60.269 -42.078 -6.649 1.00 0.00 H new ATOM 0 HB3 HIS A 390 61.778 -42.717 -7.270 1.00 0.00 H new ATOM 0 HD2 HIS A 390 61.535 -45.505 -8.141 1.00 0.00 H new ATOM 0 HE1 HIS A 390 57.421 -45.114 -8.970 1.00 0.00 H new ATOM 0 HE2 HIS A 390 59.463 -46.589 -9.350 1.00 0.00 H new ATOM 711 N ILE A 391 59.310 -42.662 -4.119 1.00 0.00 N ATOM 712 CA ILE A 391 58.114 -42.755 -3.302 1.00 0.00 C ATOM 713 C ILE A 391 56.896 -42.289 -4.095 1.00 0.00 C ATOM 714 O ILE A 391 56.993 -41.356 -4.892 1.00 0.00 O ATOM 715 CB ILE A 391 58.250 -41.893 -2.029 1.00 0.00 C ATOM 716 CG1 ILE A 391 59.557 -42.227 -1.312 1.00 0.00 C ATOM 717 CG2 ILE A 391 57.061 -42.117 -1.096 1.00 0.00 C ATOM 718 CD1 ILE A 391 59.809 -41.383 -0.093 1.00 0.00 C ATOM 0 H ILE A 391 59.577 -41.709 -4.365 1.00 0.00 H new ATOM 0 HA ILE A 391 57.986 -43.798 -3.012 1.00 0.00 H new ATOM 0 HB ILE A 391 58.262 -40.842 -2.319 1.00 0.00 H new ATOM 0 HG12 ILE A 391 59.543 -43.277 -1.020 1.00 0.00 H new ATOM 0 HG13 ILE A 391 60.386 -42.101 -2.008 1.00 0.00 H new ATOM 0 HG21 ILE A 391 57.177 -41.500 -0.205 1.00 0.00 H new ATOM 0 HG22 ILE A 391 56.139 -41.844 -1.609 1.00 0.00 H new ATOM 0 HG23 ILE A 391 57.018 -43.167 -0.807 1.00 0.00 H new ATOM 0 HD11 ILE A 391 60.754 -41.677 0.364 1.00 0.00 H new ATOM 0 HD12 ILE A 391 59.856 -40.333 -0.381 1.00 0.00 H new ATOM 0 HD13 ILE A 391 59.000 -41.527 0.623 1.00 0.00 H new ATOM 730 N GLY A 392 55.765 -42.943 -3.884 1.00 0.00 N ATOM 731 CA GLY A 392 54.552 -42.562 -4.583 1.00 0.00 C ATOM 732 C GLY A 392 54.120 -43.607 -5.579 1.00 0.00 C ATOM 733 O GLY A 392 53.397 -43.304 -6.533 1.00 0.00 O ATOM 0 H GLY A 392 55.663 -43.730 -3.243 1.00 0.00 H new ATOM 0 HA2 GLY A 392 53.753 -42.399 -3.860 1.00 0.00 H new ATOM 0 HA3 GLY A 392 54.713 -41.615 -5.098 1.00 0.00 H new ATOM 737 N GLU A 393 54.566 -44.845 -5.349 1.00 0.00 N ATOM 738 CA GLU A 393 54.274 -45.980 -6.217 1.00 0.00 C ATOM 739 C GLU A 393 54.826 -45.775 -7.623 1.00 0.00 C ATOM 740 O GLU A 393 55.465 -44.759 -7.913 1.00 0.00 O ATOM 741 CB GLU A 393 52.780 -46.266 -6.270 1.00 0.00 C ATOM 742 CG GLU A 393 52.183 -46.670 -4.939 1.00 0.00 C ATOM 743 CD GLU A 393 50.768 -47.164 -5.080 1.00 0.00 C ATOM 744 OE1 GLU A 393 49.900 -46.380 -5.506 1.00 0.00 O ATOM 745 OE2 GLU A 393 50.511 -48.345 -4.763 1.00 0.00 O1- ATOM 0 H GLU A 393 55.146 -45.086 -4.545 1.00 0.00 H new ATOM 0 HA GLU A 393 54.775 -46.846 -5.784 1.00 0.00 H new ATOM 0 HB2 GLU A 393 52.263 -45.378 -6.634 1.00 0.00 H new ATOM 0 HB3 GLU A 393 52.598 -47.060 -6.994 1.00 0.00 H new ATOM 0 HG2 GLU A 393 52.796 -47.451 -4.489 1.00 0.00 H new ATOM 0 HG3 GLU A 393 52.203 -45.818 -4.259 1.00 0.00 H new ATOM 752 N CYS A 394 54.590 -46.742 -8.487 1.00 0.00 N ATOM 753 CA CYS A 394 55.083 -46.676 -9.845 1.00 0.00 C ATOM 754 C CYS A 394 53.940 -46.843 -10.825 1.00 0.00 C ATOM 755 O CYS A 394 53.677 -45.964 -11.647 1.00 0.00 O ATOM 756 CB CYS A 394 56.123 -47.765 -10.063 1.00 0.00 C ATOM 757 SG CYS A 394 57.131 -48.114 -8.586 1.00 0.00 S ATOM 0 H CYS A 394 54.058 -47.585 -8.270 1.00 0.00 H new ATOM 0 HA CYS A 394 55.543 -45.702 -10.011 1.00 0.00 H new ATOM 0 HB2 CYS A 394 55.619 -48.680 -10.374 1.00 0.00 H new ATOM 0 HB3 CYS A 394 56.781 -47.470 -10.880 1.00 0.00 H new ATOM 0 HG CYS A 394 58.378 -48.237 -8.931 1.00 0.00 H new ATOM 1275 N VAL A 431 -56.219 -28.389 -43.122 1.00 0.00 N ATOM 1276 CA VAL A 431 -57.278 -27.515 -42.656 1.00 0.00 C ATOM 1277 C VAL A 431 -58.509 -28.309 -42.227 1.00 0.00 C ATOM 1278 O VAL A 431 -59.167 -28.958 -43.039 1.00 0.00 O ATOM 1279 CB VAL A 431 -57.656 -26.438 -43.720 1.00 0.00 C ATOM 1280 CG1 VAL A 431 -58.024 -27.075 -45.055 1.00 0.00 C ATOM 1281 CG2 VAL A 431 -58.787 -25.547 -43.215 1.00 0.00 C ATOM 0 HA VAL A 431 -56.892 -26.991 -41.781 1.00 0.00 H new ATOM 0 HB VAL A 431 -56.776 -25.815 -43.883 1.00 0.00 H new ATOM 0 HG11 VAL A 431 -58.282 -26.295 -45.772 1.00 0.00 H new ATOM 0 HG12 VAL A 431 -57.176 -27.648 -45.431 1.00 0.00 H new ATOM 0 HG13 VAL A 431 -58.878 -27.739 -44.918 1.00 0.00 H new ATOM 0 HG21 VAL A 431 -59.032 -24.805 -43.975 1.00 0.00 H new ATOM 0 HG22 VAL A 431 -59.666 -26.157 -43.007 1.00 0.00 H new ATOM 0 HG23 VAL A 431 -58.472 -25.042 -42.302 1.00 0.00 H new ATOM 1291 N SER A 432 -58.794 -28.276 -40.945 1.00 0.00 N ATOM 1292 CA SER A 432 -59.947 -28.961 -40.401 1.00 0.00 C ATOM 1293 C SER A 432 -60.945 -27.956 -39.828 1.00 0.00 C ATOM 1294 O SER A 432 -61.973 -28.325 -39.256 1.00 0.00 O ATOM 1295 CB SER A 432 -59.497 -29.965 -39.340 1.00 0.00 C ATOM 1296 OG SER A 432 -58.453 -29.425 -38.545 1.00 0.00 O ATOM 0 H SER A 432 -58.237 -27.776 -40.252 1.00 0.00 H new ATOM 0 HA SER A 432 -60.451 -29.507 -41.199 1.00 0.00 H new ATOM 0 HB2 SER A 432 -60.342 -30.233 -38.705 1.00 0.00 H new ATOM 0 HB3 SER A 432 -59.156 -30.882 -39.822 1.00 0.00 H new ATOM 0 HG SER A 432 -58.181 -30.083 -37.871 1.00 0.00 H new ATOM 1302 N THR A 433 -60.632 -26.686 -39.991 1.00 0.00 N ATOM 1303 CA THR A 433 -61.483 -25.626 -39.524 1.00 0.00 C ATOM 1304 C THR A 433 -62.473 -25.204 -40.600 1.00 0.00 C ATOM 1305 O THR A 433 -62.221 -25.363 -41.797 1.00 0.00 O ATOM 1306 CB THR A 433 -60.648 -24.411 -39.093 1.00 0.00 C ATOM 1307 OG1 THR A 433 -59.437 -24.356 -39.865 1.00 0.00 O ATOM 1308 CG2 THR A 433 -60.312 -24.484 -37.614 1.00 0.00 C ATOM 0 H THR A 433 -59.780 -26.367 -40.451 1.00 0.00 H new ATOM 0 HA THR A 433 -62.038 -26.004 -38.665 1.00 0.00 H new ATOM 0 HB THR A 433 -61.234 -23.509 -39.269 1.00 0.00 H new ATOM 0 HG1 THR A 433 -58.908 -23.579 -39.589 1.00 0.00 H new ATOM 0 HG21 THR A 433 -59.720 -23.613 -37.332 1.00 0.00 H new ATOM 0 HG22 THR A 433 -61.233 -24.501 -37.032 1.00 0.00 H new ATOM 0 HG23 THR A 433 -59.741 -25.391 -37.415 1.00 0.00 H new ATOM 1316 N LYS A 434 -63.606 -24.705 -40.168 1.00 0.00 N ATOM 1317 CA LYS A 434 -64.628 -24.212 -41.061 1.00 0.00 C ATOM 1318 C LYS A 434 -64.848 -22.734 -40.772 1.00 0.00 C ATOM 1319 O LYS A 434 -65.195 -22.371 -39.653 1.00 0.00 O ATOM 1320 CB LYS A 434 -65.939 -24.988 -40.851 1.00 0.00 C ATOM 1321 CG LYS A 434 -65.843 -26.501 -41.092 1.00 0.00 C ATOM 1322 CD LYS A 434 -66.149 -26.894 -42.545 1.00 0.00 C ATOM 1323 CE LYS A 434 -65.030 -26.520 -43.517 1.00 0.00 C ATOM 1324 NZ LYS A 434 -63.752 -27.209 -43.197 1.00 0.00 N1+ ATOM 0 H LYS A 434 -63.847 -24.629 -39.180 1.00 0.00 H new ATOM 0 HA LYS A 434 -64.311 -24.349 -42.095 1.00 0.00 H new ATOM 0 HB2 LYS A 434 -66.284 -24.819 -39.831 1.00 0.00 H new ATOM 0 HB3 LYS A 434 -66.698 -24.577 -41.517 1.00 0.00 H new ATOM 0 HG2 LYS A 434 -64.841 -26.843 -40.832 1.00 0.00 H new ATOM 0 HG3 LYS A 434 -66.538 -27.015 -40.428 1.00 0.00 H new ATOM 0 HD2 LYS A 434 -66.321 -27.969 -42.595 1.00 0.00 H new ATOM 0 HD3 LYS A 434 -67.073 -26.408 -42.860 1.00 0.00 H new ATOM 0 HE2 LYS A 434 -65.333 -26.775 -44.532 1.00 0.00 H new ATOM 0 HE3 LYS A 434 -64.875 -25.441 -43.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 434 -63.272 -27.478 -44.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 434 -63.140 -26.569 -42.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 434 -63.949 -28.062 -42.636 1.00 0.00 H new ATOM 1338 N PRO A 435 -64.618 -21.857 -41.755 1.00 0.00 N ATOM 1339 CA PRO A 435 -64.785 -20.419 -41.564 1.00 0.00 C ATOM 1340 C PRO A 435 -66.245 -20.029 -41.377 1.00 0.00 C ATOM 1341 O PRO A 435 -67.107 -20.381 -42.195 1.00 0.00 O ATOM 1342 CB PRO A 435 -64.232 -19.792 -42.850 1.00 0.00 C ATOM 1343 CG PRO A 435 -63.550 -20.904 -43.585 1.00 0.00 C ATOM 1344 CD PRO A 435 -64.185 -22.181 -43.118 1.00 0.00 C ATOM 0 HA PRO A 435 -64.271 -20.079 -40.665 1.00 0.00 H new ATOM 0 HB2 PRO A 435 -65.033 -19.360 -43.450 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -63.533 -18.987 -42.623 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -63.667 -20.785 -44.662 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -62.480 -20.906 -43.378 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -65.025 -22.468 -43.750 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -63.478 -23.011 -43.130 1.00 0.00 H new ATOM 1352 N CYS A 436 -66.512 -19.322 -40.289 1.00 0.00 N ATOM 1353 CA CYS A 436 -67.842 -18.838 -39.978 1.00 0.00 C ATOM 1354 C CYS A 436 -68.364 -17.960 -41.104 1.00 0.00 C ATOM 1355 O CYS A 436 -67.668 -17.059 -41.571 1.00 0.00 O ATOM 1356 CB CYS A 436 -67.808 -18.043 -38.664 1.00 0.00 C ATOM 1357 SG CYS A 436 -69.394 -17.271 -38.187 1.00 0.00 S ATOM 0 H CYS A 436 -65.807 -19.069 -39.597 1.00 0.00 H new ATOM 0 HA CYS A 436 -68.511 -19.691 -39.866 1.00 0.00 H new ATOM 0 HB2 CYS A 436 -67.490 -18.709 -37.862 1.00 0.00 H new ATOM 0 HB3 CYS A 436 -67.052 -17.262 -38.749 1.00 0.00 H new ATOM 0 HG CYS A 436 -69.520 -17.302 -36.893 1.00 0.00 H new ATOM 1362 N PRO A 437 -69.591 -18.209 -41.560 1.00 0.00 N ATOM 1363 CA PRO A 437 -70.211 -17.407 -42.611 1.00 0.00 C ATOM 1364 C PRO A 437 -70.662 -16.046 -42.081 1.00 0.00 C ATOM 1365 O PRO A 437 -71.195 -15.219 -42.822 1.00 0.00 O ATOM 1366 CB PRO A 437 -71.420 -18.249 -43.023 1.00 0.00 C ATOM 1367 CG PRO A 437 -71.769 -19.025 -41.801 1.00 0.00 C ATOM 1368 CD PRO A 437 -70.471 -19.299 -41.095 1.00 0.00 C ATOM 0 HA PRO A 437 -69.529 -17.191 -43.434 1.00 0.00 H new ATOM 0 HB2 PRO A 437 -72.250 -17.620 -43.344 1.00 0.00 H new ATOM 0 HB3 PRO A 437 -71.179 -18.909 -43.856 1.00 0.00 H new ATOM 0 HG2 PRO A 437 -72.448 -18.461 -41.162 1.00 0.00 H new ATOM 0 HG3 PRO A 437 -72.275 -19.955 -42.061 1.00 0.00 H new ATOM 0 HD2 PRO A 437 -70.592 -19.283 -40.012 1.00 0.00 H new ATOM 0 HD3 PRO A 437 -70.070 -20.278 -41.357 1.00 0.00 H new ATOM 1376 N LYS A 438 -70.451 -15.826 -40.792 1.00 0.00 N ATOM 1377 CA LYS A 438 -70.830 -14.589 -40.154 1.00 0.00 C ATOM 1378 C LYS A 438 -69.605 -13.687 -39.931 1.00 0.00 C ATOM 1379 O LYS A 438 -69.502 -12.612 -40.533 1.00 0.00 O ATOM 1380 CB LYS A 438 -71.531 -14.886 -38.824 1.00 0.00 C ATOM 1381 CG LYS A 438 -72.145 -13.676 -38.143 1.00 0.00 C ATOM 1382 CD LYS A 438 -73.317 -13.119 -38.931 1.00 0.00 C ATOM 1383 CE LYS A 438 -74.035 -12.025 -38.153 1.00 0.00 C ATOM 1384 NZ LYS A 438 -73.119 -10.930 -37.747 1.00 0.00 N1+ ATOM 0 H LYS A 438 -70.013 -16.502 -40.166 1.00 0.00 H new ATOM 0 HA LYS A 438 -71.520 -14.056 -40.808 1.00 0.00 H new ATOM 0 HB2 LYS A 438 -72.315 -15.623 -38.999 1.00 0.00 H new ATOM 0 HB3 LYS A 438 -70.811 -15.342 -38.144 1.00 0.00 H new ATOM 0 HG2 LYS A 438 -72.478 -13.952 -37.143 1.00 0.00 H new ATOM 0 HG3 LYS A 438 -71.387 -12.902 -38.024 1.00 0.00 H new ATOM 0 HD2 LYS A 438 -72.962 -12.720 -39.881 1.00 0.00 H new ATOM 0 HD3 LYS A 438 -74.016 -13.922 -39.164 1.00 0.00 H new ATOM 0 HE2 LYS A 438 -74.839 -11.615 -38.764 1.00 0.00 H new ATOM 0 HE3 LYS A 438 -74.498 -12.457 -37.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 438 -73.675 -10.127 -37.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 438 -72.481 -11.270 -37.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 438 -72.559 -10.624 -38.568 1.00 0.00 H new ATOM 1398 N CYS A 439 -68.665 -14.136 -39.088 1.00 0.00 N ATOM 1399 CA CYS A 439 -67.483 -13.330 -38.773 1.00 0.00 C ATOM 1400 C CYS A 439 -66.221 -13.811 -39.494 1.00 0.00 C ATOM 1401 O CYS A 439 -65.156 -13.185 -39.370 1.00 0.00 O ATOM 1402 CB CYS A 439 -67.255 -13.265 -37.267 1.00 0.00 C ATOM 1403 SG CYS A 439 -67.216 -14.874 -36.438 1.00 0.00 S ATOM 0 H CYS A 439 -68.700 -15.041 -38.619 1.00 0.00 H new ATOM 0 HA CYS A 439 -67.687 -12.325 -39.142 1.00 0.00 H new ATOM 0 HB2 CYS A 439 -66.313 -12.751 -37.078 1.00 0.00 H new ATOM 0 HB3 CYS A 439 -68.044 -12.660 -36.820 1.00 0.00 H new ATOM 0 HG CYS A 439 -68.007 -15.700 -37.056 1.00 0.00 H new ATOM 1408 N ARG A 440 -66.342 -14.916 -40.238 1.00 0.00 N ATOM 1409 CA ARG A 440 -65.233 -15.469 -41.037 1.00 0.00 C ATOM 1410 C ARG A 440 -64.110 -16.039 -40.176 1.00 0.00 C ATOM 1411 O ARG A 440 -62.951 -16.066 -40.593 1.00 0.00 O ATOM 1412 CB ARG A 440 -64.683 -14.421 -42.010 1.00 0.00 C ATOM 1413 CG ARG A 440 -65.616 -14.099 -43.170 1.00 0.00 C ATOM 1414 CD ARG A 440 -65.876 -15.327 -44.029 1.00 0.00 C ATOM 1415 NE ARG A 440 -64.625 -15.959 -44.454 1.00 0.00 N ATOM 1416 CZ ARG A 440 -64.545 -17.054 -45.206 1.00 0.00 C ATOM 1417 NH1 ARG A 440 -65.648 -17.637 -45.668 1.00 0.00 N1+ ATOM 1418 NH2 ARG A 440 -63.353 -17.564 -45.498 1.00 0.00 N ATOM 0 H ARG A 440 -67.206 -15.453 -40.306 1.00 0.00 H new ATOM 0 HA ARG A 440 -65.649 -16.299 -41.608 1.00 0.00 H new ATOM 0 HB2 ARG A 440 -64.475 -13.503 -41.460 1.00 0.00 H new ATOM 0 HB3 ARG A 440 -63.733 -14.775 -42.410 1.00 0.00 H new ATOM 0 HG2 ARG A 440 -66.561 -13.716 -42.784 1.00 0.00 H new ATOM 0 HG3 ARG A 440 -65.179 -13.310 -43.782 1.00 0.00 H new ATOM 0 HD2 ARG A 440 -66.475 -16.044 -43.468 1.00 0.00 H new ATOM 0 HD3 ARG A 440 -66.457 -15.042 -44.906 1.00 0.00 H new ATOM 0 HE ARG A 440 -63.751 -15.528 -44.151 1.00 0.00 H new ATOM 0 HH11 ARG A 440 -66.563 -17.245 -45.446 1.00 0.00 H new ATOM 0 HH12 ARG A 440 -65.578 -18.476 -46.244 1.00 0.00 H new ATOM 0 HH21 ARG A 440 -62.507 -17.116 -45.146 1.00 0.00 H new ATOM 0 HH22 ARG A 440 -63.284 -18.403 -46.074 1.00 0.00 H new ATOM 1432 N THR A 441 -64.451 -16.514 -39.001 1.00 0.00 N ATOM 1433 CA THR A 441 -63.473 -17.104 -38.114 1.00 0.00 C ATOM 1434 C THR A 441 -63.359 -18.605 -38.372 1.00 0.00 C ATOM 1435 O THR A 441 -64.358 -19.262 -38.641 1.00 0.00 O ATOM 1436 CB THR A 441 -63.859 -16.870 -36.646 1.00 0.00 C ATOM 1437 OG1 THR A 441 -65.206 -17.302 -36.429 1.00 0.00 O ATOM 1438 CG2 THR A 441 -63.736 -15.396 -36.294 1.00 0.00 C ATOM 0 H THR A 441 -65.403 -16.504 -38.635 1.00 0.00 H new ATOM 0 HA THR A 441 -62.512 -16.628 -38.310 1.00 0.00 H new ATOM 0 HB THR A 441 -63.183 -17.442 -36.010 1.00 0.00 H new ATOM 0 HG1 THR A 441 -65.793 -16.520 -36.356 1.00 0.00 H new ATOM 0 HG21 THR A 441 -64.013 -15.247 -35.250 1.00 0.00 H new ATOM 0 HG22 THR A 441 -62.707 -15.070 -36.446 1.00 0.00 H new ATOM 0 HG23 THR A 441 -64.400 -14.813 -36.932 1.00 0.00 H new ATOM 1446 N PRO A 442 -62.145 -19.171 -38.317 1.00 0.00 N ATOM 1447 CA PRO A 442 -61.953 -20.593 -38.518 1.00 0.00 C ATOM 1448 C PRO A 442 -62.386 -21.391 -37.294 1.00 0.00 C ATOM 1449 O PRO A 442 -61.628 -21.551 -36.336 1.00 0.00 O ATOM 1450 CB PRO A 442 -60.444 -20.752 -38.767 1.00 0.00 C ATOM 1451 CG PRO A 442 -59.851 -19.374 -38.670 1.00 0.00 C ATOM 1452 CD PRO A 442 -60.889 -18.480 -38.047 1.00 0.00 C ATOM 0 HA PRO A 442 -62.553 -20.969 -39.347 1.00 0.00 H new ATOM 0 HB2 PRO A 442 -59.997 -21.420 -38.031 1.00 0.00 H new ATOM 0 HB3 PRO A 442 -60.256 -21.188 -39.748 1.00 0.00 H new ATOM 0 HG2 PRO A 442 -58.944 -19.388 -38.066 1.00 0.00 H new ATOM 0 HG3 PRO A 442 -59.571 -19.007 -39.657 1.00 0.00 H new ATOM 0 HD2 PRO A 442 -60.722 -18.357 -36.977 1.00 0.00 H new ATOM 0 HD3 PRO A 442 -60.877 -17.484 -38.489 1.00 0.00 H new ATOM 1460 N THR A 443 -63.613 -21.853 -37.320 1.00 0.00 N ATOM 1461 CA THR A 443 -64.175 -22.619 -36.235 1.00 0.00 C ATOM 1462 C THR A 443 -63.902 -24.107 -36.449 1.00 0.00 C ATOM 1463 O THR A 443 -64.168 -24.646 -37.526 1.00 0.00 O ATOM 1464 CB THR A 443 -65.694 -22.367 -36.154 1.00 0.00 C ATOM 1465 OG1 THR A 443 -65.931 -20.949 -36.095 1.00 0.00 O ATOM 1466 CG2 THR A 443 -66.302 -23.034 -34.929 1.00 0.00 C ATOM 0 H THR A 443 -64.254 -21.707 -38.100 1.00 0.00 H new ATOM 0 HA THR A 443 -63.711 -22.308 -35.299 1.00 0.00 H new ATOM 0 HB THR A 443 -66.164 -22.795 -37.040 1.00 0.00 H new ATOM 0 HG1 THR A 443 -66.895 -20.780 -36.045 1.00 0.00 H new ATOM 0 HG21 THR A 443 -67.374 -22.837 -34.902 1.00 0.00 H new ATOM 0 HG22 THR A 443 -66.132 -24.110 -34.978 1.00 0.00 H new ATOM 0 HG23 THR A 443 -65.837 -22.634 -34.028 1.00 0.00 H new ATOM 1474 N GLU A 444 -63.348 -24.762 -35.439 1.00 0.00 N ATOM 1475 CA GLU A 444 -63.029 -26.179 -35.540 1.00 0.00 C ATOM 1476 C GLU A 444 -64.285 -27.030 -35.526 1.00 0.00 C ATOM 1477 O GLU A 444 -65.302 -26.647 -34.947 1.00 0.00 O ATOM 1478 CB GLU A 444 -62.107 -26.619 -34.405 1.00 0.00 C ATOM 1479 CG GLU A 444 -60.770 -25.909 -34.381 1.00 0.00 C ATOM 1480 CD GLU A 444 -59.829 -26.503 -33.365 1.00 0.00 C ATOM 1481 OE1 GLU A 444 -60.039 -26.292 -32.155 1.00 0.00 O ATOM 1482 OE2 GLU A 444 -58.871 -27.194 -33.769 1.00 0.00 O1- ATOM 0 H GLU A 444 -63.111 -24.337 -34.543 1.00 0.00 H new ATOM 0 HA GLU A 444 -62.516 -26.323 -36.491 1.00 0.00 H new ATOM 0 HB2 GLU A 444 -62.613 -26.449 -33.455 1.00 0.00 H new ATOM 0 HB3 GLU A 444 -61.934 -27.692 -34.487 1.00 0.00 H new ATOM 0 HG2 GLU A 444 -60.315 -25.962 -35.370 1.00 0.00 H new ATOM 0 HG3 GLU A 444 -60.925 -24.854 -34.157 1.00 0.00 H new ATOM 1489 N ARG A 445 -64.212 -28.175 -36.172 1.00 0.00 N ATOM 1490 CA ARG A 445 -65.321 -29.108 -36.200 1.00 0.00 C ATOM 1491 C ARG A 445 -65.311 -29.949 -34.934 1.00 0.00 C ATOM 1492 O ARG A 445 -64.241 -30.249 -34.390 1.00 0.00 O ATOM 1493 CB ARG A 445 -65.256 -30.015 -37.456 1.00 0.00 C ATOM 1494 CG ARG A 445 -64.221 -31.149 -37.391 1.00 0.00 C ATOM 1495 CD ARG A 445 -62.803 -30.625 -37.225 1.00 0.00 C ATOM 1496 NE ARG A 445 -61.828 -31.699 -37.069 1.00 0.00 N ATOM 1497 CZ ARG A 445 -61.298 -32.070 -35.900 1.00 0.00 C ATOM 1498 NH1 ARG A 445 -61.716 -31.512 -34.763 1.00 0.00 N1+ ATOM 1499 NH2 ARG A 445 -60.375 -33.015 -35.866 1.00 0.00 N ATOM 0 H ARG A 445 -63.389 -28.484 -36.689 1.00 0.00 H new ATOM 0 HA ARG A 445 -66.251 -28.542 -36.248 1.00 0.00 H new ATOM 0 HB2 ARG A 445 -66.241 -30.452 -37.620 1.00 0.00 H new ATOM 0 HB3 ARG A 445 -65.035 -29.392 -38.323 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -64.462 -31.811 -36.559 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -64.281 -31.746 -38.301 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -62.538 -30.021 -38.093 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -62.760 -29.970 -36.355 1.00 0.00 H new ATOM 0 HE ARG A 445 -61.532 -32.199 -37.907 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -62.444 -30.798 -34.783 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -61.308 -31.799 -33.874 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -60.068 -33.460 -36.731 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -59.969 -33.300 -34.975 1.00 0.00 H new ATOM 1513 N ASP A 446 -66.481 -30.307 -34.455 1.00 0.00 N ATOM 1514 CA ASP A 446 -66.584 -31.134 -33.267 1.00 0.00 C ATOM 1515 C ASP A 446 -67.250 -32.457 -33.584 1.00 0.00 C ATOM 1516 O ASP A 446 -68.477 -32.582 -33.514 1.00 0.00 O ATOM 1517 CB ASP A 446 -67.330 -30.414 -32.138 1.00 0.00 C ATOM 1518 CG ASP A 446 -66.468 -29.395 -31.419 1.00 0.00 C ATOM 1519 OD1 ASP A 446 -65.579 -29.809 -30.637 1.00 0.00 O ATOM 1520 OD2 ASP A 446 -66.684 -28.179 -31.605 1.00 0.00 O1- ATOM 0 H ASP A 446 -67.375 -30.041 -34.867 1.00 0.00 H new ATOM 0 HA ASP A 446 -65.569 -31.331 -32.921 1.00 0.00 H new ATOM 0 HB2 ASP A 446 -68.207 -29.915 -32.549 1.00 0.00 H new ATOM 0 HB3 ASP A 446 -67.690 -31.150 -31.419 1.00 0.00 H new ATOM 1525 N GLY A 447 -66.435 -33.433 -33.956 1.00 0.00 N ATOM 1526 CA GLY A 447 -66.936 -34.751 -34.283 1.00 0.00 C ATOM 1527 C GLY A 447 -67.912 -34.732 -35.434 1.00 0.00 C ATOM 1528 O GLY A 447 -67.675 -34.079 -36.457 1.00 0.00 O ATOM 0 H GLY A 447 -65.423 -33.333 -34.038 1.00 0.00 H new ATOM 0 HA2 GLY A 447 -66.098 -35.402 -34.532 1.00 0.00 H new ATOM 0 HA3 GLY A 447 -67.422 -35.179 -33.406 1.00 0.00 H new ATOM 1532 N GLY A 448 -69.005 -35.447 -35.270 1.00 0.00 N ATOM 1533 CA GLY A 448 -70.022 -35.494 -36.289 1.00 0.00 C ATOM 1534 C GLY A 448 -71.297 -34.832 -35.834 1.00 0.00 C ATOM 1535 O GLY A 448 -72.366 -35.061 -36.408 1.00 0.00 O ATOM 0 H GLY A 448 -69.208 -36.002 -34.439 1.00 0.00 H new ATOM 0 HA2 GLY A 448 -69.657 -35.001 -37.190 1.00 0.00 H new ATOM 0 HA3 GLY A 448 -70.225 -36.532 -36.553 1.00 0.00 H new ATOM 1539 N CYS A 449 -71.185 -34.013 -34.795 1.00 0.00 N ATOM 1540 CA CYS A 449 -72.324 -33.300 -34.252 1.00 0.00 C ATOM 1541 C CYS A 449 -72.868 -32.333 -35.282 1.00 0.00 C ATOM 1542 O CYS A 449 -72.119 -31.548 -35.865 1.00 0.00 O ATOM 1543 CB CYS A 449 -71.919 -32.545 -32.980 1.00 0.00 C ATOM 1544 SG CYS A 449 -73.234 -31.536 -32.248 1.00 0.00 S ATOM 0 H CYS A 449 -70.306 -33.828 -34.311 1.00 0.00 H new ATOM 0 HA CYS A 449 -73.102 -34.020 -33.998 1.00 0.00 H new ATOM 0 HB2 CYS A 449 -71.578 -33.267 -32.238 1.00 0.00 H new ATOM 0 HB3 CYS A 449 -71.071 -31.900 -33.211 1.00 0.00 H new ATOM 0 HG CYS A 449 -73.076 -30.295 -32.600 1.00 0.00 H new ATOM 1550 N MET A 450 -74.166 -32.390 -35.511 1.00 0.00 N ATOM 1551 CA MET A 450 -74.784 -31.522 -36.485 1.00 0.00 C ATOM 1552 C MET A 450 -74.924 -30.120 -35.947 1.00 0.00 C ATOM 1553 O MET A 450 -74.974 -29.158 -36.711 1.00 0.00 O ATOM 1554 CB MET A 450 -76.139 -32.060 -36.939 1.00 0.00 C ATOM 1555 CG MET A 450 -76.045 -33.358 -37.712 1.00 0.00 C ATOM 1556 SD MET A 450 -77.609 -33.850 -38.449 1.00 0.00 S ATOM 1557 CE MET A 450 -77.110 -35.362 -39.263 1.00 0.00 C ATOM 0 H MET A 450 -74.807 -33.026 -35.037 1.00 0.00 H new ATOM 0 HA MET A 450 -74.129 -31.494 -37.356 1.00 0.00 H new ATOM 0 HB2 MET A 450 -76.772 -32.212 -36.065 1.00 0.00 H new ATOM 0 HB3 MET A 450 -76.629 -31.311 -37.561 1.00 0.00 H new ATOM 0 HG2 MET A 450 -75.296 -33.254 -38.497 1.00 0.00 H new ATOM 0 HG3 MET A 450 -75.699 -34.148 -37.045 1.00 0.00 H new ATOM 0 HE1 MET A 450 -77.830 -35.610 -40.042 1.00 0.00 H new ATOM 0 HE2 MET A 450 -76.125 -35.227 -39.709 1.00 0.00 H new ATOM 0 HE3 MET A 450 -77.070 -36.172 -38.534 1.00 0.00 H new ATOM 1567 N HIS A 451 -74.990 -29.996 -34.632 1.00 0.00 N ATOM 1568 CA HIS A 451 -75.093 -28.691 -34.024 1.00 0.00 C ATOM 1569 C HIS A 451 -73.726 -28.041 -33.991 1.00 0.00 C ATOM 1570 O HIS A 451 -72.910 -28.312 -33.108 1.00 0.00 O ATOM 1571 CB HIS A 451 -75.691 -28.779 -32.617 1.00 0.00 C ATOM 1572 CG HIS A 451 -76.163 -27.457 -32.077 1.00 0.00 C ATOM 1573 ND1 HIS A 451 -75.897 -27.072 -30.786 1.00 0.00 N ATOM 1574 CD2 HIS A 451 -76.898 -26.489 -32.685 1.00 0.00 C ATOM 1575 CE1 HIS A 451 -76.469 -25.887 -30.637 1.00 0.00 C ATOM 1576 NE2 HIS A 451 -77.084 -25.497 -31.757 1.00 0.00 N ATOM 0 H HIS A 451 -74.974 -30.777 -33.976 1.00 0.00 H new ATOM 0 HA HIS A 451 -75.766 -28.077 -34.623 1.00 0.00 H new ATOM 0 HB2 HIS A 451 -76.529 -29.476 -32.631 1.00 0.00 H new ATOM 0 HB3 HIS A 451 -74.944 -29.192 -31.939 1.00 0.00 H new ATOM 0 HD2 HIS A 451 -77.264 -26.499 -33.701 1.00 0.00 H new ATOM 0 HE1 HIS A 451 -76.442 -25.309 -29.725 1.00 0.00 H new ATOM 0 HE2 HIS A 451 -77.596 -24.625 -31.896 1.00 0.00 H new ATOM 1584 N MET A 452 -73.475 -27.220 -34.983 1.00 0.00 N ATOM 1585 CA MET A 452 -72.220 -26.524 -35.113 1.00 0.00 C ATOM 1586 C MET A 452 -72.456 -25.038 -35.056 1.00 0.00 C ATOM 1587 O MET A 452 -73.040 -24.458 -35.962 1.00 0.00 O ATOM 1588 CB MET A 452 -71.544 -26.907 -36.431 1.00 0.00 C ATOM 1589 CG MET A 452 -70.893 -28.283 -36.413 1.00 0.00 C ATOM 1590 SD MET A 452 -69.207 -28.247 -35.768 1.00 0.00 S ATOM 1591 CE MET A 452 -68.387 -27.327 -37.071 1.00 0.00 C ATOM 0 H MET A 452 -74.142 -27.016 -35.727 1.00 0.00 H new ATOM 0 HA MET A 452 -71.563 -26.808 -34.291 1.00 0.00 H new ATOM 0 HB2 MET A 452 -72.285 -26.877 -37.230 1.00 0.00 H new ATOM 0 HB3 MET A 452 -70.787 -26.161 -36.670 1.00 0.00 H new ATOM 0 HG2 MET A 452 -71.496 -28.958 -35.805 1.00 0.00 H new ATOM 0 HG3 MET A 452 -70.882 -28.689 -37.425 1.00 0.00 H new ATOM 0 HE1 MET A 452 -67.621 -27.951 -37.530 1.00 0.00 H new ATOM 0 HE2 MET A 452 -69.118 -27.035 -37.826 1.00 0.00 H new ATOM 0 HE3 MET A 452 -67.924 -26.434 -36.650 1.00 0.00 H new ATOM 1601 N VAL A 453 -72.034 -24.424 -33.981 1.00 0.00 N ATOM 1602 CA VAL A 453 -72.227 -23.007 -33.819 1.00 0.00 C ATOM 1603 C VAL A 453 -70.898 -22.316 -33.633 1.00 0.00 C ATOM 1604 O VAL A 453 -69.934 -22.912 -33.128 1.00 0.00 O ATOM 1605 CB VAL A 453 -73.171 -22.674 -32.630 1.00 0.00 C ATOM 1606 CG1 VAL A 453 -74.413 -23.539 -32.679 1.00 0.00 C ATOM 1607 CG2 VAL A 453 -72.470 -22.819 -31.290 1.00 0.00 C ATOM 0 H VAL A 453 -71.555 -24.882 -33.206 1.00 0.00 H new ATOM 0 HA VAL A 453 -72.704 -22.641 -34.728 1.00 0.00 H new ATOM 0 HB VAL A 453 -73.466 -21.629 -32.730 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -75.062 -23.292 -31.839 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -74.945 -23.360 -33.613 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -74.127 -24.589 -32.620 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -73.166 -22.577 -30.487 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -72.121 -23.845 -31.171 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -71.619 -22.140 -31.249 1.00 0.00 H new ATOM 1617 N CYS A 454 -70.834 -21.082 -34.052 1.00 0.00 N ATOM 1618 CA CYS A 454 -69.631 -20.318 -33.935 1.00 0.00 C ATOM 1619 C CYS A 454 -69.525 -19.705 -32.557 1.00 0.00 C ATOM 1620 O CYS A 454 -70.191 -18.703 -32.255 1.00 0.00 O ATOM 1621 CB CYS A 454 -69.582 -19.227 -35.002 1.00 0.00 C ATOM 1622 SG CYS A 454 -68.109 -18.157 -34.915 1.00 0.00 S ATOM 0 H CYS A 454 -71.613 -20.583 -34.482 1.00 0.00 H new ATOM 0 HA CYS A 454 -68.785 -20.989 -34.085 1.00 0.00 H new ATOM 0 HB2 CYS A 454 -69.619 -19.695 -35.986 1.00 0.00 H new ATOM 0 HB3 CYS A 454 -70.473 -18.606 -34.911 1.00 0.00 H new ATOM 0 HG CYS A 454 -68.451 -16.927 -35.161 1.00 0.00 H new ATOM 1627 N THR A 455 -68.733 -20.320 -31.708 1.00 0.00 N ATOM 1628 CA THR A 455 -68.498 -19.773 -30.411 1.00 0.00 C ATOM 1629 C THR A 455 -67.441 -18.697 -30.515 1.00 0.00 C ATOM 1630 O THR A 455 -66.236 -18.968 -30.467 1.00 0.00 O ATOM 1631 CB THR A 455 -68.072 -20.857 -29.402 1.00 0.00 C ATOM 1632 OG1 THR A 455 -67.133 -21.760 -30.013 1.00 0.00 O ATOM 1633 CG2 THR A 455 -69.283 -21.638 -28.911 1.00 0.00 C ATOM 0 H THR A 455 -68.247 -21.196 -31.901 1.00 0.00 H new ATOM 0 HA THR A 455 -69.428 -19.343 -30.041 1.00 0.00 H new ATOM 0 HB THR A 455 -67.601 -20.366 -28.551 1.00 0.00 H new ATOM 0 HG1 THR A 455 -66.424 -21.246 -30.453 1.00 0.00 H new ATOM 0 HG21 THR A 455 -68.961 -22.399 -28.200 1.00 0.00 H new ATOM 0 HG22 THR A 455 -69.982 -20.958 -28.424 1.00 0.00 H new ATOM 0 HG23 THR A 455 -69.774 -22.118 -29.758 1.00 0.00 H new ATOM 1641 N ARG A 456 -67.899 -17.487 -30.698 1.00 0.00 N ATOM 1642 CA ARG A 456 -67.036 -16.355 -30.864 1.00 0.00 C ATOM 1643 C ARG A 456 -67.506 -15.293 -29.877 1.00 0.00 C ATOM 1644 O ARG A 456 -68.714 -15.126 -29.694 1.00 0.00 O ATOM 1645 CB ARG A 456 -67.174 -15.837 -32.311 1.00 0.00 C ATOM 1646 CG ARG A 456 -65.914 -15.252 -32.973 1.00 0.00 C ATOM 1647 CD ARG A 456 -65.109 -14.355 -32.055 1.00 0.00 C ATOM 1648 NE ARG A 456 -64.235 -15.125 -31.170 1.00 0.00 N ATOM 1649 CZ ARG A 456 -63.240 -14.610 -30.454 1.00 0.00 C ATOM 1650 NH1 ARG A 456 -62.985 -13.306 -30.494 1.00 0.00 N1+ ATOM 1651 NH2 ARG A 456 -62.498 -15.404 -29.701 1.00 0.00 N ATOM 0 H ARG A 456 -68.893 -17.261 -30.736 1.00 0.00 H new ATOM 0 HA ARG A 456 -65.992 -16.608 -30.682 1.00 0.00 H new ATOM 0 HB2 ARG A 456 -67.530 -16.659 -32.931 1.00 0.00 H new ATOM 0 HB3 ARG A 456 -67.948 -15.070 -32.323 1.00 0.00 H new ATOM 0 HG2 ARG A 456 -65.280 -16.070 -33.316 1.00 0.00 H new ATOM 0 HG3 ARG A 456 -66.208 -14.685 -33.856 1.00 0.00 H new ATOM 0 HD2 ARG A 456 -64.508 -13.670 -32.652 1.00 0.00 H new ATOM 0 HD3 ARG A 456 -65.787 -13.746 -31.456 1.00 0.00 H new ATOM 0 HE ARG A 456 -64.401 -16.129 -31.097 1.00 0.00 H new ATOM 0 HH11 ARG A 456 -63.555 -12.693 -31.077 1.00 0.00 H new ATOM 0 HH12 ARG A 456 -62.220 -12.919 -29.942 1.00 0.00 H new ATOM 0 HH21 ARG A 456 -62.690 -16.405 -29.672 1.00 0.00 H new ATOM 0 HH22 ARG A 456 -61.733 -15.015 -29.149 1.00 0.00 H new ATOM 1665 N ALA A 457 -66.567 -14.603 -29.242 1.00 0.00 N ATOM 1666 CA ALA A 457 -66.882 -13.572 -28.249 1.00 0.00 C ATOM 1667 C ALA A 457 -67.992 -12.630 -28.724 1.00 0.00 C ATOM 1668 O ALA A 457 -68.928 -12.333 -27.977 1.00 0.00 O ATOM 1669 CB ALA A 457 -65.632 -12.785 -27.897 1.00 0.00 C ATOM 0 H ALA A 457 -65.568 -14.738 -29.397 1.00 0.00 H new ATOM 0 HA ALA A 457 -67.251 -14.079 -27.358 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -65.878 -12.022 -27.159 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -64.881 -13.460 -27.485 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -65.238 -12.308 -28.794 1.00 0.00 H new ATOM 1675 N GLY A 458 -67.895 -12.178 -29.963 1.00 0.00 N ATOM 1676 CA GLY A 458 -68.906 -11.300 -30.504 1.00 0.00 C ATOM 1677 C GLY A 458 -69.546 -11.849 -31.764 1.00 0.00 C ATOM 1678 O GLY A 458 -69.471 -11.226 -32.820 1.00 0.00 O ATOM 0 H GLY A 458 -67.134 -12.404 -30.603 1.00 0.00 H new ATOM 0 HA2 GLY A 458 -69.678 -11.135 -29.752 1.00 0.00 H new ATOM 0 HA3 GLY A 458 -68.460 -10.330 -30.721 1.00 0.00 H new ATOM 1682 N CYS A 459 -70.158 -13.029 -31.663 1.00 0.00 N ATOM 1683 CA CYS A 459 -70.846 -13.634 -32.804 1.00 0.00 C ATOM 1684 C CYS A 459 -72.064 -14.424 -32.344 1.00 0.00 C ATOM 1685 O CYS A 459 -73.184 -13.908 -32.353 1.00 0.00 O ATOM 1686 CB CYS A 459 -69.897 -14.538 -33.606 1.00 0.00 C ATOM 1687 SG CYS A 459 -70.589 -15.191 -35.164 1.00 0.00 S ATOM 0 H CYS A 459 -70.192 -13.583 -30.807 1.00 0.00 H new ATOM 0 HA CYS A 459 -71.181 -12.827 -33.455 1.00 0.00 H new ATOM 0 HB2 CYS A 459 -68.991 -13.976 -33.835 1.00 0.00 H new ATOM 0 HB3 CYS A 459 -69.601 -15.378 -32.977 1.00 0.00 H new ATOM 0 HG CYS A 459 -69.652 -15.254 -36.063 1.00 0.00 H new ATOM 1692 N GLY A 460 -71.841 -15.665 -31.929 1.00 0.00 N ATOM 1693 CA GLY A 460 -72.936 -16.511 -31.499 1.00 0.00 C ATOM 1694 C GLY A 460 -73.824 -16.894 -32.659 1.00 0.00 C ATOM 1695 O GLY A 460 -75.051 -16.758 -32.592 1.00 0.00 O ATOM 0 H GLY A 460 -70.920 -16.100 -31.883 1.00 0.00 H new ATOM 0 HA2 GLY A 460 -72.540 -17.411 -31.029 1.00 0.00 H new ATOM 0 HA3 GLY A 460 -73.525 -15.991 -30.744 1.00 0.00 H new ATOM 1699 N PHE A 461 -73.205 -17.364 -33.722 1.00 0.00 N ATOM 1700 CA PHE A 461 -73.919 -17.721 -34.931 1.00 0.00 C ATOM 1701 C PHE A 461 -74.144 -19.226 -35.011 1.00 0.00 C ATOM 1702 O PHE A 461 -73.193 -20.008 -34.993 1.00 0.00 O ATOM 1703 CB PHE A 461 -73.128 -17.243 -36.153 1.00 0.00 C ATOM 1704 CG PHE A 461 -73.849 -17.387 -37.457 1.00 0.00 C ATOM 1705 CD1 PHE A 461 -74.810 -16.469 -37.834 1.00 0.00 C ATOM 1706 CD2 PHE A 461 -73.559 -18.434 -38.312 1.00 0.00 C ATOM 1707 CE1 PHE A 461 -75.464 -16.591 -39.039 1.00 0.00 C ATOM 1708 CE2 PHE A 461 -74.214 -18.563 -39.516 1.00 0.00 C ATOM 1709 CZ PHE A 461 -75.166 -17.642 -39.880 1.00 0.00 C ATOM 0 H PHE A 461 -72.197 -17.509 -33.773 1.00 0.00 H new ATOM 0 HA PHE A 461 -74.894 -17.235 -34.913 1.00 0.00 H new ATOM 0 HB2 PHE A 461 -72.865 -16.195 -36.012 1.00 0.00 H new ATOM 0 HB3 PHE A 461 -72.194 -17.802 -36.206 1.00 0.00 H new ATOM 0 HD1 PHE A 461 -75.051 -15.647 -37.176 1.00 0.00 H new ATOM 0 HD2 PHE A 461 -72.810 -19.159 -38.032 1.00 0.00 H new ATOM 0 HE1 PHE A 461 -76.210 -15.864 -39.325 1.00 0.00 H new ATOM 0 HE2 PHE A 461 -73.980 -19.387 -40.173 1.00 0.00 H new ATOM 0 HZ PHE A 461 -75.681 -17.741 -40.824 1.00 0.00 H new ATOM 1719 N GLU A 462 -75.400 -19.625 -35.075 1.00 0.00 N ATOM 1720 CA GLU A 462 -75.748 -21.024 -35.229 1.00 0.00 C ATOM 1721 C GLU A 462 -75.949 -21.346 -36.698 1.00 0.00 C ATOM 1722 O GLU A 462 -76.614 -20.594 -37.421 1.00 0.00 O ATOM 1723 CB GLU A 462 -77.021 -21.366 -34.453 1.00 0.00 C ATOM 1724 CG GLU A 462 -76.910 -21.179 -32.953 1.00 0.00 C ATOM 1725 CD GLU A 462 -78.106 -21.735 -32.217 1.00 0.00 C ATOM 1726 OE1 GLU A 462 -79.097 -20.995 -32.035 1.00 0.00 O ATOM 1727 OE2 GLU A 462 -78.062 -22.918 -31.811 1.00 0.00 O1- ATOM 0 H GLU A 462 -76.201 -18.995 -35.022 1.00 0.00 H new ATOM 0 HA GLU A 462 -74.929 -21.622 -34.828 1.00 0.00 H new ATOM 0 HB2 GLU A 462 -77.836 -20.745 -34.825 1.00 0.00 H new ATOM 0 HB3 GLU A 462 -77.290 -22.402 -34.659 1.00 0.00 H new ATOM 0 HG2 GLU A 462 -76.005 -21.669 -32.594 1.00 0.00 H new ATOM 0 HG3 GLU A 462 -76.809 -20.117 -32.728 1.00 0.00 H new ATOM 1734 N TRP A 463 -75.377 -22.447 -37.140 1.00 0.00 N ATOM 1735 CA TRP A 463 -75.499 -22.861 -38.522 1.00 0.00 C ATOM 1736 C TRP A 463 -75.581 -24.378 -38.637 1.00 0.00 C ATOM 1737 O TRP A 463 -75.243 -25.105 -37.696 1.00 0.00 O ATOM 1738 CB TRP A 463 -74.342 -22.296 -39.377 1.00 0.00 C ATOM 1739 CG TRP A 463 -72.966 -22.438 -38.771 1.00 0.00 C ATOM 1740 CD1 TRP A 463 -72.449 -21.719 -37.729 1.00 0.00 C ATOM 1741 CD2 TRP A 463 -71.924 -23.331 -39.190 1.00 0.00 C ATOM 1742 NE1 TRP A 463 -71.163 -22.115 -37.470 1.00 0.00 N ATOM 1743 CE2 TRP A 463 -70.815 -23.103 -38.351 1.00 0.00 C ATOM 1744 CE3 TRP A 463 -71.823 -24.304 -40.188 1.00 0.00 C ATOM 1745 CZ2 TRP A 463 -69.624 -23.808 -38.481 1.00 0.00 C ATOM 1746 CZ3 TRP A 463 -70.639 -25.005 -40.316 1.00 0.00 C ATOM 1747 CH2 TRP A 463 -69.554 -24.753 -39.467 1.00 0.00 C ATOM 0 H TRP A 463 -74.820 -23.074 -36.559 1.00 0.00 H new ATOM 0 HA TRP A 463 -76.430 -22.450 -38.912 1.00 0.00 H new ATOM 0 HB2 TRP A 463 -74.349 -22.797 -40.345 1.00 0.00 H new ATOM 0 HB3 TRP A 463 -74.532 -21.239 -39.564 1.00 0.00 H new ATOM 0 HD1 TRP A 463 -72.979 -20.949 -37.188 1.00 0.00 H new ATOM 0 HE1 TRP A 463 -70.562 -21.735 -36.739 1.00 0.00 H new ATOM 0 HE3 TRP A 463 -72.655 -24.504 -40.847 1.00 0.00 H new ATOM 0 HZ2 TRP A 463 -68.785 -23.617 -37.828 1.00 0.00 H new ATOM 0 HZ3 TRP A 463 -70.549 -25.760 -41.083 1.00 0.00 H new ATOM 0 HH2 TRP A 463 -68.642 -25.317 -39.594 1.00 0.00 H new ATOM 1758 N CYS A 464 -76.070 -24.852 -39.771 1.00 0.00 N ATOM 1759 CA CYS A 464 -76.187 -26.277 -40.018 1.00 0.00 C ATOM 1760 C CYS A 464 -74.824 -26.869 -40.356 1.00 0.00 C ATOM 1761 O CYS A 464 -74.058 -26.287 -41.123 1.00 0.00 O ATOM 1762 CB CYS A 464 -77.130 -26.527 -41.176 1.00 0.00 C ATOM 1763 SG CYS A 464 -78.706 -25.618 -41.091 1.00 0.00 S ATOM 0 H CYS A 464 -76.394 -24.265 -40.539 1.00 0.00 H new ATOM 0 HA CYS A 464 -76.576 -26.750 -39.116 1.00 0.00 H new ATOM 0 HB2 CYS A 464 -76.623 -26.260 -42.103 1.00 0.00 H new ATOM 0 HB3 CYS A 464 -77.345 -27.594 -41.227 1.00 0.00 H new ATOM 0 HG CYS A 464 -79.525 -26.085 -41.986 1.00 0.00 H new ATOM 1768 N TRP A 465 -74.539 -28.023 -39.795 1.00 0.00 N ATOM 1769 CA TRP A 465 -73.278 -28.710 -40.049 1.00 0.00 C ATOM 1770 C TRP A 465 -73.193 -29.223 -41.490 1.00 0.00 C ATOM 1771 O TRP A 465 -72.171 -29.057 -42.158 1.00 0.00 O ATOM 1772 CB TRP A 465 -73.104 -29.865 -39.055 1.00 0.00 C ATOM 1773 CG TRP A 465 -72.190 -30.961 -39.522 1.00 0.00 C ATOM 1774 CD1 TRP A 465 -72.553 -32.238 -39.843 1.00 0.00 C ATOM 1775 CD2 TRP A 465 -70.775 -30.883 -39.728 1.00 0.00 C ATOM 1776 NE1 TRP A 465 -71.455 -32.954 -40.235 1.00 0.00 N ATOM 1777 CE2 TRP A 465 -70.351 -32.147 -40.174 1.00 0.00 C ATOM 1778 CE3 TRP A 465 -69.825 -29.867 -39.579 1.00 0.00 C ATOM 1779 CZ2 TRP A 465 -69.027 -32.424 -40.474 1.00 0.00 C ATOM 1780 CZ3 TRP A 465 -68.506 -30.144 -39.877 1.00 0.00 C ATOM 1781 CH2 TRP A 465 -68.117 -31.411 -40.319 1.00 0.00 C ATOM 0 H TRP A 465 -75.163 -28.514 -39.155 1.00 0.00 H new ATOM 0 HA TRP A 465 -72.469 -27.993 -39.911 1.00 0.00 H new ATOM 0 HB2 TRP A 465 -72.719 -29.465 -38.117 1.00 0.00 H new ATOM 0 HB3 TRP A 465 -74.083 -30.293 -38.841 1.00 0.00 H new ATOM 0 HD1 TRP A 465 -73.560 -32.626 -39.794 1.00 0.00 H new ATOM 0 HE1 TRP A 465 -71.459 -33.932 -40.526 1.00 0.00 H new ATOM 0 HE3 TRP A 465 -70.118 -28.885 -39.238 1.00 0.00 H new ATOM 0 HZ2 TRP A 465 -68.723 -33.402 -40.817 1.00 0.00 H new ATOM 0 HZ3 TRP A 465 -67.762 -29.369 -39.767 1.00 0.00 H new ATOM 0 HH2 TRP A 465 -67.077 -31.596 -40.543 1.00 0.00 H new ATOM 1792 N VAL A 466 -74.266 -29.843 -41.961 1.00 0.00 N ATOM 1793 CA VAL A 466 -74.280 -30.424 -43.297 1.00 0.00 C ATOM 1794 C VAL A 466 -74.336 -29.338 -44.373 1.00 0.00 C ATOM 1795 O VAL A 466 -73.401 -29.192 -45.168 1.00 0.00 O ATOM 1796 CB VAL A 466 -75.451 -31.415 -43.472 1.00 0.00 C ATOM 1797 CG1 VAL A 466 -75.384 -32.096 -44.831 1.00 0.00 C ATOM 1798 CG2 VAL A 466 -75.434 -32.450 -42.354 1.00 0.00 C ATOM 0 H VAL A 466 -75.136 -29.957 -41.440 1.00 0.00 H new ATOM 0 HA VAL A 466 -73.349 -30.978 -43.416 1.00 0.00 H new ATOM 0 HB VAL A 466 -76.386 -30.858 -43.419 1.00 0.00 H new ATOM 0 HG11 VAL A 466 -76.219 -32.790 -44.932 1.00 0.00 H new ATOM 0 HG12 VAL A 466 -75.440 -31.344 -45.618 1.00 0.00 H new ATOM 0 HG13 VAL A 466 -74.445 -32.643 -44.918 1.00 0.00 H new ATOM 0 HG21 VAL A 466 -76.264 -33.144 -42.488 1.00 0.00 H new ATOM 0 HG22 VAL A 466 -74.493 -33.000 -42.382 1.00 0.00 H new ATOM 0 HG23 VAL A 466 -75.532 -31.948 -41.392 1.00 0.00 H new ATOM 1808 N CYS A 467 -75.417 -28.580 -44.401 1.00 0.00 N ATOM 1809 CA CYS A 467 -75.541 -27.481 -45.339 1.00 0.00 C ATOM 1810 C CYS A 467 -75.196 -26.192 -44.640 1.00 0.00 C ATOM 1811 O CYS A 467 -75.774 -25.881 -43.617 1.00 0.00 O ATOM 1812 CB CYS A 467 -76.971 -27.405 -45.905 1.00 0.00 C ATOM 1813 SG CYS A 467 -78.290 -27.322 -44.654 1.00 0.00 S ATOM 0 H CYS A 467 -76.221 -28.706 -43.785 1.00 0.00 H new ATOM 0 HA CYS A 467 -74.855 -27.646 -46.170 1.00 0.00 H new ATOM 0 HB2 CYS A 467 -77.045 -26.528 -46.548 1.00 0.00 H new ATOM 0 HB3 CYS A 467 -77.143 -28.278 -46.535 1.00 0.00 H new ATOM 0 HG CYS A 467 -78.356 -26.116 -44.173 1.00 0.00 H new ATOM 1818 N GLN A 468 -74.278 -25.422 -45.175 1.00 0.00 N ATOM 1819 CA GLN A 468 -73.953 -24.187 -44.509 1.00 0.00 C ATOM 1820 C GLN A 468 -75.076 -23.200 -44.748 1.00 0.00 C ATOM 1821 O GLN A 468 -75.275 -22.704 -45.855 1.00 0.00 O ATOM 1822 CB GLN A 468 -72.600 -23.632 -44.984 1.00 0.00 C ATOM 1823 CG GLN A 468 -72.482 -23.450 -46.491 1.00 0.00 C ATOM 1824 CD GLN A 468 -71.147 -22.868 -46.901 1.00 0.00 C ATOM 1825 OE1 GLN A 468 -70.131 -23.087 -46.241 1.00 0.00 O ATOM 1826 NE2 GLN A 468 -71.137 -22.130 -47.988 1.00 0.00 N ATOM 0 H GLN A 468 -73.763 -25.617 -46.033 1.00 0.00 H new ATOM 0 HA GLN A 468 -73.852 -24.366 -43.439 1.00 0.00 H new ATOM 0 HB2 GLN A 468 -72.427 -22.670 -44.501 1.00 0.00 H new ATOM 0 HB3 GLN A 468 -71.809 -24.304 -44.650 1.00 0.00 H new ATOM 0 HG2 GLN A 468 -72.621 -24.413 -46.982 1.00 0.00 H new ATOM 0 HG3 GLN A 468 -73.282 -22.796 -46.839 1.00 0.00 H new ATOM 0 HE21 GLN A 468 -72.002 -21.973 -48.506 1.00 0.00 H new ATOM 0 HE22 GLN A 468 -70.265 -21.714 -48.314 1.00 0.00 H new ATOM 1835 N THR A 469 -75.809 -22.934 -43.697 1.00 0.00 N ATOM 1836 CA THR A 469 -76.966 -22.082 -43.754 1.00 0.00 C ATOM 1837 C THR A 469 -77.224 -21.466 -42.396 1.00 0.00 C ATOM 1838 O THR A 469 -76.792 -22.003 -41.378 1.00 0.00 O ATOM 1839 CB THR A 469 -78.221 -22.884 -44.200 1.00 0.00 C ATOM 1840 OG1 THR A 469 -78.121 -24.249 -43.745 1.00 0.00 O ATOM 1841 CG2 THR A 469 -78.379 -22.867 -45.712 1.00 0.00 C ATOM 0 H THR A 469 -75.616 -23.308 -42.768 1.00 0.00 H new ATOM 0 HA THR A 469 -76.772 -21.295 -44.483 1.00 0.00 H new ATOM 0 HB THR A 469 -79.096 -22.409 -43.756 1.00 0.00 H new ATOM 0 HG1 THR A 469 -78.372 -24.298 -42.799 1.00 0.00 H new ATOM 0 HG21 THR A 469 -79.265 -23.436 -45.992 1.00 0.00 H new ATOM 0 HG22 THR A 469 -78.486 -21.838 -46.055 1.00 0.00 H new ATOM 0 HG23 THR A 469 -77.499 -23.315 -46.175 1.00 0.00 H new ATOM 1849 N GLU A 470 -77.900 -20.344 -42.382 1.00 0.00 N ATOM 1850 CA GLU A 470 -78.241 -19.693 -41.142 1.00 0.00 C ATOM 1851 C GLU A 470 -79.535 -20.273 -40.604 1.00 0.00 C ATOM 1852 O GLU A 470 -80.480 -20.495 -41.372 1.00 0.00 O ATOM 1853 CB GLU A 470 -78.405 -18.188 -41.363 1.00 0.00 C ATOM 1854 CG GLU A 470 -78.691 -17.404 -40.091 1.00 0.00 C ATOM 1855 CD GLU A 470 -78.914 -15.933 -40.354 1.00 0.00 C ATOM 1856 OE1 GLU A 470 -77.923 -15.180 -40.442 1.00 0.00 O ATOM 1857 OE2 GLU A 470 -80.085 -15.522 -40.472 1.00 0.00 O1- ATOM 0 H GLU A 470 -78.226 -19.861 -43.219 1.00 0.00 H new ATOM 0 HA GLU A 470 -77.439 -19.859 -40.422 1.00 0.00 H new ATOM 0 HB2 GLU A 470 -77.497 -17.797 -41.822 1.00 0.00 H new ATOM 0 HB3 GLU A 470 -79.217 -18.021 -42.071 1.00 0.00 H new ATOM 0 HG2 GLU A 470 -79.572 -17.820 -39.603 1.00 0.00 H new ATOM 0 HG3 GLU A 470 -77.857 -17.524 -39.399 1.00 0.00 H new ATOM 1864 N TRP A 471 -79.568 -20.547 -39.304 1.00 0.00 N ATOM 1865 CA TRP A 471 -80.782 -21.033 -38.659 1.00 0.00 C ATOM 1866 C TRP A 471 -81.919 -20.057 -38.913 1.00 0.00 C ATOM 1867 O TRP A 471 -81.952 -18.953 -38.357 1.00 0.00 O ATOM 1868 CB TRP A 471 -80.554 -21.225 -37.162 1.00 0.00 C ATOM 1869 CG TRP A 471 -79.957 -22.553 -36.815 1.00 0.00 C ATOM 1870 CD1 TRP A 471 -78.817 -23.095 -37.321 1.00 0.00 C ATOM 1871 CD2 TRP A 471 -80.473 -23.508 -35.880 1.00 0.00 C ATOM 1872 NE1 TRP A 471 -78.587 -24.324 -36.762 1.00 0.00 N ATOM 1873 CE2 TRP A 471 -79.590 -24.603 -35.874 1.00 0.00 C ATOM 1874 CE3 TRP A 471 -81.593 -23.543 -35.049 1.00 0.00 C ATOM 1875 CZ2 TRP A 471 -79.794 -25.719 -35.069 1.00 0.00 C ATOM 1876 CZ3 TRP A 471 -81.793 -24.653 -34.252 1.00 0.00 C ATOM 1877 CH2 TRP A 471 -80.898 -25.726 -34.266 1.00 0.00 C ATOM 0 H TRP A 471 -78.770 -20.441 -38.678 1.00 0.00 H new ATOM 0 HA TRP A 471 -81.049 -22.001 -39.082 1.00 0.00 H new ATOM 0 HB2 TRP A 471 -79.898 -20.434 -36.798 1.00 0.00 H new ATOM 0 HB3 TRP A 471 -81.505 -21.116 -36.641 1.00 0.00 H new ATOM 0 HD1 TRP A 471 -78.184 -22.624 -38.058 1.00 0.00 H new ATOM 0 HE1 TRP A 471 -77.796 -24.933 -36.973 1.00 0.00 H new ATOM 0 HE3 TRP A 471 -82.290 -22.718 -35.029 1.00 0.00 H new ATOM 0 HZ2 TRP A 471 -79.104 -26.550 -35.079 1.00 0.00 H new ATOM 0 HZ3 TRP A 471 -82.657 -24.692 -33.606 1.00 0.00 H new ATOM 0 HH2 TRP A 471 -81.083 -26.578 -33.629 1.00 0.00 H new ATOM 1888 N THR A 472 -82.830 -20.460 -39.767 1.00 0.00 N ATOM 1889 CA THR A 472 -83.917 -19.611 -40.200 1.00 0.00 C ATOM 1890 C THR A 472 -85.203 -20.407 -40.313 1.00 0.00 C ATOM 1891 O THR A 472 -85.302 -21.515 -39.789 1.00 0.00 O ATOM 1892 CB THR A 472 -83.585 -18.992 -41.574 1.00 0.00 C ATOM 1893 OG1 THR A 472 -82.946 -19.982 -42.404 1.00 0.00 O ATOM 1894 CG2 THR A 472 -82.673 -17.784 -41.426 1.00 0.00 C ATOM 0 H THR A 472 -82.839 -21.391 -40.184 1.00 0.00 H new ATOM 0 HA THR A 472 -84.049 -18.821 -39.461 1.00 0.00 H new ATOM 0 HB THR A 472 -84.515 -18.662 -42.037 1.00 0.00 H new ATOM 0 HG1 THR A 472 -82.007 -20.075 -42.138 1.00 0.00 H new ATOM 0 HG21 THR A 472 -82.456 -17.369 -42.410 1.00 0.00 H new ATOM 0 HG22 THR A 472 -83.166 -17.029 -40.814 1.00 0.00 H new ATOM 0 HG23 THR A 472 -81.742 -18.087 -40.947 1.00 0.00 H new ATOM 1902 N ARG A 473 -86.190 -19.839 -40.983 1.00 0.00 N ATOM 1903 CA ARG A 473 -87.448 -20.524 -41.208 1.00 0.00 C ATOM 1904 C ARG A 473 -87.263 -21.611 -42.255 1.00 0.00 C ATOM 1905 O ARG A 473 -87.951 -22.629 -42.242 1.00 0.00 O ATOM 1906 CB ARG A 473 -88.526 -19.532 -41.668 1.00 0.00 C ATOM 1907 CG ARG A 473 -88.215 -18.871 -43.006 1.00 0.00 C ATOM 1908 CD ARG A 473 -89.322 -17.937 -43.453 1.00 0.00 C ATOM 1909 NE ARG A 473 -89.074 -17.417 -44.801 1.00 0.00 N ATOM 1910 CZ ARG A 473 -89.936 -16.676 -45.500 1.00 0.00 C ATOM 1911 NH1 ARG A 473 -91.089 -16.296 -44.960 1.00 0.00 N1+ ATOM 1912 NH2 ARG A 473 -89.634 -16.302 -46.736 1.00 0.00 N ATOM 0 H ARG A 473 -86.143 -18.901 -41.382 1.00 0.00 H new ATOM 0 HA ARG A 473 -87.771 -20.978 -40.271 1.00 0.00 H new ATOM 0 HB2 ARG A 473 -89.480 -20.054 -41.743 1.00 0.00 H new ATOM 0 HB3 ARG A 473 -88.644 -18.759 -40.909 1.00 0.00 H new ATOM 0 HG2 ARG A 473 -87.282 -18.314 -42.926 1.00 0.00 H new ATOM 0 HG3 ARG A 473 -88.063 -19.640 -43.763 1.00 0.00 H new ATOM 0 HD2 ARG A 473 -90.275 -18.466 -43.435 1.00 0.00 H new ATOM 0 HD3 ARG A 473 -89.405 -17.107 -42.751 1.00 0.00 H new ATOM 0 HE ARG A 473 -88.178 -17.637 -45.236 1.00 0.00 H new ATOM 0 HH11 ARG A 473 -91.320 -16.571 -44.005 1.00 0.00 H new ATOM 0 HH12 ARG A 473 -91.743 -15.730 -45.500 1.00 0.00 H new ATOM 0 HH21 ARG A 473 -88.745 -16.581 -47.150 1.00 0.00 H new ATOM 0 HH22 ARG A 473 -90.291 -15.736 -47.272 1.00 0.00 H new ATOM 1926 N ASP A 474 -86.318 -21.383 -43.160 1.00 0.00 N ATOM 1927 CA ASP A 474 -86.017 -22.335 -44.215 1.00 0.00 C ATOM 1928 C ASP A 474 -85.307 -23.538 -43.614 1.00 0.00 C ATOM 1929 O ASP A 474 -85.780 -24.674 -43.713 1.00 0.00 O ATOM 1930 CB ASP A 474 -85.146 -21.677 -45.281 1.00 0.00 C ATOM 1931 CG ASP A 474 -85.107 -22.461 -46.573 1.00 0.00 C ATOM 1932 OD1 ASP A 474 -84.271 -23.380 -46.694 1.00 0.00 O ATOM 1933 OD2 ASP A 474 -85.903 -22.149 -47.484 1.00 0.00 O1- ATOM 0 H ASP A 474 -85.745 -20.539 -43.181 1.00 0.00 H new ATOM 0 HA ASP A 474 -86.943 -22.665 -44.686 1.00 0.00 H new ATOM 0 HB2 ASP A 474 -85.521 -20.674 -45.482 1.00 0.00 H new ATOM 0 HB3 ASP A 474 -84.132 -21.567 -44.898 1.00 0.00 H new ATOM 1938 N CYS A 475 -84.174 -23.280 -42.972 1.00 0.00 N ATOM 1939 CA CYS A 475 -83.455 -24.315 -42.255 1.00 0.00 C ATOM 1940 C CYS A 475 -83.808 -24.248 -40.779 1.00 0.00 C ATOM 1941 O CYS A 475 -83.001 -23.829 -39.957 1.00 0.00 O ATOM 1942 CB CYS A 475 -81.931 -24.193 -42.439 1.00 0.00 C ATOM 1943 SG CYS A 475 -81.295 -24.818 -44.036 1.00 0.00 S ATOM 0 H CYS A 475 -83.736 -22.359 -42.936 1.00 0.00 H new ATOM 0 HA CYS A 475 -83.756 -25.278 -42.667 1.00 0.00 H new ATOM 0 HB2 CYS A 475 -81.650 -23.145 -42.338 1.00 0.00 H new ATOM 0 HB3 CYS A 475 -81.438 -24.734 -41.631 1.00 0.00 H new ATOM 0 HG CYS A 475 -80.678 -25.947 -43.846 1.00 0.00 H new ATOM 1948 N MET A 476 -85.037 -24.616 -40.459 1.00 0.00 N ATOM 1949 CA MET A 476 -85.493 -24.617 -39.073 1.00 0.00 C ATOM 1950 C MET A 476 -85.243 -25.987 -38.458 1.00 0.00 C ATOM 1951 O MET A 476 -85.604 -26.252 -37.312 1.00 0.00 O ATOM 1952 CB MET A 476 -86.992 -24.264 -38.989 1.00 0.00 C ATOM 1953 CG MET A 476 -87.946 -25.421 -39.274 1.00 0.00 C ATOM 1954 SD MET A 476 -87.760 -26.123 -40.923 1.00 0.00 S ATOM 1955 CE MET A 476 -89.039 -27.383 -40.880 1.00 0.00 C ATOM 0 H MET A 476 -85.738 -24.918 -41.136 1.00 0.00 H new ATOM 0 HA MET A 476 -84.935 -23.862 -38.519 1.00 0.00 H new ATOM 0 HB2 MET A 476 -87.203 -23.877 -37.992 1.00 0.00 H new ATOM 0 HB3 MET A 476 -87.200 -23.460 -39.694 1.00 0.00 H new ATOM 0 HG2 MET A 476 -87.783 -26.205 -38.534 1.00 0.00 H new ATOM 0 HG3 MET A 476 -88.972 -25.074 -39.150 1.00 0.00 H new ATOM 0 HE1 MET A 476 -89.355 -27.615 -41.897 1.00 0.00 H new ATOM 0 HE2 MET A 476 -88.647 -28.284 -40.408 1.00 0.00 H new ATOM 0 HE3 MET A 476 -89.892 -27.016 -40.309 1.00 0.00 H new ATOM 1965 N GLY A 477 -84.608 -26.846 -39.235 1.00 0.00 N ATOM 1966 CA GLY A 477 -84.366 -28.201 -38.816 1.00 0.00 C ATOM 1967 C GLY A 477 -84.986 -29.194 -39.780 1.00 0.00 C ATOM 1968 O GLY A 477 -85.070 -30.382 -39.494 1.00 0.00 O ATOM 0 H GLY A 477 -84.252 -26.620 -40.164 1.00 0.00 H new ATOM 0 HA2 GLY A 477 -83.292 -28.377 -38.749 1.00 0.00 H new ATOM 0 HA3 GLY A 477 -84.777 -28.354 -37.818 1.00 0.00 H new ATOM 1972 N ALA A 478 -85.398 -28.692 -40.945 1.00 0.00 N ATOM 1973 CA ALA A 478 -86.050 -29.509 -41.981 1.00 0.00 C ATOM 1974 C ALA A 478 -85.143 -30.627 -42.511 1.00 0.00 C ATOM 1975 O ALA A 478 -85.613 -31.594 -43.106 1.00 0.00 O ATOM 1976 CB ALA A 478 -86.501 -28.619 -43.128 1.00 0.00 C ATOM 0 H ALA A 478 -85.292 -27.710 -41.201 1.00 0.00 H new ATOM 0 HA ALA A 478 -86.912 -29.990 -41.518 1.00 0.00 H new ATOM 0 HB1 ALA A 478 -86.983 -29.228 -43.893 1.00 0.00 H new ATOM 0 HB2 ALA A 478 -87.207 -27.877 -42.756 1.00 0.00 H new ATOM 0 HB3 ALA A 478 -85.636 -28.114 -43.558 1.00 0.00 H new ATOM 1982 N HIS A 479 -83.857 -30.482 -42.303 1.00 0.00 N ATOM 1983 CA HIS A 479 -82.887 -31.470 -42.757 1.00 0.00 C ATOM 1984 C HIS A 479 -82.086 -31.992 -41.573 1.00 0.00 C ATOM 1985 O HIS A 479 -81.092 -32.697 -41.738 1.00 0.00 O ATOM 1986 CB HIS A 479 -81.937 -30.825 -43.772 1.00 0.00 C ATOM 1987 CG HIS A 479 -81.240 -29.621 -43.227 1.00 0.00 C ATOM 1988 ND1 HIS A 479 -80.244 -29.686 -42.283 1.00 0.00 N ATOM 1989 CD2 HIS A 479 -81.453 -28.304 -43.462 1.00 0.00 C ATOM 1990 CE1 HIS A 479 -79.894 -28.441 -41.971 1.00 0.00 C ATOM 1991 NE2 HIS A 479 -80.596 -27.559 -42.661 1.00 0.00 N ATOM 0 H HIS A 479 -83.447 -29.684 -41.818 1.00 0.00 H new ATOM 0 HA HIS A 479 -83.415 -32.300 -43.226 1.00 0.00 H new ATOM 0 HB2 HIS A 479 -81.194 -31.559 -44.085 1.00 0.00 H new ATOM 0 HB3 HIS A 479 -82.500 -30.542 -44.661 1.00 0.00 H new ATOM 0 HD1 HIS A 479 -79.844 -30.538 -41.891 1.00 0.00 H new ATOM 0 HD2 HIS A 479 -82.172 -27.899 -44.159 1.00 0.00 H new ATOM 0 HE1 HIS A 479 -79.134 -28.184 -41.247 1.00 0.00 H new ATOM 1999 N TRP A 480 -82.521 -31.632 -40.390 1.00 0.00 N ATOM 2000 CA TRP A 480 -81.811 -31.974 -39.181 1.00 0.00 C ATOM 2001 C TRP A 480 -82.236 -33.352 -38.695 1.00 0.00 C ATOM 2002 O TRP A 480 -83.169 -33.485 -37.900 1.00 0.00 O ATOM 2003 CB TRP A 480 -82.092 -30.912 -38.120 1.00 0.00 C ATOM 2004 CG TRP A 480 -81.047 -30.788 -37.058 1.00 0.00 C ATOM 2005 CD1 TRP A 480 -80.912 -31.560 -35.941 1.00 0.00 C ATOM 2006 CD2 TRP A 480 -80.001 -29.805 -36.998 1.00 0.00 C ATOM 2007 NE1 TRP A 480 -79.850 -31.121 -35.193 1.00 0.00 N ATOM 2008 CE2 TRP A 480 -79.276 -30.046 -35.819 1.00 0.00 C ATOM 2009 CE3 TRP A 480 -79.602 -28.740 -37.829 1.00 0.00 C ATOM 2010 CZ2 TRP A 480 -78.189 -29.270 -35.448 1.00 0.00 C ATOM 2011 CZ3 TRP A 480 -78.524 -27.978 -37.454 1.00 0.00 C ATOM 2012 CH2 TRP A 480 -77.830 -28.242 -36.278 1.00 0.00 C ATOM 0 H TRP A 480 -83.375 -31.095 -40.238 1.00 0.00 H new ATOM 0 HA TRP A 480 -80.740 -32.004 -39.379 1.00 0.00 H new ATOM 0 HB2 TRP A 480 -82.203 -29.947 -38.614 1.00 0.00 H new ATOM 0 HB3 TRP A 480 -83.047 -31.138 -37.645 1.00 0.00 H new ATOM 0 HD1 TRP A 480 -81.548 -32.394 -35.684 1.00 0.00 H new ATOM 0 HE1 TRP A 480 -79.538 -31.529 -34.312 1.00 0.00 H new ATOM 0 HE3 TRP A 480 -80.134 -28.527 -38.744 1.00 0.00 H new ATOM 0 HZ2 TRP A 480 -77.645 -29.469 -34.537 1.00 0.00 H new ATOM 0 HZ3 TRP A 480 -78.209 -27.159 -38.083 1.00 0.00 H new ATOM 0 HH2 TRP A 480 -76.987 -27.621 -36.013 1.00 0.00 H new ATOM 2023 N PHE A 481 -81.585 -34.373 -39.216 1.00 0.00 N ATOM 2024 CA PHE A 481 -81.872 -35.738 -38.834 1.00 0.00 C ATOM 2025 C PHE A 481 -80.623 -36.593 -38.949 1.00 0.00 C ATOM 2026 O PHE A 481 -80.029 -36.700 -40.025 1.00 0.00 O ATOM 2027 CB PHE A 481 -82.995 -36.323 -39.701 1.00 0.00 C ATOM 2028 CG PHE A 481 -83.336 -37.749 -39.359 1.00 0.00 C ATOM 2029 CD1 PHE A 481 -84.085 -38.043 -38.232 1.00 0.00 C ATOM 2030 CD2 PHE A 481 -82.905 -38.793 -40.163 1.00 0.00 C ATOM 2031 CE1 PHE A 481 -84.397 -39.349 -37.913 1.00 0.00 C ATOM 2032 CE2 PHE A 481 -83.215 -40.101 -39.847 1.00 0.00 C ATOM 2033 CZ PHE A 481 -83.962 -40.379 -38.721 1.00 0.00 C ATOM 0 H PHE A 481 -80.846 -34.279 -39.913 1.00 0.00 H new ATOM 0 HA PHE A 481 -82.204 -35.737 -37.796 1.00 0.00 H new ATOM 0 HB2 PHE A 481 -83.888 -35.707 -39.590 1.00 0.00 H new ATOM 0 HB3 PHE A 481 -82.700 -36.270 -40.749 1.00 0.00 H new ATOM 0 HD1 PHE A 481 -84.429 -37.241 -37.595 1.00 0.00 H new ATOM 0 HD2 PHE A 481 -82.320 -38.581 -41.046 1.00 0.00 H new ATOM 0 HE1 PHE A 481 -84.982 -39.565 -37.031 1.00 0.00 H new ATOM 0 HE2 PHE A 481 -82.873 -40.906 -40.481 1.00 0.00 H new ATOM 0 HZ PHE A 481 -84.206 -41.401 -38.472 1.00 0.00 H new ATOM 2043 N GLY A 482 -80.227 -37.188 -37.846 1.00 0.00 N ATOM 2044 CA GLY A 482 -79.066 -38.039 -37.842 1.00 0.00 C ATOM 2045 C GLY A 482 -79.384 -39.391 -37.266 1.00 0.00 C ATOM 2046 O GLY A 482 -79.727 -40.309 -38.036 1.00 0.00 O ATOM 2047 OXT GLY A 482 -79.332 -39.534 -36.031 1.00 0.00 O ATOM 0 H GLY A 482 -80.693 -37.096 -36.943 1.00 0.00 H new ATOM 0 HA2 GLY A 482 -78.692 -38.153 -38.860 1.00 0.00 H new ATOM 0 HA3 GLY A 482 -78.271 -37.571 -37.261 1.00 0.00 H new