USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 915 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 97 SER OG : rot 140:sc= 0.556 USER MOD Set 1.2: A 100 SER OG : rot 13:sc= 0.0718 USER MOD Set 2.1: A 31 ASN : amide:sc= -4.23! C(o=-4.9!,f=-6.3!) USER MOD Set 2.2: A 106 TYR OH : rot 2:sc= -0.639! USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN :FLIP amide:sc= -1.28 F(o=-3.7!,f=-1.3) USER MOD Single : A 23 GLN :FLIP amide:sc= -3.81! C(o=-7.6!,f=-3.8!) USER MOD Single : A 32 LYS NZ :NH3+ -175:sc= 1.56 (180deg=1.32) USER MOD Single : A 33 GLN : amide:sc= -0.7 K(o=-0.7,f=-1.4) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot -146:sc= 1.47 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 167:sc= 1.79 (180deg=1.55) USER MOD Single : A 54 LYS NZ :NH3+ -173:sc= 0.894 (180deg=0.644) USER MOD Single : A 56 LYS NZ :NH3+ -133:sc= 0.672 (180deg=-1.48) USER MOD Single : A 57 TYR OH : rot 172:sc= 1.13 USER MOD Single : A 58 MET CE :methyl -157:sc= -0.259 (180deg=-1.09) USER MOD Single : A 63 ASN : amide:sc= 2.29 K(o=2.3,f=-1.3) USER MOD Single : A 65 ASN : amide:sc=-0.00826 X(o=-0.0083,f=-0.0083) USER MOD Single : A 71 MET CE :methyl -158:sc= -0.143 (180deg=-0.744) USER MOD Single : A 72 SER OG : rot 180:sc= 0.52 USER MOD Single : A 74 LYS NZ :NH3+ 166:sc= 1.21 (180deg=1.18) USER MOD Single : A 76 MET CE :methyl -129:sc= -1.95 (180deg=-3.73!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ -170:sc= -0.0264 (180deg=-0.137) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 HIS : no HD1:sc= 0 X(o=0,f=-0.00087) USER MOD Single : A 90 LYS NZ :NH3+ 168:sc= 0.514 (180deg=0.375) USER MOD Single : A 91 LYS NZ :NH3+ -138:sc= 0.557 (180deg=0.138) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -72:sc= 1.34 USER MOD Single : A 105 SER OG : rot 180:sc= -1.24 USER MOD Single : A 112 MET CE :methyl -159:sc= -0.172 (180deg=-0.752) USER MOD Single : A 113 MET CE :methyl -144:sc= -0.294 (180deg=-1.42) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 126 MET CE :methyl 158:sc= -0.207 (180deg=-0.818) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 245 N LEU A 18 12.037 3.985 -8.714 1.00 64.34 N ATOM 246 CA LEU A 18 11.448 3.501 -9.955 1.00 70.14 C ATOM 247 C LEU A 18 10.890 2.098 -9.848 1.00 61.13 C ATOM 248 O LEU A 18 10.533 1.488 -10.860 1.00 32.15 O ATOM 249 CB LEU A 18 12.402 3.629 -11.164 1.00 32.02 C ATOM 250 CG LEU A 18 12.585 5.034 -11.780 1.00 60.25 C ATOM 251 CD1 LEU A 18 11.266 5.572 -12.302 1.00 43.20 C ATOM 252 CD2 LEU A 18 13.202 6.009 -10.800 1.00 52.45 C ATOM 0 HA LEU A 18 10.602 4.164 -10.137 1.00 70.14 H new ATOM 0 HB2 LEU A 18 13.383 3.265 -10.859 1.00 32.02 H new ATOM 0 HB3 LEU A 18 12.044 2.962 -11.948 1.00 32.02 H new ATOM 0 HG LEU A 18 13.276 4.928 -12.616 1.00 60.25 H new ATOM 0 HD11 LEU A 18 11.421 6.562 -12.731 1.00 43.20 H new ATOM 0 HD12 LEU A 18 10.877 4.901 -13.068 1.00 43.20 H new ATOM 0 HD13 LEU A 18 10.551 5.639 -11.482 1.00 43.20 H new ATOM 0 HD21 LEU A 18 13.312 6.983 -11.276 1.00 52.45 H new ATOM 0 HD22 LEU A 18 12.558 6.103 -9.926 1.00 52.45 H new ATOM 0 HD23 LEU A 18 14.181 5.644 -10.491 1.00 52.45 H new ATOM 264 N LEU A 19 10.778 1.578 -8.638 1.00 24.21 N ATOM 265 CA LEU A 19 10.081 0.323 -8.474 1.00 73.40 C ATOM 266 C LEU A 19 8.627 0.475 -8.740 1.00 34.43 C ATOM 267 O LEU A 19 7.967 -0.488 -9.087 1.00 31.04 O ATOM 268 CB LEU A 19 10.302 -0.387 -7.160 1.00 42.43 C ATOM 269 CG LEU A 19 11.568 -1.202 -7.028 1.00 21.22 C ATOM 270 CD1 LEU A 19 12.814 -0.355 -6.869 1.00 10.43 C ATOM 271 CD2 LEU A 19 11.400 -2.222 -5.941 1.00 31.10 C ATOM 0 H LEU A 19 11.149 1.992 -7.783 1.00 24.21 H new ATOM 0 HA LEU A 19 10.534 -0.326 -9.223 1.00 73.40 H new ATOM 0 HB2 LEU A 19 10.295 0.359 -6.366 1.00 42.43 H new ATOM 0 HB3 LEU A 19 9.453 -1.048 -6.984 1.00 42.43 H new ATOM 0 HG LEU A 19 11.729 -1.731 -7.967 1.00 21.22 H new ATOM 0 HD11 LEU A 19 13.686 -1.003 -6.780 1.00 10.43 H new ATOM 0 HD12 LEU A 19 12.929 0.290 -7.740 1.00 10.43 H new ATOM 0 HD13 LEU A 19 12.725 0.259 -5.973 1.00 10.43 H new ATOM 0 HD21 LEU A 19 12.314 -2.808 -5.848 1.00 31.10 H new ATOM 0 HD22 LEU A 19 11.195 -1.717 -4.997 1.00 31.10 H new ATOM 0 HD23 LEU A 19 10.569 -2.883 -6.187 1.00 31.10 H new ATOM 283 N LYS A 20 8.118 1.697 -8.593 1.00 22.03 N ATOM 284 CA LYS A 20 6.733 1.983 -8.919 1.00 40.52 C ATOM 285 C LYS A 20 6.469 1.573 -10.369 1.00 52.24 C ATOM 286 O LYS A 20 5.451 0.989 -10.673 1.00 43.13 O ATOM 287 CB LYS A 20 6.411 3.470 -8.718 1.00 3.42 C ATOM 288 CG LYS A 20 6.620 3.976 -7.296 1.00 53.23 C ATOM 289 CD LYS A 20 6.222 5.441 -7.167 1.00 2.22 C ATOM 290 CE LYS A 20 6.449 5.961 -5.752 1.00 34.43 C ATOM 291 NZ LYS A 20 6.005 7.368 -5.603 1.00 60.43 N ATOM 0 H LYS A 20 8.647 2.499 -8.251 1.00 22.03 H new ATOM 0 HA LYS A 20 6.087 1.414 -8.250 1.00 40.52 H new ATOM 0 HB2 LYS A 20 7.032 4.058 -9.394 1.00 3.42 H new ATOM 0 HB3 LYS A 20 5.374 3.646 -9.004 1.00 3.42 H new ATOM 0 HG2 LYS A 20 6.031 3.374 -6.603 1.00 53.23 H new ATOM 0 HG3 LYS A 20 7.666 3.855 -7.014 1.00 53.23 H new ATOM 0 HD2 LYS A 20 6.799 6.039 -7.872 1.00 2.22 H new ATOM 0 HD3 LYS A 20 5.172 5.558 -7.434 1.00 2.22 H new ATOM 0 HE2 LYS A 20 5.909 5.333 -5.043 1.00 34.43 H new ATOM 0 HE3 LYS A 20 7.507 5.886 -5.503 1.00 34.43 H new ATOM 0 HZ1 LYS A 20 6.176 7.685 -4.627 1.00 60.43 H new ATOM 0 HZ2 LYS A 20 6.538 7.972 -6.261 1.00 60.43 H new ATOM 0 HZ3 LYS A 20 4.989 7.436 -5.816 1.00 60.43 H new ATOM 305 N ALA A 21 7.461 1.825 -11.232 1.00 22.12 N ATOM 306 CA ALA A 21 7.406 1.476 -12.652 1.00 72.01 C ATOM 307 C ALA A 21 7.331 -0.033 -12.840 1.00 72.24 C ATOM 308 O ALA A 21 6.709 -0.531 -13.774 1.00 61.02 O ATOM 309 CB ALA A 21 8.640 2.007 -13.354 1.00 73.14 C ATOM 0 H ALA A 21 8.331 2.281 -10.959 1.00 22.12 H new ATOM 0 HA ALA A 21 6.510 1.925 -13.081 1.00 72.01 H new ATOM 0 HB1 ALA A 21 8.598 1.746 -14.411 1.00 73.14 H new ATOM 0 HB2 ALA A 21 8.680 3.091 -13.249 1.00 73.14 H new ATOM 0 HB3 ALA A 21 9.531 1.566 -12.907 1.00 73.14 H new ATOM 315 N GLN A 22 7.978 -0.754 -11.950 1.00 54.32 N ATOM 316 CA GLN A 22 7.984 -2.203 -11.999 1.00 62.13 C ATOM 317 C GLN A 22 6.668 -2.728 -11.501 1.00 73.10 C ATOM 318 O GLN A 22 6.090 -3.665 -12.055 1.00 20.22 O ATOM 319 CB GLN A 22 9.087 -2.782 -11.115 1.00 42.54 C ATOM 320 CG GLN A 22 10.501 -2.385 -11.482 1.00 62.43 C ATOM 321 CD GLN A 22 11.533 -3.044 -10.594 1.00 32.22 C ATOM 322 OE1 GLN A 22 11.169 -3.306 -9.374 1.00 22.14 O flip ATOM 323 NE2 GLN A 22 12.655 -3.311 -11.011 1.00 33.41 N flip ATOM 0 H GLN A 22 8.512 -0.357 -11.177 1.00 54.32 H new ATOM 0 HA GLN A 22 8.157 -2.500 -13.033 1.00 62.13 H new ATOM 0 HB2 GLN A 22 8.899 -2.477 -10.086 1.00 42.54 H new ATOM 0 HB3 GLN A 22 9.016 -3.869 -11.143 1.00 42.54 H new ATOM 0 HG2 GLN A 22 10.693 -2.655 -12.520 1.00 62.43 H new ATOM 0 HG3 GLN A 22 10.602 -1.302 -11.410 1.00 62.43 H new ATOM 0 HE21 GLN A 22 12.907 -3.091 -11.975 1.00 33.41 H new ATOM 0 HE22 GLN A 22 13.337 -3.753 -10.394 1.00 33.41 H new ATOM 332 N GLN A 23 6.195 -2.114 -10.455 1.00 31.41 N ATOM 333 CA GLN A 23 5.015 -2.556 -9.804 1.00 55.41 C ATOM 334 C GLN A 23 3.766 -2.212 -10.600 1.00 43.02 C ATOM 335 O GLN A 23 2.759 -2.878 -10.449 1.00 31.12 O ATOM 336 CB GLN A 23 4.979 -2.073 -8.353 1.00 65.22 C ATOM 337 CG GLN A 23 6.241 -2.503 -7.579 1.00 2.43 C ATOM 338 CD GLN A 23 6.252 -2.117 -6.128 1.00 32.42 C ATOM 339 OE1 GLN A 23 5.127 -2.123 -5.531 1.00 44.01 O flip ATOM 340 NE2 GLN A 23 7.292 -1.864 -5.551 1.00 50.51 N flip ATOM 0 H GLN A 23 6.625 -1.290 -10.035 1.00 31.41 H new ATOM 0 HA GLN A 23 5.032 -3.645 -9.761 1.00 55.41 H new ATOM 0 HB2 GLN A 23 4.892 -0.987 -8.333 1.00 65.22 H new ATOM 0 HB3 GLN A 23 4.094 -2.473 -7.858 1.00 65.22 H new ATOM 0 HG2 GLN A 23 6.344 -3.586 -7.653 1.00 2.43 H new ATOM 0 HG3 GLN A 23 7.114 -2.065 -8.063 1.00 2.43 H new ATOM 0 HE21 GLN A 23 8.174 -1.869 -6.064 1.00 50.51 H new ATOM 0 HE22 GLN A 23 7.283 -1.647 -4.554 1.00 50.51 H new ATOM 349 N GLU A 24 3.853 -1.190 -11.478 1.00 54.10 N ATOM 350 CA GLU A 24 2.748 -0.856 -12.399 1.00 75.21 C ATOM 351 C GLU A 24 2.327 -2.096 -13.173 1.00 2.31 C ATOM 352 O GLU A 24 1.133 -2.386 -13.318 1.00 45.00 O ATOM 353 CB GLU A 24 3.150 0.251 -13.403 1.00 74.43 C ATOM 354 CG GLU A 24 3.383 1.627 -12.796 1.00 15.52 C ATOM 355 CD GLU A 24 3.804 2.664 -13.824 1.00 22.33 C ATOM 356 OE1 GLU A 24 2.930 3.195 -14.549 1.00 53.43 O ATOM 357 OE2 GLU A 24 5.009 2.990 -13.907 1.00 71.33 O ATOM 0 H GLU A 24 4.671 -0.587 -11.568 1.00 54.10 H new ATOM 0 HA GLU A 24 1.920 -0.487 -11.794 1.00 75.21 H new ATOM 0 HB2 GLU A 24 4.060 -0.060 -13.916 1.00 74.43 H new ATOM 0 HB3 GLU A 24 2.369 0.333 -14.159 1.00 74.43 H new ATOM 0 HG2 GLU A 24 2.469 1.961 -12.304 1.00 15.52 H new ATOM 0 HG3 GLU A 24 4.151 1.553 -12.026 1.00 15.52 H new ATOM 364 N GLU A 25 3.317 -2.831 -13.663 1.00 61.32 N ATOM 365 CA GLU A 25 3.052 -4.055 -14.383 1.00 21.54 C ATOM 366 C GLU A 25 2.508 -5.100 -13.424 1.00 64.44 C ATOM 367 O GLU A 25 1.418 -5.621 -13.622 1.00 63.22 O ATOM 368 CB GLU A 25 4.332 -4.594 -15.018 1.00 12.50 C ATOM 369 CG GLU A 25 5.076 -3.595 -15.874 1.00 2.43 C ATOM 370 CD GLU A 25 6.288 -4.201 -16.544 1.00 62.41 C ATOM 371 OE1 GLU A 25 7.141 -4.802 -15.841 1.00 53.13 O ATOM 372 OE2 GLU A 25 6.425 -4.043 -17.772 1.00 34.31 O ATOM 0 H GLU A 25 4.305 -2.596 -13.572 1.00 61.32 H new ATOM 0 HA GLU A 25 2.324 -3.843 -15.166 1.00 21.54 H new ATOM 0 HB2 GLU A 25 4.996 -4.942 -14.227 1.00 12.50 H new ATOM 0 HB3 GLU A 25 4.082 -5.462 -15.629 1.00 12.50 H new ATOM 0 HG2 GLU A 25 4.403 -3.200 -16.635 1.00 2.43 H new ATOM 0 HG3 GLU A 25 5.388 -2.753 -15.257 1.00 2.43 H new ATOM 379 N ARG A 26 3.253 -5.311 -12.328 1.00 73.23 N ATOM 380 CA ARG A 26 2.967 -6.360 -11.336 1.00 61.30 C ATOM 381 C ARG A 26 1.537 -6.302 -10.814 1.00 45.01 C ATOM 382 O ARG A 26 0.816 -7.288 -10.882 1.00 40.32 O ATOM 383 CB ARG A 26 3.928 -6.269 -10.143 1.00 12.31 C ATOM 384 CG ARG A 26 5.404 -6.430 -10.472 1.00 1.23 C ATOM 385 CD ARG A 26 6.247 -6.323 -9.205 1.00 11.35 C ATOM 386 NE ARG A 26 7.686 -6.470 -9.459 1.00 44.52 N ATOM 387 CZ ARG A 26 8.622 -6.620 -8.505 1.00 70.40 C ATOM 388 NH1 ARG A 26 8.278 -6.630 -7.209 1.00 23.33 N ATOM 389 NH2 ARG A 26 9.895 -6.762 -8.840 1.00 10.21 N ATOM 0 H ARG A 26 4.077 -4.754 -12.103 1.00 73.23 H new ATOM 0 HA ARG A 26 3.105 -7.307 -11.858 1.00 61.30 H new ATOM 0 HB2 ARG A 26 3.786 -5.303 -9.658 1.00 12.31 H new ATOM 0 HB3 ARG A 26 3.651 -7.034 -9.417 1.00 12.31 H new ATOM 0 HG2 ARG A 26 5.573 -7.396 -10.949 1.00 1.23 H new ATOM 0 HG3 ARG A 26 5.710 -5.665 -11.185 1.00 1.23 H new ATOM 0 HD2 ARG A 26 6.064 -5.357 -8.734 1.00 11.35 H new ATOM 0 HD3 ARG A 26 5.928 -7.089 -8.498 1.00 11.35 H new ATOM 0 HE ARG A 26 7.998 -6.457 -10.430 1.00 44.52 H new ATOM 0 HH11 ARG A 26 7.300 -6.523 -6.940 1.00 23.33 H new ATOM 0 HH12 ARG A 26 8.994 -6.744 -6.492 1.00 23.33 H new ATOM 0 HH21 ARG A 26 10.167 -6.758 -9.823 1.00 10.21 H new ATOM 0 HH22 ARG A 26 10.604 -6.876 -8.115 1.00 10.21 H new ATOM 403 N LEU A 27 1.140 -5.140 -10.324 1.00 71.20 N ATOM 404 CA LEU A 27 -0.169 -4.950 -9.696 1.00 54.11 C ATOM 405 C LEU A 27 -1.289 -5.310 -10.654 1.00 13.04 C ATOM 406 O LEU A 27 -2.180 -6.098 -10.331 1.00 13.44 O ATOM 407 CB LEU A 27 -0.322 -3.493 -9.236 1.00 23.15 C ATOM 408 CG LEU A 27 0.765 -2.969 -8.286 1.00 12.35 C ATOM 409 CD1 LEU A 27 0.492 -1.534 -7.901 1.00 73.32 C ATOM 410 CD2 LEU A 27 0.878 -3.839 -7.058 1.00 23.52 C ATOM 0 H LEU A 27 1.713 -4.296 -10.347 1.00 71.20 H new ATOM 0 HA LEU A 27 -0.233 -5.611 -8.832 1.00 54.11 H new ATOM 0 HB2 LEU A 27 -0.343 -2.854 -10.119 1.00 23.15 H new ATOM 0 HB3 LEU A 27 -1.289 -3.388 -8.743 1.00 23.15 H new ATOM 0 HG LEU A 27 1.718 -3.007 -8.813 1.00 12.35 H new ATOM 0 HD11 LEU A 27 1.274 -1.183 -7.228 1.00 73.32 H new ATOM 0 HD12 LEU A 27 0.479 -0.913 -8.797 1.00 73.32 H new ATOM 0 HD13 LEU A 27 -0.474 -1.469 -7.400 1.00 73.32 H new ATOM 0 HD21 LEU A 27 1.655 -3.445 -6.403 1.00 23.52 H new ATOM 0 HD22 LEU A 27 -0.074 -3.846 -6.528 1.00 23.52 H new ATOM 0 HD23 LEU A 27 1.135 -4.856 -7.355 1.00 23.52 H new ATOM 422 N ASP A 28 -1.201 -4.774 -11.846 1.00 52.23 N ATOM 423 CA ASP A 28 -2.205 -4.994 -12.865 1.00 74.11 C ATOM 424 C ASP A 28 -2.215 -6.456 -13.335 1.00 72.11 C ATOM 425 O ASP A 28 -3.251 -6.976 -13.763 1.00 12.51 O ATOM 426 CB ASP A 28 -1.983 -4.034 -14.032 1.00 65.01 C ATOM 427 CG ASP A 28 -2.993 -4.195 -15.138 1.00 62.44 C ATOM 428 OD1 ASP A 28 -4.080 -3.606 -15.052 1.00 62.31 O ATOM 429 OD2 ASP A 28 -2.682 -4.895 -16.126 1.00 52.32 O ATOM 0 H ASP A 28 -0.432 -4.172 -12.140 1.00 52.23 H new ATOM 0 HA ASP A 28 -3.186 -4.792 -12.434 1.00 74.11 H new ATOM 0 HB2 ASP A 28 -2.020 -3.009 -13.662 1.00 65.01 H new ATOM 0 HB3 ASP A 28 -0.983 -4.191 -14.437 1.00 65.01 H new ATOM 434 N GLU A 29 -1.072 -7.128 -13.252 1.00 42.24 N ATOM 435 CA GLU A 29 -1.021 -8.531 -13.639 1.00 2.43 C ATOM 436 C GLU A 29 -1.686 -9.388 -12.602 1.00 71.20 C ATOM 437 O GLU A 29 -2.426 -10.305 -12.940 1.00 1.25 O ATOM 438 CB GLU A 29 0.400 -9.049 -13.919 1.00 73.41 C ATOM 439 CG GLU A 29 1.181 -8.261 -14.964 1.00 24.42 C ATOM 440 CD GLU A 29 0.392 -7.946 -16.213 1.00 74.03 C ATOM 441 OE1 GLU A 29 -0.582 -8.656 -16.526 1.00 72.31 O ATOM 442 OE2 GLU A 29 0.733 -6.965 -16.893 1.00 44.52 O ATOM 0 H GLU A 29 -0.188 -6.735 -12.928 1.00 42.24 H new ATOM 0 HA GLU A 29 -1.563 -8.599 -14.582 1.00 2.43 H new ATOM 0 HB2 GLU A 29 0.963 -9.042 -12.986 1.00 73.41 H new ATOM 0 HB3 GLU A 29 0.334 -10.087 -14.244 1.00 73.41 H new ATOM 0 HG2 GLU A 29 1.524 -7.327 -14.518 1.00 24.42 H new ATOM 0 HG3 GLU A 29 2.070 -8.827 -15.241 1.00 24.42 H new ATOM 449 N ILE A 30 -1.449 -9.067 -11.333 1.00 0.24 N ATOM 450 CA ILE A 30 -2.017 -9.813 -10.211 1.00 64.34 C ATOM 451 C ILE A 30 -3.541 -9.805 -10.286 1.00 12.43 C ATOM 452 O ILE A 30 -4.202 -10.809 -9.966 1.00 1.05 O ATOM 453 CB ILE A 30 -1.519 -9.248 -8.835 1.00 54.25 C ATOM 454 CG1 ILE A 30 0.004 -9.338 -8.767 1.00 63.04 C ATOM 455 CG2 ILE A 30 -2.122 -10.025 -7.677 1.00 72.31 C ATOM 456 CD1 ILE A 30 0.611 -8.754 -7.510 1.00 14.35 C ATOM 0 H ILE A 30 -0.859 -8.284 -11.052 1.00 0.24 H new ATOM 0 HA ILE A 30 -1.672 -10.844 -10.283 1.00 64.34 H new ATOM 0 HB ILE A 30 -1.835 -8.208 -8.756 1.00 54.25 H new ATOM 0 HG12 ILE A 30 0.297 -10.385 -8.845 1.00 63.04 H new ATOM 0 HG13 ILE A 30 0.425 -8.824 -9.631 1.00 63.04 H new ATOM 0 HG21 ILE A 30 -1.760 -9.613 -6.735 1.00 72.31 H new ATOM 0 HG22 ILE A 30 -3.209 -9.948 -7.714 1.00 72.31 H new ATOM 0 HG23 ILE A 30 -1.830 -11.073 -7.751 1.00 72.31 H new ATOM 0 HD11 ILE A 30 1.695 -8.861 -7.546 1.00 14.35 H new ATOM 0 HD12 ILE A 30 0.352 -7.698 -7.438 1.00 14.35 H new ATOM 0 HD13 ILE A 30 0.223 -9.283 -6.639 1.00 14.35 H new ATOM 468 N ASN A 31 -4.088 -8.689 -10.768 1.00 52.33 N ATOM 469 CA ASN A 31 -5.533 -8.539 -10.938 1.00 14.24 C ATOM 470 C ASN A 31 -6.118 -9.640 -11.774 1.00 21.44 C ATOM 471 O ASN A 31 -7.142 -10.190 -11.427 1.00 70.11 O ATOM 472 CB ASN A 31 -5.923 -7.199 -11.580 1.00 61.54 C ATOM 473 CG ASN A 31 -5.607 -6.000 -10.735 1.00 51.43 C ATOM 474 OD1 ASN A 31 -5.535 -6.086 -9.512 1.00 63.41 O ATOM 475 ND2 ASN A 31 -5.505 -4.862 -11.357 1.00 43.34 N ATOM 0 H ASN A 31 -3.548 -7.871 -11.049 1.00 52.33 H new ATOM 0 HA ASN A 31 -5.938 -8.582 -9.927 1.00 14.24 H new ATOM 0 HB2 ASN A 31 -5.408 -7.103 -12.536 1.00 61.54 H new ATOM 0 HB3 ASN A 31 -6.992 -7.208 -11.794 1.00 61.54 H new ATOM 0 HD21 ASN A 31 -5.360 -4.002 -10.827 1.00 43.34 H new ATOM 0 HD22 ASN A 31 -5.570 -4.829 -12.374 1.00 43.34 H new ATOM 482 N LYS A 32 -5.436 -9.995 -12.846 1.00 12.13 N ATOM 483 CA LYS A 32 -5.952 -10.944 -13.827 1.00 64.44 C ATOM 484 C LYS A 32 -6.187 -12.341 -13.247 1.00 22.52 C ATOM 485 O LYS A 32 -7.054 -13.067 -13.712 1.00 24.34 O ATOM 486 CB LYS A 32 -5.037 -11.005 -15.049 1.00 73.32 C ATOM 487 CG LYS A 32 -4.839 -9.653 -15.711 1.00 5.31 C ATOM 488 CD LYS A 32 -3.959 -9.740 -16.945 1.00 50.15 C ATOM 489 CE LYS A 32 -3.713 -8.356 -17.524 1.00 15.21 C ATOM 490 NZ LYS A 32 -2.976 -7.500 -16.571 1.00 60.04 N ATOM 0 H LYS A 32 -4.507 -9.636 -13.066 1.00 12.13 H new ATOM 0 HA LYS A 32 -6.930 -10.574 -14.135 1.00 64.44 H new ATOM 0 HB2 LYS A 32 -4.067 -11.402 -14.750 1.00 73.32 H new ATOM 0 HB3 LYS A 32 -5.456 -11.701 -15.775 1.00 73.32 H new ATOM 0 HG2 LYS A 32 -5.809 -9.241 -15.988 1.00 5.31 H new ATOM 0 HG3 LYS A 32 -4.391 -8.963 -14.996 1.00 5.31 H new ATOM 0 HD2 LYS A 32 -3.008 -10.207 -16.688 1.00 50.15 H new ATOM 0 HD3 LYS A 32 -4.434 -10.374 -17.693 1.00 50.15 H new ATOM 0 HE2 LYS A 32 -3.147 -8.443 -18.452 1.00 15.21 H new ATOM 0 HE3 LYS A 32 -4.666 -7.889 -17.774 1.00 15.21 H new ATOM 0 HZ1 LYS A 32 -2.897 -6.538 -16.958 1.00 60.04 H new ATOM 0 HZ2 LYS A 32 -3.487 -7.468 -15.666 1.00 60.04 H new ATOM 0 HZ3 LYS A 32 -2.025 -7.891 -16.418 1.00 60.04 H new ATOM 504 N GLN A 33 -5.426 -12.711 -12.240 1.00 64.01 N ATOM 505 CA GLN A 33 -5.589 -14.022 -11.617 1.00 73.44 C ATOM 506 C GLN A 33 -6.834 -14.048 -10.743 1.00 50.44 C ATOM 507 O GLN A 33 -7.583 -15.017 -10.732 1.00 3.53 O ATOM 508 CB GLN A 33 -4.341 -14.448 -10.813 1.00 74.55 C ATOM 509 CG GLN A 33 -3.084 -14.769 -11.648 1.00 45.02 C ATOM 510 CD GLN A 33 -2.591 -13.608 -12.492 1.00 71.45 C ATOM 511 OE1 GLN A 33 -2.985 -13.450 -13.654 1.00 14.14 O ATOM 512 NE2 GLN A 33 -1.746 -12.788 -11.920 1.00 70.43 N ATOM 0 H GLN A 33 -4.691 -12.133 -11.832 1.00 64.01 H new ATOM 0 HA GLN A 33 -5.711 -14.749 -12.420 1.00 73.44 H new ATOM 0 HB2 GLN A 33 -4.095 -13.651 -10.111 1.00 74.55 H new ATOM 0 HB3 GLN A 33 -4.596 -15.327 -10.221 1.00 74.55 H new ATOM 0 HG2 GLN A 33 -2.284 -15.082 -10.977 1.00 45.02 H new ATOM 0 HG3 GLN A 33 -3.300 -15.614 -12.302 1.00 45.02 H new ATOM 0 HE21 GLN A 33 -1.446 -12.953 -10.959 1.00 70.43 H new ATOM 0 HE22 GLN A 33 -1.388 -11.984 -12.435 1.00 70.43 H new ATOM 521 N PHE A 34 -7.035 -12.979 -10.006 1.00 23.13 N ATOM 522 CA PHE A 34 -8.207 -12.831 -9.148 1.00 2.33 C ATOM 523 C PHE A 34 -9.461 -12.576 -9.976 1.00 52.04 C ATOM 524 O PHE A 34 -10.508 -13.169 -9.743 1.00 14.11 O ATOM 525 CB PHE A 34 -7.987 -11.694 -8.141 1.00 32.45 C ATOM 526 CG PHE A 34 -6.926 -11.984 -7.113 1.00 42.40 C ATOM 527 CD1 PHE A 34 -5.583 -11.994 -7.445 1.00 34.15 C ATOM 528 CD2 PHE A 34 -7.282 -12.262 -5.816 1.00 2.54 C ATOM 529 CE1 PHE A 34 -4.625 -12.276 -6.500 1.00 21.21 C ATOM 530 CE2 PHE A 34 -6.328 -12.547 -4.864 1.00 32.12 C ATOM 531 CZ PHE A 34 -5.001 -12.554 -5.206 1.00 55.45 C ATOM 0 H PHE A 34 -6.396 -12.184 -9.979 1.00 23.13 H new ATOM 0 HA PHE A 34 -8.349 -13.762 -8.600 1.00 2.33 H new ATOM 0 HB2 PHE A 34 -7.715 -10.789 -8.684 1.00 32.45 H new ATOM 0 HB3 PHE A 34 -8.927 -11.488 -7.630 1.00 32.45 H new ATOM 0 HD1 PHE A 34 -5.283 -11.777 -8.460 1.00 34.15 H new ATOM 0 HD2 PHE A 34 -8.326 -12.257 -5.538 1.00 2.54 H new ATOM 0 HE1 PHE A 34 -3.580 -12.279 -6.773 1.00 21.21 H new ATOM 0 HE2 PHE A 34 -6.626 -12.765 -3.849 1.00 32.12 H new ATOM 0 HZ PHE A 34 -4.252 -12.777 -4.461 1.00 55.45 H new ATOM 541 N LEU A 35 -9.318 -11.702 -10.944 1.00 13.44 N ATOM 542 CA LEU A 35 -10.387 -11.275 -11.834 1.00 62.40 C ATOM 543 C LEU A 35 -10.992 -12.428 -12.606 1.00 14.21 C ATOM 544 O LEU A 35 -12.214 -12.549 -12.718 1.00 72.32 O ATOM 545 CB LEU A 35 -9.812 -10.306 -12.848 1.00 13.54 C ATOM 546 CG LEU A 35 -10.761 -9.797 -13.908 1.00 14.24 C ATOM 547 CD1 LEU A 35 -11.792 -8.874 -13.319 1.00 1.03 C ATOM 548 CD2 LEU A 35 -9.997 -9.152 -15.028 1.00 31.14 C ATOM 0 H LEU A 35 -8.426 -11.250 -11.146 1.00 13.44 H new ATOM 0 HA LEU A 35 -11.164 -10.823 -11.217 1.00 62.40 H new ATOM 0 HB2 LEU A 35 -9.410 -9.448 -12.310 1.00 13.54 H new ATOM 0 HB3 LEU A 35 -8.973 -10.792 -13.346 1.00 13.54 H new ATOM 0 HG LEU A 35 -11.303 -10.646 -14.325 1.00 14.24 H new ATOM 0 HD11 LEU A 35 -12.460 -8.525 -14.106 1.00 1.03 H new ATOM 0 HD12 LEU A 35 -12.369 -9.408 -12.564 1.00 1.03 H new ATOM 0 HD13 LEU A 35 -11.295 -8.020 -12.859 1.00 1.03 H new ATOM 0 HD21 LEU A 35 -10.695 -8.791 -15.783 1.00 31.14 H new ATOM 0 HD22 LEU A 35 -9.418 -8.315 -14.639 1.00 31.14 H new ATOM 0 HD23 LEU A 35 -9.323 -9.882 -15.476 1.00 31.14 H new ATOM 560 N ASP A 36 -10.147 -13.262 -13.141 1.00 72.12 N ATOM 561 CA ASP A 36 -10.597 -14.313 -14.020 1.00 72.13 C ATOM 562 C ASP A 36 -10.825 -15.600 -13.237 1.00 20.03 C ATOM 563 O ASP A 36 -10.887 -16.694 -13.795 1.00 20.02 O ATOM 564 CB ASP A 36 -9.563 -14.506 -15.147 1.00 12.31 C ATOM 565 CG ASP A 36 -10.048 -15.384 -16.281 1.00 1.14 C ATOM 566 OD1 ASP A 36 -10.770 -14.871 -17.175 1.00 70.15 O ATOM 567 OD2 ASP A 36 -9.697 -16.584 -16.332 1.00 63.51 O ATOM 0 H ASP A 36 -9.139 -13.238 -12.986 1.00 72.12 H new ATOM 0 HA ASP A 36 -11.551 -14.037 -14.469 1.00 72.13 H new ATOM 0 HB2 ASP A 36 -9.290 -13.530 -15.548 1.00 12.31 H new ATOM 0 HB3 ASP A 36 -8.657 -14.942 -14.725 1.00 12.31 H new ATOM 572 N ASP A 37 -10.974 -15.485 -11.941 1.00 4.23 N ATOM 573 CA ASP A 37 -11.220 -16.692 -11.174 1.00 73.31 C ATOM 574 C ASP A 37 -12.590 -16.681 -10.528 1.00 60.44 C ATOM 575 O ASP A 37 -12.876 -15.846 -9.652 1.00 44.22 O ATOM 576 CB ASP A 37 -10.179 -16.960 -10.119 1.00 35.44 C ATOM 577 CG ASP A 37 -10.158 -18.435 -9.779 1.00 43.02 C ATOM 578 OD1 ASP A 37 -10.995 -18.902 -9.005 1.00 43.51 O ATOM 579 OD2 ASP A 37 -9.302 -19.160 -10.325 1.00 53.21 O ATOM 0 H ASP A 37 -10.933 -14.615 -11.410 1.00 4.23 H new ATOM 0 HA ASP A 37 -11.167 -17.499 -11.905 1.00 73.31 H new ATOM 0 HB2 ASP A 37 -9.198 -16.646 -10.476 1.00 35.44 H new ATOM 0 HB3 ASP A 37 -10.395 -16.375 -9.225 1.00 35.44 H new ATOM 584 N PRO A 38 -13.458 -17.608 -10.945 1.00 13.51 N ATOM 585 CA PRO A 38 -14.824 -17.747 -10.411 1.00 43.40 C ATOM 586 C PRO A 38 -14.914 -18.068 -8.893 1.00 55.41 C ATOM 587 O PRO A 38 -16.021 -18.098 -8.338 1.00 51.44 O ATOM 588 CB PRO A 38 -15.401 -18.915 -11.212 1.00 12.45 C ATOM 589 CG PRO A 38 -14.573 -18.994 -12.439 1.00 75.23 C ATOM 590 CD PRO A 38 -13.202 -18.580 -12.028 1.00 51.51 C ATOM 0 HA PRO A 38 -15.356 -16.800 -10.509 1.00 43.40 H new ATOM 0 HB2 PRO A 38 -15.352 -19.844 -10.644 1.00 12.45 H new ATOM 0 HB3 PRO A 38 -16.450 -18.745 -11.455 1.00 12.45 H new ATOM 0 HG2 PRO A 38 -14.571 -20.005 -12.846 1.00 75.23 H new ATOM 0 HG3 PRO A 38 -14.963 -18.338 -13.217 1.00 75.23 H new ATOM 0 HD2 PRO A 38 -12.612 -19.428 -11.678 1.00 51.51 H new ATOM 0 HD3 PRO A 38 -12.652 -18.128 -12.854 1.00 51.51 H new ATOM 598 N LYS A 39 -13.768 -18.292 -8.208 1.00 13.33 N ATOM 599 CA LYS A 39 -13.795 -18.619 -6.765 1.00 53.11 C ATOM 600 C LYS A 39 -14.372 -17.474 -5.957 1.00 43.33 C ATOM 601 O LYS A 39 -14.876 -17.668 -4.850 1.00 40.22 O ATOM 602 CB LYS A 39 -12.401 -18.993 -6.219 1.00 65.01 C ATOM 603 CG LYS A 39 -11.369 -17.862 -6.233 1.00 73.13 C ATOM 604 CD LYS A 39 -10.015 -18.340 -5.722 1.00 51.31 C ATOM 605 CE LYS A 39 -8.965 -17.237 -5.804 1.00 41.34 C ATOM 606 NZ LYS A 39 -7.637 -17.689 -5.344 1.00 63.42 N ATOM 0 H LYS A 39 -12.835 -18.254 -8.620 1.00 13.33 H new ATOM 0 HA LYS A 39 -14.439 -19.492 -6.660 1.00 53.11 H new ATOM 0 HB2 LYS A 39 -12.513 -19.348 -5.195 1.00 65.01 H new ATOM 0 HB3 LYS A 39 -12.011 -19.826 -6.804 1.00 65.01 H new ATOM 0 HG2 LYS A 39 -11.262 -17.477 -7.247 1.00 73.13 H new ATOM 0 HG3 LYS A 39 -11.723 -17.037 -5.615 1.00 73.13 H new ATOM 0 HD2 LYS A 39 -10.112 -18.675 -4.689 1.00 51.31 H new ATOM 0 HD3 LYS A 39 -9.687 -19.200 -6.306 1.00 51.31 H new ATOM 0 HE2 LYS A 39 -8.890 -16.886 -6.833 1.00 41.34 H new ATOM 0 HE3 LYS A 39 -9.286 -16.388 -5.201 1.00 41.34 H new ATOM 0 HZ1 LYS A 39 -6.958 -16.905 -5.419 1.00 63.42 H new ATOM 0 HZ2 LYS A 39 -7.700 -17.999 -4.353 1.00 63.42 H new ATOM 0 HZ3 LYS A 39 -7.316 -18.482 -5.935 1.00 63.42 H new ATOM 620 N TYR A 40 -14.305 -16.276 -6.507 1.00 13.45 N ATOM 621 CA TYR A 40 -14.857 -15.128 -5.828 1.00 73.44 C ATOM 622 C TYR A 40 -16.366 -15.044 -5.921 1.00 33.02 C ATOM 623 O TYR A 40 -16.994 -14.283 -5.182 1.00 33.32 O ATOM 624 CB TYR A 40 -14.122 -13.838 -6.174 1.00 53.45 C ATOM 625 CG TYR A 40 -12.720 -13.884 -5.626 1.00 74.22 C ATOM 626 CD1 TYR A 40 -12.523 -13.825 -4.265 1.00 32.31 C ATOM 627 CD2 TYR A 40 -11.610 -14.024 -6.445 1.00 14.54 C ATOM 628 CE1 TYR A 40 -11.281 -13.908 -3.711 1.00 70.25 C ATOM 629 CE2 TYR A 40 -10.341 -14.097 -5.892 1.00 13.03 C ATOM 630 CZ TYR A 40 -10.194 -14.043 -4.512 1.00 4.43 C ATOM 631 OH TYR A 40 -8.950 -14.147 -3.937 1.00 41.44 O ATOM 0 H TYR A 40 -13.878 -16.077 -7.412 1.00 13.45 H new ATOM 0 HA TYR A 40 -14.672 -15.277 -4.764 1.00 73.44 H new ATOM 0 HB2 TYR A 40 -14.095 -13.704 -7.255 1.00 53.45 H new ATOM 0 HB3 TYR A 40 -14.656 -12.983 -5.760 1.00 53.45 H new ATOM 0 HD1 TYR A 40 -13.379 -13.709 -3.617 1.00 32.31 H new ATOM 0 HD2 TYR A 40 -11.734 -14.076 -7.517 1.00 14.54 H new ATOM 0 HE1 TYR A 40 -11.162 -13.867 -2.638 1.00 70.25 H new ATOM 0 HE2 TYR A 40 -9.474 -14.195 -6.529 1.00 13.03 H new ATOM 0 HH TYR A 40 -8.286 -13.714 -4.513 1.00 41.44 H new ATOM 641 N SER A 41 -16.939 -15.855 -6.822 1.00 11.34 N ATOM 642 CA SER A 41 -18.398 -16.051 -6.991 1.00 74.31 C ATOM 643 C SER A 41 -19.189 -14.806 -7.462 1.00 64.30 C ATOM 644 O SER A 41 -20.098 -14.925 -8.285 1.00 52.31 O ATOM 645 CB SER A 41 -18.998 -16.639 -5.710 1.00 51.14 C ATOM 646 OG SER A 41 -18.327 -17.851 -5.364 1.00 12.44 O ATOM 0 H SER A 41 -16.389 -16.412 -7.476 1.00 11.34 H new ATOM 0 HA SER A 41 -18.503 -16.756 -7.816 1.00 74.31 H new ATOM 0 HB2 SER A 41 -18.910 -15.920 -4.895 1.00 51.14 H new ATOM 0 HB3 SER A 41 -20.061 -16.831 -5.852 1.00 51.14 H new ATOM 0 HG SER A 41 -18.717 -18.218 -4.543 1.00 12.44 H new ATOM 652 N SER A 42 -18.861 -13.645 -6.935 1.00 3.11 N ATOM 653 CA SER A 42 -19.540 -12.430 -7.281 1.00 74.30 C ATOM 654 C SER A 42 -19.285 -12.064 -8.746 1.00 34.03 C ATOM 655 O SER A 42 -20.241 -11.868 -9.502 1.00 44.11 O ATOM 656 CB SER A 42 -19.105 -11.327 -6.339 1.00 33.03 C ATOM 657 OG SER A 42 -19.305 -11.725 -4.989 1.00 41.33 O ATOM 0 H SER A 42 -18.112 -13.525 -6.253 1.00 3.11 H new ATOM 0 HA SER A 42 -20.616 -12.569 -7.173 1.00 74.30 H new ATOM 0 HB2 SER A 42 -18.054 -11.092 -6.504 1.00 33.03 H new ATOM 0 HB3 SER A 42 -19.671 -10.419 -6.545 1.00 33.03 H new ATOM 0 HG SER A 42 -19.019 -11.004 -4.390 1.00 41.33 H new ATOM 663 N ASP A 43 -17.991 -11.975 -9.141 1.00 1.22 N ATOM 664 CA ASP A 43 -17.566 -11.714 -10.554 1.00 4.34 C ATOM 665 C ASP A 43 -17.876 -10.309 -11.057 1.00 55.14 C ATOM 666 O ASP A 43 -17.036 -9.667 -11.674 1.00 72.33 O ATOM 667 CB ASP A 43 -18.124 -12.748 -11.527 1.00 3.51 C ATOM 668 CG ASP A 43 -17.520 -14.121 -11.375 1.00 31.43 C ATOM 669 OD1 ASP A 43 -17.993 -14.898 -10.520 1.00 55.23 O ATOM 670 OD2 ASP A 43 -16.579 -14.454 -12.140 1.00 50.22 O ATOM 0 H ASP A 43 -17.208 -12.081 -8.496 1.00 1.22 H new ATOM 0 HA ASP A 43 -16.480 -11.803 -10.522 1.00 4.34 H new ATOM 0 HB2 ASP A 43 -19.203 -12.819 -11.387 1.00 3.51 H new ATOM 0 HB3 ASP A 43 -17.957 -12.400 -12.546 1.00 3.51 H new ATOM 675 N GLU A 44 -19.069 -9.867 -10.799 1.00 43.14 N ATOM 676 CA GLU A 44 -19.590 -8.569 -11.194 1.00 64.23 C ATOM 677 C GLU A 44 -18.733 -7.419 -10.663 1.00 14.41 C ATOM 678 O GLU A 44 -18.475 -6.436 -11.359 1.00 71.14 O ATOM 679 CB GLU A 44 -20.990 -8.463 -10.618 1.00 11.21 C ATOM 680 CG GLU A 44 -21.693 -7.152 -10.833 1.00 41.23 C ATOM 681 CD GLU A 44 -23.030 -7.160 -10.173 1.00 41.53 C ATOM 682 OE1 GLU A 44 -23.115 -6.811 -8.980 1.00 22.20 O ATOM 683 OE2 GLU A 44 -24.015 -7.557 -10.820 1.00 55.55 O ATOM 0 H GLU A 44 -19.750 -10.422 -10.281 1.00 43.14 H new ATOM 0 HA GLU A 44 -19.586 -8.491 -12.281 1.00 64.23 H new ATOM 0 HB2 GLU A 44 -21.601 -9.255 -11.051 1.00 11.21 H new ATOM 0 HB3 GLU A 44 -20.936 -8.652 -9.546 1.00 11.21 H new ATOM 0 HG2 GLU A 44 -21.088 -6.339 -10.432 1.00 41.23 H new ATOM 0 HG3 GLU A 44 -21.809 -6.966 -11.901 1.00 41.23 H new ATOM 690 N ASP A 45 -18.281 -7.579 -9.462 1.00 11.21 N ATOM 691 CA ASP A 45 -17.570 -6.554 -8.729 1.00 72.34 C ATOM 692 C ASP A 45 -16.069 -6.654 -8.921 1.00 12.04 C ATOM 693 O ASP A 45 -15.335 -5.732 -8.565 1.00 23.15 O ATOM 694 CB ASP A 45 -17.894 -6.712 -7.245 1.00 52.30 C ATOM 695 CG ASP A 45 -17.426 -8.050 -6.676 1.00 70.12 C ATOM 696 OD1 ASP A 45 -17.527 -9.075 -7.378 1.00 23.01 O ATOM 697 OD2 ASP A 45 -16.946 -8.073 -5.527 1.00 70.31 O ATOM 0 H ASP A 45 -18.394 -8.447 -8.939 1.00 11.21 H new ATOM 0 HA ASP A 45 -17.887 -5.581 -9.104 1.00 72.34 H new ATOM 0 HB2 ASP A 45 -17.425 -5.901 -6.687 1.00 52.30 H new ATOM 0 HB3 ASP A 45 -18.970 -6.618 -7.101 1.00 52.30 H new ATOM 702 N LEU A 46 -15.621 -7.752 -9.484 1.00 32.41 N ATOM 703 CA LEU A 46 -14.193 -8.010 -9.646 1.00 1.21 C ATOM 704 C LEU A 46 -13.494 -6.966 -10.525 1.00 23.21 C ATOM 705 O LEU A 46 -12.545 -6.336 -10.067 1.00 33.32 O ATOM 706 CB LEU A 46 -13.937 -9.364 -10.228 1.00 71.33 C ATOM 707 CG LEU A 46 -14.554 -10.535 -9.543 1.00 22.44 C ATOM 708 CD1 LEU A 46 -14.198 -11.732 -10.330 1.00 23.22 C ATOM 709 CD2 LEU A 46 -14.085 -10.676 -8.111 1.00 52.22 C ATOM 0 H LEU A 46 -16.224 -8.492 -9.843 1.00 32.41 H new ATOM 0 HA LEU A 46 -13.778 -7.954 -8.640 1.00 1.21 H new ATOM 0 HB2 LEU A 46 -14.284 -9.357 -11.261 1.00 71.33 H new ATOM 0 HB3 LEU A 46 -12.859 -9.520 -10.255 1.00 71.33 H new ATOM 0 HG LEU A 46 -15.635 -10.402 -9.491 1.00 22.44 H new ATOM 0 HD11 LEU A 46 -14.631 -12.617 -9.863 1.00 23.22 H new ATOM 0 HD12 LEU A 46 -14.587 -11.630 -11.343 1.00 23.22 H new ATOM 0 HD13 LEU A 46 -13.113 -11.835 -10.366 1.00 23.22 H new ATOM 0 HD21 LEU A 46 -14.563 -11.543 -7.655 1.00 52.22 H new ATOM 0 HD22 LEU A 46 -13.003 -10.807 -8.094 1.00 52.22 H new ATOM 0 HD23 LEU A 46 -14.351 -9.779 -7.551 1.00 52.22 H new ATOM 721 N PRO A 47 -13.952 -6.733 -11.816 1.00 32.22 N ATOM 722 CA PRO A 47 -13.291 -5.771 -12.720 1.00 32.21 C ATOM 723 C PRO A 47 -13.274 -4.398 -12.115 1.00 74.13 C ATOM 724 O PRO A 47 -12.469 -3.551 -12.465 1.00 64.13 O ATOM 725 CB PRO A 47 -14.176 -5.779 -13.980 1.00 54.41 C ATOM 726 CG PRO A 47 -15.476 -6.353 -13.531 1.00 71.24 C ATOM 727 CD PRO A 47 -15.125 -7.355 -12.487 1.00 15.32 C ATOM 0 HA PRO A 47 -12.253 -6.036 -12.922 1.00 32.21 H new ATOM 0 HB2 PRO A 47 -14.305 -4.773 -14.379 1.00 54.41 H new ATOM 0 HB3 PRO A 47 -13.731 -6.381 -14.772 1.00 54.41 H new ATOM 0 HG2 PRO A 47 -16.130 -5.579 -13.129 1.00 71.24 H new ATOM 0 HG3 PRO A 47 -16.007 -6.819 -14.361 1.00 71.24 H new ATOM 0 HD2 PRO A 47 -15.948 -7.520 -11.792 1.00 15.32 H new ATOM 0 HD3 PRO A 47 -14.876 -8.323 -12.922 1.00 15.32 H new ATOM 735 N SER A 48 -14.173 -4.196 -11.214 1.00 41.23 N ATOM 736 CA SER A 48 -14.275 -2.943 -10.527 1.00 30.34 C ATOM 737 C SER A 48 -13.237 -2.856 -9.391 1.00 15.15 C ATOM 738 O SER A 48 -12.423 -1.926 -9.346 1.00 20.43 O ATOM 739 CB SER A 48 -15.690 -2.747 -10.010 1.00 71.54 C ATOM 740 OG SER A 48 -16.636 -2.848 -11.070 1.00 51.53 O ATOM 0 H SER A 48 -14.862 -4.892 -10.928 1.00 41.23 H new ATOM 0 HA SER A 48 -14.056 -2.136 -11.227 1.00 30.34 H new ATOM 0 HB2 SER A 48 -15.910 -3.495 -9.248 1.00 71.54 H new ATOM 0 HB3 SER A 48 -15.775 -1.771 -9.533 1.00 71.54 H new ATOM 0 HG SER A 48 -17.540 -2.720 -10.715 1.00 51.53 H new ATOM 746 N LYS A 49 -13.259 -3.850 -8.495 1.00 71.23 N ATOM 747 CA LYS A 49 -12.365 -3.878 -7.348 1.00 12.23 C ATOM 748 C LYS A 49 -10.914 -3.935 -7.749 1.00 1.31 C ATOM 749 O LYS A 49 -10.136 -3.123 -7.300 1.00 45.11 O ATOM 750 CB LYS A 49 -12.684 -5.044 -6.407 1.00 54.04 C ATOM 751 CG LYS A 49 -13.994 -4.914 -5.654 1.00 31.45 C ATOM 752 CD LYS A 49 -14.218 -6.121 -4.765 1.00 72.31 C ATOM 753 CE LYS A 49 -15.473 -5.976 -3.929 1.00 22.51 C ATOM 754 NZ LYS A 49 -15.745 -7.195 -3.137 1.00 31.21 N ATOM 0 H LYS A 49 -13.893 -4.647 -8.550 1.00 71.23 H new ATOM 0 HA LYS A 49 -12.534 -2.940 -6.818 1.00 12.23 H new ATOM 0 HB2 LYS A 49 -12.705 -5.966 -6.988 1.00 54.04 H new ATOM 0 HB3 LYS A 49 -11.874 -5.141 -5.684 1.00 54.04 H new ATOM 0 HG2 LYS A 49 -13.984 -4.007 -5.050 1.00 31.45 H new ATOM 0 HG3 LYS A 49 -14.818 -4.818 -6.361 1.00 31.45 H new ATOM 0 HD2 LYS A 49 -14.292 -7.018 -5.381 1.00 72.31 H new ATOM 0 HD3 LYS A 49 -13.358 -6.255 -4.109 1.00 72.31 H new ATOM 0 HE2 LYS A 49 -15.368 -5.123 -3.259 1.00 22.51 H new ATOM 0 HE3 LYS A 49 -16.322 -5.768 -4.580 1.00 22.51 H new ATOM 0 HZ1 LYS A 49 -16.470 -6.989 -2.421 1.00 31.21 H new ATOM 0 HZ2 LYS A 49 -16.085 -7.950 -3.767 1.00 31.21 H new ATOM 0 HZ3 LYS A 49 -14.871 -7.505 -2.666 1.00 31.21 H new ATOM 768 N LEU A 50 -10.563 -4.866 -8.621 1.00 24.03 N ATOM 769 CA LEU A 50 -9.166 -5.036 -9.034 1.00 12.42 C ATOM 770 C LEU A 50 -8.598 -3.782 -9.696 1.00 53.31 C ATOM 771 O LEU A 50 -7.524 -3.288 -9.318 1.00 24.02 O ATOM 772 CB LEU A 50 -8.973 -6.261 -9.959 1.00 24.41 C ATOM 773 CG LEU A 50 -9.034 -7.681 -9.332 1.00 73.42 C ATOM 774 CD1 LEU A 50 -8.048 -7.819 -8.217 1.00 75.45 C ATOM 775 CD2 LEU A 50 -10.421 -8.076 -8.873 1.00 51.01 C ATOM 0 H LEU A 50 -11.217 -5.516 -9.058 1.00 24.03 H new ATOM 0 HA LEU A 50 -8.607 -5.214 -8.115 1.00 12.42 H new ATOM 0 HB2 LEU A 50 -9.733 -6.210 -10.739 1.00 24.41 H new ATOM 0 HB3 LEU A 50 -8.005 -6.157 -10.449 1.00 24.41 H new ATOM 0 HG LEU A 50 -8.765 -8.374 -10.129 1.00 73.42 H new ATOM 0 HD11 LEU A 50 -8.112 -8.823 -7.796 1.00 75.45 H new ATOM 0 HD12 LEU A 50 -7.041 -7.649 -8.599 1.00 75.45 H new ATOM 0 HD13 LEU A 50 -8.270 -7.086 -7.442 1.00 75.45 H new ATOM 0 HD21 LEU A 50 -10.391 -9.078 -8.446 1.00 51.01 H new ATOM 0 HD22 LEU A 50 -10.769 -7.370 -8.119 1.00 51.01 H new ATOM 0 HD23 LEU A 50 -11.103 -8.064 -9.723 1.00 51.01 H new ATOM 787 N GLU A 51 -9.334 -3.258 -10.640 1.00 14.12 N ATOM 788 CA GLU A 51 -8.909 -2.105 -11.401 1.00 4.52 C ATOM 789 C GLU A 51 -8.885 -0.824 -10.582 1.00 20.30 C ATOM 790 O GLU A 51 -8.031 0.041 -10.795 1.00 21.13 O ATOM 791 CB GLU A 51 -9.744 -1.984 -12.652 1.00 61.11 C ATOM 792 CG GLU A 51 -9.465 -3.102 -13.645 1.00 35.01 C ATOM 793 CD GLU A 51 -8.041 -3.062 -14.172 1.00 72.54 C ATOM 794 OE1 GLU A 51 -7.084 -3.367 -13.420 1.00 32.14 O ATOM 795 OE2 GLU A 51 -7.858 -2.716 -15.348 1.00 5.41 O ATOM 0 H GLU A 51 -10.250 -3.618 -10.907 1.00 14.12 H new ATOM 0 HA GLU A 51 -7.871 -2.261 -11.696 1.00 4.52 H new ATOM 0 HB2 GLU A 51 -10.800 -1.996 -12.383 1.00 61.11 H new ATOM 0 HB3 GLU A 51 -9.546 -1.023 -13.126 1.00 61.11 H new ATOM 0 HG2 GLU A 51 -9.646 -4.064 -13.166 1.00 35.01 H new ATOM 0 HG3 GLU A 51 -10.161 -3.026 -14.480 1.00 35.01 H new ATOM 802 N GLY A 52 -9.793 -0.701 -9.648 1.00 34.01 N ATOM 803 CA GLY A 52 -9.774 0.441 -8.784 1.00 23.35 C ATOM 804 C GLY A 52 -8.648 0.332 -7.778 1.00 14.34 C ATOM 805 O GLY A 52 -7.916 1.298 -7.538 1.00 5.33 O ATOM 0 H GLY A 52 -10.543 -1.369 -9.471 1.00 34.01 H new ATOM 0 HA2 GLY A 52 -9.653 1.349 -9.375 1.00 23.35 H new ATOM 0 HA3 GLY A 52 -10.727 0.525 -8.262 1.00 23.35 H new ATOM 809 N PHE A 53 -8.492 -0.863 -7.232 1.00 43.11 N ATOM 810 CA PHE A 53 -7.505 -1.166 -6.208 1.00 14.01 C ATOM 811 C PHE A 53 -6.065 -1.000 -6.673 1.00 23.02 C ATOM 812 O PHE A 53 -5.259 -0.450 -5.939 1.00 24.14 O ATOM 813 CB PHE A 53 -7.743 -2.564 -5.637 1.00 73.12 C ATOM 814 CG PHE A 53 -6.701 -3.054 -4.691 1.00 12.13 C ATOM 815 CD1 PHE A 53 -6.592 -2.538 -3.421 1.00 13.53 C ATOM 816 CD2 PHE A 53 -5.837 -4.052 -5.079 1.00 73.12 C ATOM 817 CE1 PHE A 53 -5.635 -3.011 -2.557 1.00 2.52 C ATOM 818 CE2 PHE A 53 -4.881 -4.530 -4.226 1.00 42.25 C ATOM 819 CZ PHE A 53 -4.777 -4.013 -2.962 1.00 72.22 C ATOM 0 H PHE A 53 -9.061 -1.668 -7.494 1.00 43.11 H new ATOM 0 HA PHE A 53 -7.643 -0.426 -5.420 1.00 14.01 H new ATOM 0 HB2 PHE A 53 -8.706 -2.570 -5.126 1.00 73.12 H new ATOM 0 HB3 PHE A 53 -7.818 -3.268 -6.465 1.00 73.12 H new ATOM 0 HD1 PHE A 53 -7.264 -1.755 -3.101 1.00 13.53 H new ATOM 0 HD2 PHE A 53 -5.915 -4.465 -6.074 1.00 73.12 H new ATOM 0 HE1 PHE A 53 -5.554 -2.599 -1.562 1.00 2.52 H new ATOM 0 HE2 PHE A 53 -4.210 -5.313 -4.548 1.00 42.25 H new ATOM 0 HZ PHE A 53 -4.025 -4.389 -2.284 1.00 72.22 H new ATOM 829 N LYS A 54 -5.740 -1.461 -7.880 1.00 42.51 N ATOM 830 CA LYS A 54 -4.359 -1.341 -8.382 1.00 72.43 C ATOM 831 C LYS A 54 -3.808 0.091 -8.360 1.00 42.31 C ATOM 832 O LYS A 54 -2.631 0.296 -8.072 1.00 22.21 O ATOM 833 CB LYS A 54 -4.129 -2.087 -9.728 1.00 4.13 C ATOM 834 CG LYS A 54 -5.026 -1.723 -10.923 1.00 73.44 C ATOM 835 CD LYS A 54 -4.662 -0.412 -11.583 1.00 25.34 C ATOM 836 CE LYS A 54 -5.574 -0.130 -12.774 1.00 52.53 C ATOM 837 NZ LYS A 54 -5.536 -1.207 -13.807 1.00 14.12 N ATOM 0 H LYS A 54 -6.393 -1.912 -8.521 1.00 42.51 H new ATOM 0 HA LYS A 54 -3.746 -1.872 -7.654 1.00 72.43 H new ATOM 0 HB2 LYS A 54 -3.094 -1.923 -10.027 1.00 4.13 H new ATOM 0 HB3 LYS A 54 -4.241 -3.155 -9.540 1.00 4.13 H new ATOM 0 HG2 LYS A 54 -4.969 -2.520 -11.664 1.00 73.44 H new ATOM 0 HG3 LYS A 54 -6.062 -1.674 -10.586 1.00 73.44 H new ATOM 0 HD2 LYS A 54 -4.742 0.399 -10.859 1.00 25.34 H new ATOM 0 HD3 LYS A 54 -3.624 -0.443 -11.914 1.00 25.34 H new ATOM 0 HE2 LYS A 54 -6.598 -0.010 -12.420 1.00 52.53 H new ATOM 0 HE3 LYS A 54 -5.282 0.815 -13.232 1.00 52.53 H new ATOM 0 HZ1 LYS A 54 -6.080 -0.907 -14.641 1.00 14.12 H new ATOM 0 HZ2 LYS A 54 -4.550 -1.388 -14.083 1.00 14.12 H new ATOM 0 HZ3 LYS A 54 -5.952 -2.077 -13.417 1.00 14.12 H new ATOM 851 N GLU A 55 -4.664 1.074 -8.611 1.00 11.25 N ATOM 852 CA GLU A 55 -4.250 2.472 -8.521 1.00 41.23 C ATOM 853 C GLU A 55 -4.082 2.871 -7.058 1.00 64.21 C ATOM 854 O GLU A 55 -3.112 3.527 -6.678 1.00 71.25 O ATOM 855 CB GLU A 55 -5.291 3.403 -9.154 1.00 73.53 C ATOM 856 CG GLU A 55 -4.945 4.880 -8.965 1.00 53.31 C ATOM 857 CD GLU A 55 -6.032 5.822 -9.389 1.00 1.43 C ATOM 858 OE1 GLU A 55 -7.056 5.923 -8.683 1.00 12.12 O ATOM 859 OE2 GLU A 55 -5.863 6.526 -10.377 1.00 43.22 O ATOM 0 H GLU A 55 -5.639 0.934 -8.876 1.00 11.25 H new ATOM 0 HA GLU A 55 -3.306 2.570 -9.058 1.00 41.23 H new ATOM 0 HB2 GLU A 55 -5.370 3.185 -10.219 1.00 73.53 H new ATOM 0 HB3 GLU A 55 -6.268 3.203 -8.715 1.00 73.53 H new ATOM 0 HG2 GLU A 55 -4.715 5.057 -7.914 1.00 53.31 H new ATOM 0 HG3 GLU A 55 -4.042 5.106 -9.531 1.00 53.31 H new ATOM 866 N LYS A 56 -5.030 2.453 -6.247 1.00 52.05 N ATOM 867 CA LYS A 56 -5.069 2.843 -4.856 1.00 43.52 C ATOM 868 C LYS A 56 -3.909 2.250 -4.088 1.00 50.20 C ATOM 869 O LYS A 56 -3.295 2.931 -3.295 1.00 34.45 O ATOM 870 CB LYS A 56 -6.386 2.425 -4.208 1.00 15.45 C ATOM 871 CG LYS A 56 -7.620 2.923 -4.933 1.00 41.31 C ATOM 872 CD LYS A 56 -8.888 2.496 -4.223 1.00 60.33 C ATOM 873 CE LYS A 56 -10.138 2.796 -5.039 1.00 51.34 C ATOM 874 NZ LYS A 56 -10.259 4.220 -5.389 1.00 51.11 N ATOM 0 H LYS A 56 -5.791 1.837 -6.532 1.00 52.05 H new ATOM 0 HA LYS A 56 -4.989 3.929 -4.821 1.00 43.52 H new ATOM 0 HB2 LYS A 56 -6.423 1.337 -4.156 1.00 15.45 H new ATOM 0 HB3 LYS A 56 -6.407 2.794 -3.183 1.00 15.45 H new ATOM 0 HG2 LYS A 56 -7.589 4.010 -5.003 1.00 41.31 H new ATOM 0 HG3 LYS A 56 -7.625 2.538 -5.953 1.00 41.31 H new ATOM 0 HD2 LYS A 56 -8.842 1.427 -4.013 1.00 60.33 H new ATOM 0 HD3 LYS A 56 -8.953 3.007 -3.262 1.00 60.33 H new ATOM 0 HE2 LYS A 56 -10.122 2.202 -5.953 1.00 51.34 H new ATOM 0 HE3 LYS A 56 -11.018 2.489 -4.474 1.00 51.34 H new ATOM 0 HZ1 LYS A 56 -11.226 4.546 -5.189 1.00 51.11 H new ATOM 0 HZ2 LYS A 56 -9.583 4.775 -4.826 1.00 51.11 H new ATOM 0 HZ3 LYS A 56 -10.053 4.348 -6.400 1.00 51.11 H new ATOM 888 N TYR A 57 -3.589 0.991 -4.362 1.00 34.12 N ATOM 889 CA TYR A 57 -2.552 0.284 -3.636 1.00 34.35 C ATOM 890 C TYR A 57 -1.216 0.961 -3.839 1.00 71.23 C ATOM 891 O TYR A 57 -0.464 1.157 -2.895 1.00 31.44 O ATOM 892 CB TYR A 57 -2.499 -1.165 -4.103 1.00 64.21 C ATOM 893 CG TYR A 57 -1.551 -2.068 -3.333 1.00 73.13 C ATOM 894 CD1 TYR A 57 -1.941 -2.642 -2.134 1.00 20.43 C ATOM 895 CD2 TYR A 57 -0.292 -2.374 -3.822 1.00 21.41 C ATOM 896 CE1 TYR A 57 -1.106 -3.491 -1.441 1.00 32.34 C ATOM 897 CE2 TYR A 57 0.548 -3.233 -3.135 1.00 15.32 C ATOM 898 CZ TYR A 57 0.131 -3.787 -1.947 1.00 72.03 C ATOM 899 OH TYR A 57 0.954 -4.646 -1.269 1.00 2.22 O ATOM 0 H TYR A 57 -4.041 0.438 -5.090 1.00 34.12 H new ATOM 0 HA TYR A 57 -2.782 0.302 -2.571 1.00 34.35 H new ATOM 0 HB2 TYR A 57 -3.503 -1.585 -4.041 1.00 64.21 H new ATOM 0 HB3 TYR A 57 -2.212 -1.179 -5.154 1.00 64.21 H new ATOM 0 HD1 TYR A 57 -2.919 -2.419 -1.734 1.00 20.43 H new ATOM 0 HD2 TYR A 57 0.039 -1.936 -4.752 1.00 21.41 H new ATOM 0 HE1 TYR A 57 -1.426 -3.921 -0.503 1.00 32.34 H new ATOM 0 HE2 TYR A 57 1.526 -3.467 -3.530 1.00 15.32 H new ATOM 0 HH TYR A 57 1.738 -4.851 -1.820 1.00 2.22 H new ATOM 909 N MET A 58 -0.931 1.329 -5.078 1.00 3.05 N ATOM 910 CA MET A 58 0.310 2.002 -5.403 1.00 72.41 C ATOM 911 C MET A 58 0.358 3.441 -4.886 1.00 74.34 C ATOM 912 O MET A 58 1.414 4.073 -4.904 1.00 4.40 O ATOM 913 CB MET A 58 0.640 1.933 -6.893 1.00 42.02 C ATOM 914 CG MET A 58 -0.372 2.600 -7.797 1.00 23.42 C ATOM 915 SD MET A 58 0.071 2.498 -9.542 1.00 55.34 S ATOM 916 CE MET A 58 1.681 3.274 -9.513 1.00 33.12 C ATOM 0 H MET A 58 -1.547 1.171 -5.876 1.00 3.05 H new ATOM 0 HA MET A 58 1.089 1.451 -4.875 1.00 72.41 H new ATOM 0 HB2 MET A 58 1.613 2.395 -7.057 1.00 42.02 H new ATOM 0 HB3 MET A 58 0.731 0.886 -7.183 1.00 42.02 H new ATOM 0 HG2 MET A 58 -1.347 2.136 -7.647 1.00 23.42 H new ATOM 0 HG3 MET A 58 -0.470 3.648 -7.513 1.00 23.42 H new ATOM 0 HE1 MET A 58 1.917 3.660 -10.505 1.00 33.12 H new ATOM 0 HE2 MET A 58 1.676 4.095 -8.796 1.00 33.12 H new ATOM 0 HE3 MET A 58 2.433 2.541 -9.220 1.00 33.12 H new ATOM 926 N GLU A 59 -0.783 3.964 -4.452 1.00 21.42 N ATOM 927 CA GLU A 59 -0.832 5.291 -3.893 1.00 62.42 C ATOM 928 C GLU A 59 -0.236 5.236 -2.487 1.00 73.45 C ATOM 929 O GLU A 59 0.468 6.162 -2.048 1.00 64.31 O ATOM 930 CB GLU A 59 -2.275 5.806 -3.864 1.00 60.01 C ATOM 931 CG GLU A 59 -2.419 7.252 -3.446 1.00 63.13 C ATOM 932 CD GLU A 59 -1.711 8.196 -4.391 1.00 73.11 C ATOM 933 OE1 GLU A 59 -2.322 8.633 -5.383 1.00 63.30 O ATOM 934 OE2 GLU A 59 -0.525 8.514 -4.162 1.00 62.05 O ATOM 0 H GLU A 59 -1.681 3.482 -4.481 1.00 21.42 H new ATOM 0 HA GLU A 59 -0.255 5.983 -4.507 1.00 62.42 H new ATOM 0 HB2 GLU A 59 -2.711 5.683 -4.855 1.00 60.01 H new ATOM 0 HB3 GLU A 59 -2.855 5.185 -3.182 1.00 60.01 H new ATOM 0 HG2 GLU A 59 -3.477 7.511 -3.402 1.00 63.13 H new ATOM 0 HG3 GLU A 59 -2.017 7.379 -2.441 1.00 63.13 H new ATOM 941 N PHE A 60 -0.493 4.129 -1.792 1.00 1.40 N ATOM 942 CA PHE A 60 0.092 3.897 -0.494 1.00 15.30 C ATOM 943 C PHE A 60 1.581 3.639 -0.707 1.00 75.30 C ATOM 944 O PHE A 60 1.978 3.166 -1.778 1.00 62.34 O ATOM 945 CB PHE A 60 -0.569 2.694 0.217 1.00 50.40 C ATOM 946 CG PHE A 60 -2.068 2.817 0.465 1.00 11.24 C ATOM 947 CD1 PHE A 60 -2.973 2.370 -0.471 1.00 61.12 C ATOM 948 CD2 PHE A 60 -2.556 3.370 1.635 1.00 4.43 C ATOM 949 CE1 PHE A 60 -4.338 2.473 -0.257 1.00 74.13 C ATOM 950 CE2 PHE A 60 -3.918 3.479 1.863 1.00 60.30 C ATOM 951 CZ PHE A 60 -4.811 3.031 0.912 1.00 41.14 C ATOM 0 H PHE A 60 -1.107 3.382 -2.117 1.00 1.40 H new ATOM 0 HA PHE A 60 -0.065 4.765 0.146 1.00 15.30 H new ATOM 0 HB2 PHE A 60 -0.390 1.799 -0.379 1.00 50.40 H new ATOM 0 HB3 PHE A 60 -0.072 2.543 1.175 1.00 50.40 H new ATOM 0 HD1 PHE A 60 -2.612 1.931 -1.389 1.00 61.12 H new ATOM 0 HD2 PHE A 60 -1.863 3.723 2.384 1.00 4.43 H new ATOM 0 HE1 PHE A 60 -5.031 2.117 -1.005 1.00 74.13 H new ATOM 0 HE2 PHE A 60 -4.280 3.914 2.783 1.00 60.30 H new ATOM 0 HZ PHE A 60 -5.874 3.117 1.082 1.00 41.14 H new ATOM 961 N ASP A 61 2.398 3.966 0.269 1.00 33.14 N ATOM 962 CA ASP A 61 3.843 3.820 0.106 1.00 52.43 C ATOM 963 C ASP A 61 4.258 2.348 0.023 1.00 22.33 C ATOM 964 O ASP A 61 4.131 1.589 0.998 1.00 34.55 O ATOM 965 CB ASP A 61 4.615 4.580 1.185 1.00 14.21 C ATOM 966 CG ASP A 61 6.106 4.535 0.961 1.00 52.05 C ATOM 967 OD1 ASP A 61 6.599 5.244 0.052 1.00 22.32 O ATOM 968 OD2 ASP A 61 6.806 3.794 1.668 1.00 25.45 O ATOM 0 H ASP A 61 2.101 4.330 1.174 1.00 33.14 H new ATOM 0 HA ASP A 61 4.109 4.275 -0.848 1.00 52.43 H new ATOM 0 HB2 ASP A 61 4.284 5.618 1.202 1.00 14.21 H new ATOM 0 HB3 ASP A 61 4.384 4.155 2.162 1.00 14.21 H new ATOM 973 N LEU A 62 4.727 1.962 -1.163 1.00 32.04 N ATOM 974 CA LEU A 62 5.099 0.586 -1.480 1.00 40.40 C ATOM 975 C LEU A 62 6.538 0.290 -1.065 1.00 45.31 C ATOM 976 O LEU A 62 7.433 1.126 -1.244 1.00 60.53 O ATOM 977 CB LEU A 62 4.962 0.348 -3.003 1.00 62.32 C ATOM 978 CG LEU A 62 3.567 0.581 -3.625 1.00 2.22 C ATOM 979 CD1 LEU A 62 3.628 0.549 -5.143 1.00 11.34 C ATOM 980 CD2 LEU A 62 2.628 -0.484 -3.174 1.00 60.32 C ATOM 0 H LEU A 62 4.861 2.607 -1.942 1.00 32.04 H new ATOM 0 HA LEU A 62 4.432 -0.076 -0.929 1.00 40.40 H new ATOM 0 HB2 LEU A 62 5.673 0.997 -3.513 1.00 62.32 H new ATOM 0 HB3 LEU A 62 5.260 -0.679 -3.214 1.00 62.32 H new ATOM 0 HG LEU A 62 3.221 1.562 -3.300 1.00 2.22 H new ATOM 0 HD11 LEU A 62 2.631 0.716 -5.551 1.00 11.34 H new ATOM 0 HD12 LEU A 62 4.300 1.331 -5.497 1.00 11.34 H new ATOM 0 HD13 LEU A 62 3.996 -0.423 -5.472 1.00 11.34 H new ATOM 0 HD21 LEU A 62 1.646 -0.314 -3.616 1.00 60.32 H new ATOM 0 HD22 LEU A 62 3.004 -1.458 -3.488 1.00 60.32 H new ATOM 0 HD23 LEU A 62 2.546 -0.460 -2.087 1.00 60.32 H new ATOM 992 N ASN A 63 6.749 -0.884 -0.509 1.00 40.02 N ATOM 993 CA ASN A 63 8.089 -1.362 -0.156 1.00 54.44 C ATOM 994 C ASN A 63 8.757 -2.027 -1.350 1.00 2.01 C ATOM 995 O ASN A 63 8.192 -2.057 -2.441 1.00 52.44 O ATOM 996 CB ASN A 63 8.028 -2.348 1.007 1.00 42.50 C ATOM 997 CG ASN A 63 7.648 -1.712 2.315 1.00 10.33 C ATOM 998 OD1 ASN A 63 7.972 -0.565 2.579 1.00 34.24 O ATOM 999 ND2 ASN A 63 6.947 -2.438 3.125 1.00 61.11 N ATOM 0 H ASN A 63 6.003 -1.542 -0.285 1.00 40.02 H new ATOM 0 HA ASN A 63 8.678 -0.496 0.145 1.00 54.44 H new ATOM 0 HB2 ASN A 63 7.308 -3.132 0.771 1.00 42.50 H new ATOM 0 HB3 ASN A 63 9.000 -2.830 1.115 1.00 42.50 H new ATOM 0 HD21 ASN A 63 6.645 -2.056 4.021 1.00 61.11 H new ATOM 0 HD22 ASN A 63 6.697 -3.393 2.867 1.00 61.11 H new ATOM 1006 N GLY A 64 9.936 -2.591 -1.119 1.00 51.03 N ATOM 1007 CA GLY A 64 10.742 -3.194 -2.186 1.00 42.54 C ATOM 1008 C GLY A 64 10.070 -4.363 -2.905 1.00 71.02 C ATOM 1009 O GLY A 64 10.259 -4.550 -4.102 1.00 23.52 O ATOM 0 H GLY A 64 10.363 -2.646 -0.194 1.00 51.03 H new ATOM 0 HA2 GLY A 64 10.985 -2.425 -2.919 1.00 42.54 H new ATOM 0 HA3 GLY A 64 11.685 -3.539 -1.761 1.00 42.54 H new ATOM 1013 N ASN A 65 9.308 -5.147 -2.185 1.00 35.14 N ATOM 1014 CA ASN A 65 8.605 -6.281 -2.788 1.00 53.13 C ATOM 1015 C ASN A 65 7.249 -5.832 -3.322 1.00 71.52 C ATOM 1016 O ASN A 65 6.627 -6.501 -4.152 1.00 10.23 O ATOM 1017 CB ASN A 65 8.458 -7.427 -1.761 1.00 72.23 C ATOM 1018 CG ASN A 65 7.707 -8.650 -2.287 1.00 24.23 C ATOM 1019 OD1 ASN A 65 8.303 -9.554 -2.880 1.00 23.32 O ATOM 1020 ND2 ASN A 65 6.421 -8.716 -2.031 1.00 40.23 N ATOM 0 H ASN A 65 9.151 -5.032 -1.184 1.00 35.14 H new ATOM 0 HA ASN A 65 9.188 -6.660 -3.628 1.00 53.13 H new ATOM 0 HB2 ASN A 65 9.451 -7.737 -1.435 1.00 72.23 H new ATOM 0 HB3 ASN A 65 7.939 -7.047 -0.881 1.00 72.23 H new ATOM 0 HD21 ASN A 65 5.884 -9.532 -2.324 1.00 40.23 H new ATOM 0 HD22 ASN A 65 5.959 -7.951 -1.539 1.00 40.23 H new ATOM 1027 N GLY A 66 6.835 -4.670 -2.884 1.00 54.44 N ATOM 1028 CA GLY A 66 5.547 -4.147 -3.250 1.00 32.45 C ATOM 1029 C GLY A 66 4.530 -4.427 -2.190 1.00 13.13 C ATOM 1030 O GLY A 66 3.396 -4.763 -2.476 1.00 65.02 O ATOM 0 H GLY A 66 7.378 -4.065 -2.268 1.00 54.44 H new ATOM 0 HA2 GLY A 66 5.621 -3.072 -3.412 1.00 32.45 H new ATOM 0 HA3 GLY A 66 5.226 -4.590 -4.192 1.00 32.45 H new ATOM 1034 N ASP A 67 4.948 -4.268 -0.974 1.00 24.21 N ATOM 1035 CA ASP A 67 4.125 -4.531 0.195 1.00 72.25 C ATOM 1036 C ASP A 67 3.999 -3.272 1.021 1.00 50.22 C ATOM 1037 O ASP A 67 4.711 -2.298 0.766 1.00 24.31 O ATOM 1038 CB ASP A 67 4.712 -5.680 1.019 1.00 54.45 C ATOM 1039 CG ASP A 67 6.159 -5.458 1.387 1.00 3.02 C ATOM 1040 OD1 ASP A 67 7.039 -5.827 0.590 1.00 54.33 O ATOM 1041 OD2 ASP A 67 6.440 -4.925 2.452 1.00 34.13 O ATOM 0 H ASP A 67 5.889 -3.945 -0.747 1.00 24.21 H new ATOM 0 HA ASP A 67 3.129 -4.834 -0.128 1.00 72.25 H new ATOM 0 HB2 ASP A 67 4.126 -5.804 1.929 1.00 54.45 H new ATOM 0 HB3 ASP A 67 4.624 -6.608 0.454 1.00 54.45 H new ATOM 1046 N ILE A 68 3.095 -3.274 1.977 1.00 52.33 N ATOM 1047 CA ILE A 68 2.814 -2.088 2.782 1.00 71.42 C ATOM 1048 C ILE A 68 2.795 -2.476 4.267 1.00 31.55 C ATOM 1049 O ILE A 68 2.323 -3.569 4.615 1.00 74.31 O ATOM 1050 CB ILE A 68 1.434 -1.470 2.369 1.00 55.24 C ATOM 1051 CG1 ILE A 68 1.416 -1.139 0.870 1.00 25.25 C ATOM 1052 CG2 ILE A 68 1.119 -0.207 3.179 1.00 54.30 C ATOM 1053 CD1 ILE A 68 0.075 -0.677 0.364 1.00 43.52 C ATOM 0 H ILE A 68 2.533 -4.089 2.223 1.00 52.33 H new ATOM 0 HA ILE A 68 3.592 -1.343 2.612 1.00 71.42 H new ATOM 0 HB ILE A 68 0.668 -2.215 2.582 1.00 55.24 H new ATOM 0 HG12 ILE A 68 2.156 -0.364 0.670 1.00 25.25 H new ATOM 0 HG13 ILE A 68 1.721 -2.023 0.309 1.00 25.25 H new ATOM 0 HG21 ILE A 68 0.155 0.195 2.866 1.00 54.30 H new ATOM 0 HG22 ILE A 68 1.082 -0.455 4.240 1.00 54.30 H new ATOM 0 HG23 ILE A 68 1.896 0.538 3.007 1.00 54.30 H new ATOM 0 HD11 ILE A 68 0.143 -0.463 -0.703 1.00 43.52 H new ATOM 0 HD12 ILE A 68 -0.666 -1.459 0.531 1.00 43.52 H new ATOM 0 HD13 ILE A 68 -0.224 0.225 0.897 1.00 43.52 H new ATOM 1065 N ASP A 69 3.301 -1.605 5.127 1.00 0.31 N ATOM 1066 CA ASP A 69 3.350 -1.887 6.557 1.00 55.31 C ATOM 1067 C ASP A 69 2.372 -1.024 7.308 1.00 23.11 C ATOM 1068 O ASP A 69 1.763 -0.103 6.746 1.00 53.22 O ATOM 1069 CB ASP A 69 4.727 -1.601 7.167 1.00 72.33 C ATOM 1070 CG ASP A 69 5.864 -2.387 6.603 1.00 2.11 C ATOM 1071 OD1 ASP A 69 6.124 -3.497 7.100 1.00 55.52 O ATOM 1072 OD2 ASP A 69 6.547 -1.887 5.688 1.00 11.43 O ATOM 0 H ASP A 69 3.684 -0.697 4.862 1.00 0.31 H new ATOM 0 HA ASP A 69 3.111 -2.946 6.650 1.00 55.31 H new ATOM 0 HB2 ASP A 69 4.946 -0.541 7.042 1.00 72.33 H new ATOM 0 HB3 ASP A 69 4.675 -1.791 8.239 1.00 72.33 H new ATOM 1077 N ILE A 70 2.255 -1.313 8.601 1.00 64.40 N ATOM 1078 CA ILE A 70 1.468 -0.525 9.537 1.00 33.33 C ATOM 1079 C ILE A 70 1.961 0.918 9.566 1.00 43.04 C ATOM 1080 O ILE A 70 1.189 1.839 9.751 1.00 20.45 O ATOM 1081 CB ILE A 70 1.455 -1.176 10.981 1.00 72.54 C ATOM 1082 CG1 ILE A 70 2.827 -1.361 11.615 1.00 13.25 C ATOM 1083 CG2 ILE A 70 0.721 -2.456 10.994 1.00 53.25 C ATOM 1084 CD1 ILE A 70 3.276 -0.187 12.406 1.00 35.51 C ATOM 0 H ILE A 70 2.713 -2.116 9.032 1.00 64.40 H new ATOM 0 HA ILE A 70 0.435 -0.517 9.190 1.00 33.33 H new ATOM 0 HB ILE A 70 0.933 -0.444 11.597 1.00 72.54 H new ATOM 0 HG12 ILE A 70 2.805 -2.238 12.262 1.00 13.25 H new ATOM 0 HG13 ILE A 70 3.557 -1.562 10.831 1.00 13.25 H new ATOM 0 HG21 ILE A 70 0.734 -2.872 12.001 1.00 53.25 H new ATOM 0 HG22 ILE A 70 -0.310 -2.287 10.684 1.00 53.25 H new ATOM 0 HG23 ILE A 70 1.197 -3.155 10.306 1.00 53.25 H new ATOM 0 HD11 ILE A 70 4.260 -0.388 12.829 1.00 35.51 H new ATOM 0 HD12 ILE A 70 3.331 0.688 11.759 1.00 35.51 H new ATOM 0 HD13 ILE A 70 2.567 0.002 13.212 1.00 35.51 H new ATOM 1096 N MET A 71 3.257 1.092 9.335 1.00 10.42 N ATOM 1097 CA MET A 71 3.877 2.413 9.306 1.00 55.11 C ATOM 1098 C MET A 71 3.586 3.166 8.017 1.00 60.01 C ATOM 1099 O MET A 71 3.143 4.315 8.060 1.00 22.41 O ATOM 1100 CB MET A 71 5.388 2.346 9.557 1.00 24.13 C ATOM 1101 CG MET A 71 6.092 3.697 9.420 1.00 45.05 C ATOM 1102 SD MET A 71 7.841 3.644 9.851 1.00 31.34 S ATOM 1103 CE MET A 71 7.717 3.242 11.594 1.00 33.41 C ATOM 0 H MET A 71 3.907 0.325 9.163 1.00 10.42 H new ATOM 0 HA MET A 71 3.422 2.972 10.124 1.00 55.11 H new ATOM 0 HB2 MET A 71 5.564 1.954 10.559 1.00 24.13 H new ATOM 0 HB3 MET A 71 5.834 1.641 8.855 1.00 24.13 H new ATOM 0 HG2 MET A 71 5.990 4.049 8.393 1.00 45.05 H new ATOM 0 HG3 MET A 71 5.591 4.425 10.058 1.00 45.05 H new ATOM 0 HE1 MET A 71 8.632 3.544 12.103 1.00 33.41 H new ATOM 0 HE2 MET A 71 6.868 3.769 12.030 1.00 33.41 H new ATOM 0 HE3 MET A 71 7.575 2.168 11.710 1.00 33.41 H new ATOM 1113 N SER A 72 3.820 2.534 6.871 1.00 73.32 N ATOM 1114 CA SER A 72 3.618 3.207 5.600 1.00 14.02 C ATOM 1115 C SER A 72 2.148 3.556 5.367 1.00 32.21 C ATOM 1116 O SER A 72 1.836 4.573 4.752 1.00 5.21 O ATOM 1117 CB SER A 72 4.237 2.422 4.435 1.00 24.51 C ATOM 1118 OG SER A 72 3.766 1.091 4.371 1.00 41.43 O ATOM 0 H SER A 72 4.145 1.570 6.799 1.00 73.32 H new ATOM 0 HA SER A 72 4.151 4.157 5.646 1.00 14.02 H new ATOM 0 HB2 SER A 72 4.011 2.930 3.497 1.00 24.51 H new ATOM 0 HB3 SER A 72 5.322 2.416 4.540 1.00 24.51 H new ATOM 0 HG SER A 72 4.186 0.631 3.614 1.00 41.43 H new ATOM 1124 N LEU A 73 1.258 2.724 5.882 1.00 14.32 N ATOM 1125 CA LEU A 73 -0.171 2.998 5.830 1.00 52.42 C ATOM 1126 C LEU A 73 -0.480 4.162 6.784 1.00 64.51 C ATOM 1127 O LEU A 73 -1.216 5.069 6.447 1.00 71.01 O ATOM 1128 CB LEU A 73 -0.953 1.750 6.277 1.00 14.21 C ATOM 1129 CG LEU A 73 -2.483 1.851 6.218 1.00 22.03 C ATOM 1130 CD1 LEU A 73 -2.946 2.029 4.795 1.00 24.43 C ATOM 1131 CD2 LEU A 73 -3.136 0.633 6.837 1.00 2.43 C ATOM 0 H LEU A 73 1.501 1.848 6.344 1.00 14.32 H new ATOM 0 HA LEU A 73 -0.464 3.257 4.813 1.00 52.42 H new ATOM 0 HB2 LEU A 73 -0.641 0.910 5.656 1.00 14.21 H new ATOM 0 HB3 LEU A 73 -0.665 1.514 7.301 1.00 14.21 H new ATOM 0 HG LEU A 73 -2.784 2.725 6.796 1.00 22.03 H new ATOM 0 HD11 LEU A 73 -4.034 2.099 4.772 1.00 24.43 H new ATOM 0 HD12 LEU A 73 -2.515 2.942 4.384 1.00 24.43 H new ATOM 0 HD13 LEU A 73 -2.625 1.175 4.198 1.00 24.43 H new ATOM 0 HD21 LEU A 73 -4.220 0.733 6.781 1.00 2.43 H new ATOM 0 HD22 LEU A 73 -2.826 -0.261 6.296 1.00 2.43 H new ATOM 0 HD23 LEU A 73 -2.833 0.549 7.881 1.00 2.43 H new ATOM 1143 N LYS A 74 0.119 4.123 7.967 1.00 72.43 N ATOM 1144 CA LYS A 74 -0.074 5.157 8.993 1.00 45.03 C ATOM 1145 C LYS A 74 0.330 6.551 8.461 1.00 31.03 C ATOM 1146 O LYS A 74 -0.361 7.539 8.715 1.00 42.41 O ATOM 1147 CB LYS A 74 0.702 4.740 10.266 1.00 75.55 C ATOM 1148 CG LYS A 74 0.480 5.561 11.544 1.00 5.11 C ATOM 1149 CD LYS A 74 1.227 6.879 11.567 1.00 31.40 C ATOM 1150 CE LYS A 74 2.728 6.655 11.463 1.00 61.55 C ATOM 1151 NZ LYS A 74 3.483 7.905 11.688 1.00 35.44 N ATOM 0 H LYS A 74 0.754 3.376 8.249 1.00 72.43 H new ATOM 0 HA LYS A 74 -1.129 5.241 9.253 1.00 45.03 H new ATOM 0 HB2 LYS A 74 0.450 3.703 10.487 1.00 75.55 H new ATOM 0 HB3 LYS A 74 1.766 4.766 10.032 1.00 75.55 H new ATOM 0 HG2 LYS A 74 -0.586 5.757 11.657 1.00 5.11 H new ATOM 0 HG3 LYS A 74 0.787 4.966 12.404 1.00 5.11 H new ATOM 0 HD2 LYS A 74 0.891 7.506 10.741 1.00 31.40 H new ATOM 0 HD3 LYS A 74 0.998 7.415 12.488 1.00 31.40 H new ATOM 0 HE2 LYS A 74 3.036 5.907 12.194 1.00 61.55 H new ATOM 0 HE3 LYS A 74 2.969 6.256 10.478 1.00 61.55 H new ATOM 0 HZ1 LYS A 74 4.486 7.681 11.846 1.00 35.44 H new ATOM 0 HZ2 LYS A 74 3.392 8.520 10.854 1.00 35.44 H new ATOM 0 HZ3 LYS A 74 3.102 8.395 12.523 1.00 35.44 H new ATOM 1165 N ARG A 75 1.432 6.610 7.705 1.00 74.31 N ATOM 1166 CA ARG A 75 1.880 7.870 7.066 1.00 63.55 C ATOM 1167 C ARG A 75 0.804 8.428 6.142 1.00 63.15 C ATOM 1168 O ARG A 75 0.579 9.645 6.078 1.00 75.00 O ATOM 1169 CB ARG A 75 3.178 7.653 6.280 1.00 61.24 C ATOM 1170 CG ARG A 75 4.401 7.414 7.141 1.00 2.05 C ATOM 1171 CD ARG A 75 4.739 8.658 7.950 1.00 32.42 C ATOM 1172 NE ARG A 75 5.052 9.799 7.086 1.00 71.51 N ATOM 1173 CZ ARG A 75 4.736 11.071 7.345 1.00 22.12 C ATOM 1174 NH1 ARG A 75 4.014 11.384 8.422 1.00 64.22 N ATOM 1175 NH2 ARG A 75 5.122 12.032 6.514 1.00 62.23 N ATOM 0 H ARG A 75 2.033 5.808 7.516 1.00 74.31 H new ATOM 0 HA ARG A 75 2.067 8.593 7.860 1.00 63.55 H new ATOM 0 HB2 ARG A 75 3.046 6.801 5.614 1.00 61.24 H new ATOM 0 HB3 ARG A 75 3.357 8.525 5.651 1.00 61.24 H new ATOM 0 HG2 ARG A 75 4.221 6.575 7.813 1.00 2.05 H new ATOM 0 HG3 ARG A 75 5.248 7.142 6.511 1.00 2.05 H new ATOM 0 HD2 ARG A 75 3.899 8.911 8.596 1.00 32.42 H new ATOM 0 HD3 ARG A 75 5.589 8.450 8.600 1.00 32.42 H new ATOM 0 HE ARG A 75 5.551 9.607 6.217 1.00 71.51 H new ATOM 0 HH11 ARG A 75 3.699 10.650 9.056 1.00 64.22 H new ATOM 0 HH12 ARG A 75 3.777 12.358 8.612 1.00 64.22 H new ATOM 0 HH21 ARG A 75 5.659 11.799 5.679 1.00 62.23 H new ATOM 0 HH22 ARG A 75 4.881 13.003 6.711 1.00 62.23 H new ATOM 1189 N MET A 76 0.134 7.529 5.464 1.00 52.13 N ATOM 1190 CA MET A 76 -0.937 7.852 4.541 1.00 74.32 C ATOM 1191 C MET A 76 -2.088 8.480 5.290 1.00 33.20 C ATOM 1192 O MET A 76 -2.571 9.535 4.920 1.00 34.53 O ATOM 1193 CB MET A 76 -1.384 6.576 3.857 1.00 44.25 C ATOM 1194 CG MET A 76 -0.313 5.962 2.982 1.00 25.42 C ATOM 1195 SD MET A 76 -0.046 6.883 1.473 1.00 41.02 S ATOM 1196 CE MET A 76 -1.667 6.696 0.750 1.00 33.23 C ATOM 0 H MET A 76 0.319 6.529 5.537 1.00 52.13 H new ATOM 0 HA MET A 76 -0.587 8.564 3.794 1.00 74.32 H new ATOM 0 HB2 MET A 76 -1.685 5.852 4.614 1.00 44.25 H new ATOM 0 HB3 MET A 76 -2.264 6.786 3.249 1.00 44.25 H new ATOM 0 HG2 MET A 76 0.621 5.909 3.541 1.00 25.42 H new ATOM 0 HG3 MET A 76 -0.594 4.939 2.734 1.00 25.42 H new ATOM 0 HE1 MET A 76 -1.569 6.337 -0.275 1.00 33.23 H new ATOM 0 HE2 MET A 76 -2.245 5.978 1.332 1.00 33.23 H new ATOM 0 HE3 MET A 76 -2.179 7.658 0.750 1.00 33.23 H new ATOM 1206 N LEU A 77 -2.496 7.827 6.362 1.00 41.01 N ATOM 1207 CA LEU A 77 -3.559 8.314 7.246 1.00 51.13 C ATOM 1208 C LEU A 77 -3.249 9.703 7.796 1.00 41.02 C ATOM 1209 O LEU A 77 -4.139 10.552 7.873 1.00 13.23 O ATOM 1210 CB LEU A 77 -3.829 7.302 8.373 1.00 71.44 C ATOM 1211 CG LEU A 77 -4.749 6.097 8.032 1.00 30.12 C ATOM 1212 CD1 LEU A 77 -4.285 5.332 6.809 1.00 15.23 C ATOM 1213 CD2 LEU A 77 -4.839 5.162 9.212 1.00 1.04 C ATOM 0 H LEU A 77 -2.100 6.933 6.654 1.00 41.01 H new ATOM 0 HA LEU A 77 -4.469 8.410 6.654 1.00 51.13 H new ATOM 0 HB2 LEU A 77 -2.871 6.911 8.714 1.00 71.44 H new ATOM 0 HB3 LEU A 77 -4.271 7.839 9.212 1.00 71.44 H new ATOM 0 HG LEU A 77 -5.733 6.507 7.804 1.00 30.12 H new ATOM 0 HD11 LEU A 77 -4.966 4.502 6.619 1.00 15.23 H new ATOM 0 HD12 LEU A 77 -4.275 5.998 5.946 1.00 15.23 H new ATOM 0 HD13 LEU A 77 -3.280 4.945 6.981 1.00 15.23 H new ATOM 0 HD21 LEU A 77 -5.486 4.321 8.962 1.00 1.04 H new ATOM 0 HD22 LEU A 77 -3.844 4.793 9.460 1.00 1.04 H new ATOM 0 HD23 LEU A 77 -5.252 5.695 10.068 1.00 1.04 H new ATOM 1225 N GLU A 78 -1.984 9.945 8.143 1.00 51.51 N ATOM 1226 CA GLU A 78 -1.568 11.271 8.604 1.00 42.35 C ATOM 1227 C GLU A 78 -1.778 12.298 7.498 1.00 11.14 C ATOM 1228 O GLU A 78 -2.311 13.379 7.735 1.00 31.31 O ATOM 1229 CB GLU A 78 -0.099 11.290 9.034 1.00 15.13 C ATOM 1230 CG GLU A 78 0.235 10.350 10.168 1.00 53.32 C ATOM 1231 CD GLU A 78 1.669 10.485 10.617 1.00 4.44 C ATOM 1232 OE1 GLU A 78 2.546 9.791 10.071 1.00 21.05 O ATOM 1233 OE2 GLU A 78 1.948 11.285 11.546 1.00 53.55 O ATOM 0 H GLU A 78 -1.238 9.250 8.115 1.00 51.51 H new ATOM 0 HA GLU A 78 -2.181 11.521 9.470 1.00 42.35 H new ATOM 0 HB2 GLU A 78 0.521 11.036 8.174 1.00 15.13 H new ATOM 0 HB3 GLU A 78 0.166 12.305 9.330 1.00 15.13 H new ATOM 0 HG2 GLU A 78 -0.428 10.549 11.010 1.00 53.32 H new ATOM 0 HG3 GLU A 78 0.050 9.323 9.853 1.00 53.32 H new ATOM 1240 N LYS A 79 -1.392 11.925 6.281 1.00 1.52 N ATOM 1241 CA LYS A 79 -1.513 12.796 5.111 1.00 10.21 C ATOM 1242 C LYS A 79 -2.991 13.037 4.781 1.00 65.34 C ATOM 1243 O LYS A 79 -3.371 14.110 4.315 1.00 22.25 O ATOM 1244 CB LYS A 79 -0.793 12.155 3.909 1.00 71.15 C ATOM 1245 CG LYS A 79 -0.747 13.010 2.652 1.00 11.40 C ATOM 1246 CD LYS A 79 0.041 12.319 1.549 1.00 21.54 C ATOM 1247 CE LYS A 79 0.142 13.187 0.304 1.00 21.52 C ATOM 1248 NZ LYS A 79 0.925 12.533 -0.768 1.00 74.23 N ATOM 0 H LYS A 79 -0.987 11.012 6.076 1.00 1.52 H new ATOM 0 HA LYS A 79 -1.047 13.757 5.331 1.00 10.21 H new ATOM 0 HB2 LYS A 79 0.229 11.915 4.204 1.00 71.15 H new ATOM 0 HB3 LYS A 79 -1.286 11.213 3.671 1.00 71.15 H new ATOM 0 HG2 LYS A 79 -1.761 13.211 2.308 1.00 11.40 H new ATOM 0 HG3 LYS A 79 -0.291 13.974 2.880 1.00 11.40 H new ATOM 0 HD2 LYS A 79 1.042 12.082 1.910 1.00 21.54 H new ATOM 0 HD3 LYS A 79 -0.439 11.374 1.296 1.00 21.54 H new ATOM 0 HE2 LYS A 79 -0.859 13.411 -0.064 1.00 21.52 H new ATOM 0 HE3 LYS A 79 0.606 14.139 0.563 1.00 21.52 H new ATOM 0 HZ1 LYS A 79 0.969 13.159 -1.597 1.00 74.23 H new ATOM 0 HZ2 LYS A 79 1.889 12.343 -0.427 1.00 74.23 H new ATOM 0 HZ3 LYS A 79 0.469 11.637 -1.034 1.00 74.23 H new ATOM 1262 N LEU A 80 -3.805 12.033 5.042 1.00 65.21 N ATOM 1263 CA LEU A 80 -5.243 12.092 4.807 1.00 43.34 C ATOM 1264 C LEU A 80 -5.958 12.903 5.885 1.00 13.22 C ATOM 1265 O LEU A 80 -7.124 13.281 5.723 1.00 21.21 O ATOM 1266 CB LEU A 80 -5.821 10.683 4.745 1.00 44.21 C ATOM 1267 CG LEU A 80 -5.310 9.800 3.605 1.00 71.04 C ATOM 1268 CD1 LEU A 80 -5.883 8.411 3.722 1.00 42.24 C ATOM 1269 CD2 LEU A 80 -5.661 10.406 2.254 1.00 64.03 C ATOM 0 H LEU A 80 -3.488 11.143 5.427 1.00 65.21 H new ATOM 0 HA LEU A 80 -5.403 12.593 3.852 1.00 43.34 H new ATOM 0 HB2 LEU A 80 -5.609 10.182 5.690 1.00 44.21 H new ATOM 0 HB3 LEU A 80 -6.905 10.759 4.661 1.00 44.21 H new ATOM 0 HG LEU A 80 -4.224 9.738 3.680 1.00 71.04 H new ATOM 0 HD11 LEU A 80 -5.511 7.794 2.904 1.00 42.24 H new ATOM 0 HD12 LEU A 80 -5.582 7.972 4.674 1.00 42.24 H new ATOM 0 HD13 LEU A 80 -6.971 8.461 3.673 1.00 42.24 H new ATOM 0 HD21 LEU A 80 -5.288 9.761 1.458 1.00 64.03 H new ATOM 0 HD22 LEU A 80 -6.744 10.500 2.168 1.00 64.03 H new ATOM 0 HD23 LEU A 80 -5.203 11.391 2.167 1.00 64.03 H new ATOM 1281 N GLY A 81 -5.266 13.161 6.978 1.00 23.31 N ATOM 1282 CA GLY A 81 -5.841 13.927 8.057 1.00 1.51 C ATOM 1283 C GLY A 81 -6.629 13.063 9.011 1.00 65.44 C ATOM 1284 O GLY A 81 -7.375 13.570 9.853 1.00 25.14 O ATOM 0 H GLY A 81 -4.308 12.851 7.138 1.00 23.31 H new ATOM 0 HA2 GLY A 81 -5.047 14.437 8.602 1.00 1.51 H new ATOM 0 HA3 GLY A 81 -6.492 14.699 7.646 1.00 1.51 H new ATOM 1288 N VAL A 82 -6.468 11.765 8.886 1.00 65.33 N ATOM 1289 CA VAL A 82 -7.155 10.803 9.732 1.00 74.41 C ATOM 1290 C VAL A 82 -6.187 9.777 10.336 1.00 72.34 C ATOM 1291 O VAL A 82 -6.088 8.650 9.873 1.00 74.21 O ATOM 1292 CB VAL A 82 -8.334 10.083 9.001 1.00 25.45 C ATOM 1293 CG1 VAL A 82 -9.524 11.015 8.847 1.00 13.44 C ATOM 1294 CG2 VAL A 82 -7.895 9.614 7.613 1.00 43.52 C ATOM 0 H VAL A 82 -5.854 11.340 8.191 1.00 65.33 H new ATOM 0 HA VAL A 82 -7.588 11.383 10.546 1.00 74.41 H new ATOM 0 HB VAL A 82 -8.623 9.224 9.607 1.00 25.45 H new ATOM 0 HG11 VAL A 82 -10.332 10.492 8.336 1.00 13.44 H new ATOM 0 HG12 VAL A 82 -9.865 11.335 9.831 1.00 13.44 H new ATOM 0 HG13 VAL A 82 -9.230 11.887 8.263 1.00 13.44 H new ATOM 0 HG21 VAL A 82 -8.728 9.115 7.117 1.00 43.52 H new ATOM 0 HG22 VAL A 82 -7.583 10.474 7.020 1.00 43.52 H new ATOM 0 HG23 VAL A 82 -7.061 8.919 7.711 1.00 43.52 H new ATOM 1304 N PRO A 83 -5.429 10.168 11.357 1.00 55.40 N ATOM 1305 CA PRO A 83 -4.457 9.304 11.971 1.00 51.45 C ATOM 1306 C PRO A 83 -5.044 8.472 13.107 1.00 42.13 C ATOM 1307 O PRO A 83 -5.496 9.008 14.127 1.00 32.41 O ATOM 1308 CB PRO A 83 -3.399 10.287 12.520 1.00 11.33 C ATOM 1309 CG PRO A 83 -3.984 11.667 12.345 1.00 20.24 C ATOM 1310 CD PRO A 83 -5.435 11.482 11.995 1.00 1.20 C ATOM 0 HA PRO A 83 -4.061 8.576 11.263 1.00 51.45 H new ATOM 0 HB2 PRO A 83 -3.185 10.084 13.569 1.00 11.33 H new ATOM 0 HB3 PRO A 83 -2.458 10.190 11.978 1.00 11.33 H new ATOM 0 HG2 PRO A 83 -3.878 12.251 13.259 1.00 20.24 H new ATOM 0 HG3 PRO A 83 -3.463 12.211 11.557 1.00 20.24 H new ATOM 0 HD2 PRO A 83 -6.074 11.504 12.878 1.00 1.20 H new ATOM 0 HD3 PRO A 83 -5.795 12.260 11.322 1.00 1.20 H new ATOM 1318 N LYS A 84 -5.081 7.177 12.913 1.00 62.11 N ATOM 1319 CA LYS A 84 -5.493 6.271 13.959 1.00 15.31 C ATOM 1320 C LYS A 84 -4.263 5.867 14.765 1.00 14.52 C ATOM 1321 O LYS A 84 -3.129 6.108 14.325 1.00 60.03 O ATOM 1322 CB LYS A 84 -6.238 5.018 13.413 1.00 13.21 C ATOM 1323 CG LYS A 84 -7.653 5.261 12.832 1.00 53.12 C ATOM 1324 CD LYS A 84 -7.654 6.119 11.573 1.00 15.02 C ATOM 1325 CE LYS A 84 -9.070 6.361 11.053 1.00 74.00 C ATOM 1326 NZ LYS A 84 -9.764 5.102 10.684 1.00 24.52 N ATOM 0 H LYS A 84 -4.829 6.723 12.035 1.00 62.11 H new ATOM 0 HA LYS A 84 -6.209 6.788 14.598 1.00 15.31 H new ATOM 0 HB2 LYS A 84 -5.622 4.565 12.636 1.00 13.21 H new ATOM 0 HB3 LYS A 84 -6.320 4.290 14.220 1.00 13.21 H new ATOM 0 HG2 LYS A 84 -8.115 4.300 12.607 1.00 53.12 H new ATOM 0 HG3 LYS A 84 -8.271 5.742 13.590 1.00 53.12 H new ATOM 0 HD2 LYS A 84 -7.176 7.075 11.785 1.00 15.02 H new ATOM 0 HD3 LYS A 84 -7.061 5.630 10.800 1.00 15.02 H new ATOM 0 HE2 LYS A 84 -9.649 6.881 11.816 1.00 74.00 H new ATOM 0 HE3 LYS A 84 -9.027 7.016 10.183 1.00 74.00 H new ATOM 0 HZ1 LYS A 84 -10.647 5.326 10.183 1.00 24.52 H new ATOM 0 HZ2 LYS A 84 -9.149 4.535 10.065 1.00 24.52 H new ATOM 0 HZ3 LYS A 84 -9.982 4.561 11.545 1.00 24.52 H new ATOM 1340 N THR A 85 -4.463 5.254 15.905 1.00 1.12 N ATOM 1341 CA THR A 85 -3.364 4.893 16.760 1.00 15.11 C ATOM 1342 C THR A 85 -2.694 3.633 16.222 1.00 24.42 C ATOM 1343 O THR A 85 -3.316 2.874 15.468 1.00 44.12 O ATOM 1344 CB THR A 85 -3.822 4.707 18.248 1.00 11.33 C ATOM 1345 OG1 THR A 85 -2.702 4.418 19.093 1.00 1.35 O ATOM 1346 CG2 THR A 85 -4.852 3.600 18.389 1.00 71.35 C ATOM 0 H THR A 85 -5.382 4.994 16.262 1.00 1.12 H new ATOM 0 HA THR A 85 -2.640 5.708 16.758 1.00 15.11 H new ATOM 0 HB THR A 85 -4.280 5.647 18.556 1.00 11.33 H new ATOM 0 HG1 THR A 85 -3.009 4.307 20.017 1.00 1.35 H new ATOM 0 HG21 THR A 85 -5.142 3.504 19.435 1.00 71.35 H new ATOM 0 HG22 THR A 85 -5.730 3.841 17.789 1.00 71.35 H new ATOM 0 HG23 THR A 85 -4.424 2.659 18.044 1.00 71.35 H new ATOM 1354 N HIS A 86 -1.435 3.404 16.607 1.00 10.01 N ATOM 1355 CA HIS A 86 -0.666 2.245 16.134 1.00 11.11 C ATOM 1356 C HIS A 86 -1.388 0.938 16.395 1.00 42.23 C ATOM 1357 O HIS A 86 -1.251 -0.011 15.625 1.00 44.21 O ATOM 1358 CB HIS A 86 0.758 2.202 16.722 1.00 10.45 C ATOM 1359 CG HIS A 86 1.683 3.272 16.208 1.00 5.35 C ATOM 1360 ND1 HIS A 86 2.271 4.226 17.012 1.00 73.13 N ATOM 1361 CD2 HIS A 86 2.164 3.497 14.961 1.00 23.15 C ATOM 1362 CE1 HIS A 86 3.063 4.983 16.286 1.00 53.31 C ATOM 1363 NE2 HIS A 86 3.020 4.562 15.038 1.00 23.23 N ATOM 0 H HIS A 86 -0.923 4.009 17.249 1.00 10.01 H new ATOM 0 HA HIS A 86 -0.573 2.370 15.055 1.00 11.11 H new ATOM 0 HB2 HIS A 86 0.691 2.289 17.807 1.00 10.45 H new ATOM 0 HB3 HIS A 86 1.196 1.228 16.506 1.00 10.45 H new ATOM 0 HD2 HIS A 86 1.917 2.938 14.070 1.00 23.15 H new ATOM 0 HE1 HIS A 86 3.651 5.812 16.651 1.00 53.31 H new ATOM 0 HE2 HIS A 86 3.539 4.964 14.258 1.00 23.23 H new ATOM 1372 N LEU A 87 -2.180 0.911 17.460 1.00 2.31 N ATOM 1373 CA LEU A 87 -2.977 -0.258 17.809 1.00 15.34 C ATOM 1374 C LEU A 87 -3.960 -0.584 16.690 1.00 52.41 C ATOM 1375 O LEU A 87 -4.150 -1.748 16.345 1.00 2.54 O ATOM 1376 CB LEU A 87 -3.746 -0.015 19.113 1.00 31.21 C ATOM 1377 CG LEU A 87 -2.908 0.284 20.357 1.00 75.32 C ATOM 1378 CD1 LEU A 87 -3.808 0.551 21.553 1.00 41.42 C ATOM 1379 CD2 LEU A 87 -1.968 -0.870 20.652 1.00 55.24 C ATOM 0 H LEU A 87 -2.288 1.695 18.103 1.00 2.31 H new ATOM 0 HA LEU A 87 -2.300 -1.101 17.948 1.00 15.34 H new ATOM 0 HB2 LEU A 87 -4.430 0.819 18.955 1.00 31.21 H new ATOM 0 HB3 LEU A 87 -4.357 -0.894 19.317 1.00 31.21 H new ATOM 0 HG LEU A 87 -2.313 1.177 20.165 1.00 75.32 H new ATOM 0 HD11 LEU A 87 -3.195 0.762 22.429 1.00 41.42 H new ATOM 0 HD12 LEU A 87 -4.448 1.408 21.343 1.00 41.42 H new ATOM 0 HD13 LEU A 87 -4.427 -0.325 21.745 1.00 41.42 H new ATOM 0 HD21 LEU A 87 -1.379 -0.641 21.540 1.00 55.24 H new ATOM 0 HD22 LEU A 87 -2.548 -1.777 20.825 1.00 55.24 H new ATOM 0 HD23 LEU A 87 -1.301 -1.022 19.803 1.00 55.24 H new ATOM 1391 N GLU A 88 -4.543 0.458 16.100 1.00 72.23 N ATOM 1392 CA GLU A 88 -5.519 0.293 15.048 1.00 4.43 C ATOM 1393 C GLU A 88 -4.868 -0.182 13.773 1.00 40.12 C ATOM 1394 O GLU A 88 -5.358 -1.100 13.139 1.00 71.33 O ATOM 1395 CB GLU A 88 -6.306 1.575 14.795 1.00 33.01 C ATOM 1396 CG GLU A 88 -7.093 2.055 15.998 1.00 75.22 C ATOM 1397 CD GLU A 88 -8.033 1.004 16.530 1.00 74.25 C ATOM 1398 OE1 GLU A 88 -9.152 0.852 15.993 1.00 41.55 O ATOM 1399 OE2 GLU A 88 -7.671 0.308 17.485 1.00 43.50 O ATOM 0 H GLU A 88 -4.348 1.429 16.342 1.00 72.23 H new ATOM 0 HA GLU A 88 -6.223 -0.468 15.385 1.00 4.43 H new ATOM 0 HB2 GLU A 88 -5.615 2.360 14.487 1.00 33.01 H new ATOM 0 HB3 GLU A 88 -6.993 1.411 13.965 1.00 33.01 H new ATOM 0 HG2 GLU A 88 -6.401 2.351 16.786 1.00 75.22 H new ATOM 0 HG3 GLU A 88 -7.663 2.943 15.724 1.00 75.22 H new ATOM 1406 N LEU A 89 -3.746 0.431 13.415 1.00 74.54 N ATOM 1407 CA LEU A 89 -3.007 0.043 12.201 1.00 62.02 C ATOM 1408 C LEU A 89 -2.649 -1.432 12.240 1.00 71.35 C ATOM 1409 O LEU A 89 -2.934 -2.174 11.303 1.00 32.53 O ATOM 1410 CB LEU A 89 -1.702 0.863 12.033 1.00 43.54 C ATOM 1411 CG LEU A 89 -1.778 2.334 11.571 1.00 31.14 C ATOM 1412 CD1 LEU A 89 -2.322 2.445 10.172 1.00 40.14 C ATOM 1413 CD2 LEU A 89 -2.568 3.207 12.517 1.00 4.22 C ATOM 0 H LEU A 89 -3.323 1.196 13.940 1.00 74.54 H new ATOM 0 HA LEU A 89 -3.664 0.247 11.355 1.00 62.02 H new ATOM 0 HB2 LEU A 89 -1.183 0.849 12.991 1.00 43.54 H new ATOM 0 HB3 LEU A 89 -1.072 0.330 11.321 1.00 43.54 H new ATOM 0 HG LEU A 89 -0.753 2.704 11.576 1.00 31.14 H new ATOM 0 HD11 LEU A 89 -2.362 3.494 9.879 1.00 40.14 H new ATOM 0 HD12 LEU A 89 -1.674 1.901 9.485 1.00 40.14 H new ATOM 0 HD13 LEU A 89 -3.325 2.020 10.137 1.00 40.14 H new ATOM 0 HD21 LEU A 89 -2.586 4.229 12.139 1.00 4.22 H new ATOM 0 HD22 LEU A 89 -3.588 2.830 12.594 1.00 4.22 H new ATOM 0 HD23 LEU A 89 -2.101 3.192 13.502 1.00 4.22 H new ATOM 1425 N LYS A 90 -2.067 -1.855 13.350 1.00 25.35 N ATOM 1426 CA LYS A 90 -1.648 -3.236 13.526 1.00 3.51 C ATOM 1427 C LYS A 90 -2.856 -4.187 13.475 1.00 50.12 C ATOM 1428 O LYS A 90 -2.774 -5.285 12.899 1.00 14.45 O ATOM 1429 CB LYS A 90 -0.896 -3.371 14.837 1.00 10.22 C ATOM 1430 CG LYS A 90 0.438 -2.622 14.860 1.00 53.42 C ATOM 1431 CD LYS A 90 0.938 -2.491 16.297 1.00 65.22 C ATOM 1432 CE LYS A 90 2.224 -1.688 16.409 1.00 5.32 C ATOM 1433 NZ LYS A 90 3.399 -2.367 15.822 1.00 63.30 N ATOM 0 H LYS A 90 -1.872 -1.254 14.151 1.00 25.35 H new ATOM 0 HA LYS A 90 -0.983 -3.515 12.709 1.00 3.51 H new ATOM 0 HB2 LYS A 90 -1.525 -3.000 15.646 1.00 10.22 H new ATOM 0 HB3 LYS A 90 -0.713 -4.427 15.034 1.00 10.22 H new ATOM 0 HG2 LYS A 90 1.174 -3.154 14.257 1.00 53.42 H new ATOM 0 HG3 LYS A 90 0.317 -1.634 14.417 1.00 53.42 H new ATOM 0 HD2 LYS A 90 0.166 -2.016 16.902 1.00 65.22 H new ATOM 0 HD3 LYS A 90 1.101 -3.486 16.711 1.00 65.22 H new ATOM 0 HE2 LYS A 90 2.086 -0.726 15.915 1.00 5.32 H new ATOM 0 HE3 LYS A 90 2.423 -1.480 17.460 1.00 5.32 H new ATOM 0 HZ1 LYS A 90 4.188 -1.694 15.748 1.00 63.30 H new ATOM 0 HZ2 LYS A 90 3.679 -3.163 16.430 1.00 63.30 H new ATOM 0 HZ3 LYS A 90 3.157 -2.723 14.875 1.00 63.30 H new ATOM 1447 N LYS A 91 -3.977 -3.725 14.036 1.00 71.11 N ATOM 1448 CA LYS A 91 -5.240 -4.467 14.056 1.00 51.11 C ATOM 1449 C LYS A 91 -5.716 -4.712 12.639 1.00 63.41 C ATOM 1450 O LYS A 91 -6.073 -5.833 12.264 1.00 4.44 O ATOM 1451 CB LYS A 91 -6.310 -3.617 14.767 1.00 42.04 C ATOM 1452 CG LYS A 91 -7.725 -4.205 14.750 1.00 43.24 C ATOM 1453 CD LYS A 91 -8.768 -3.187 15.223 1.00 2.44 C ATOM 1454 CE LYS A 91 -8.539 -2.751 16.655 1.00 31.30 C ATOM 1455 NZ LYS A 91 -9.523 -1.734 17.088 1.00 44.52 N ATOM 0 H LYS A 91 -4.033 -2.815 14.494 1.00 71.11 H new ATOM 0 HA LYS A 91 -5.085 -5.415 14.571 1.00 51.11 H new ATOM 0 HB2 LYS A 91 -6.006 -3.472 15.804 1.00 42.04 H new ATOM 0 HB3 LYS A 91 -6.337 -2.632 14.302 1.00 42.04 H new ATOM 0 HG2 LYS A 91 -7.970 -4.534 13.740 1.00 43.24 H new ATOM 0 HG3 LYS A 91 -7.760 -5.086 15.390 1.00 43.24 H new ATOM 0 HD2 LYS A 91 -8.741 -2.314 14.571 1.00 2.44 H new ATOM 0 HD3 LYS A 91 -9.763 -3.622 15.133 1.00 2.44 H new ATOM 0 HE2 LYS A 91 -8.601 -3.618 17.312 1.00 31.30 H new ATOM 0 HE3 LYS A 91 -7.532 -2.347 16.754 1.00 31.30 H new ATOM 0 HZ1 LYS A 91 -9.040 -0.995 17.637 1.00 44.52 H new ATOM 0 HZ2 LYS A 91 -9.971 -1.307 16.252 1.00 44.52 H new ATOM 0 HZ3 LYS A 91 -10.251 -2.184 17.679 1.00 44.52 H new ATOM 1469 N LEU A 92 -5.713 -3.654 11.865 1.00 1.13 N ATOM 1470 CA LEU A 92 -6.212 -3.678 10.518 1.00 24.53 C ATOM 1471 C LEU A 92 -5.356 -4.534 9.617 1.00 72.03 C ATOM 1472 O LEU A 92 -5.872 -5.313 8.809 1.00 52.21 O ATOM 1473 CB LEU A 92 -6.280 -2.269 9.960 1.00 61.43 C ATOM 1474 CG LEU A 92 -7.093 -1.251 10.762 1.00 4.55 C ATOM 1475 CD1 LEU A 92 -7.197 0.061 10.027 1.00 63.23 C ATOM 1476 CD2 LEU A 92 -8.459 -1.779 11.106 1.00 71.32 C ATOM 0 H LEU A 92 -5.359 -2.744 12.159 1.00 1.13 H new ATOM 0 HA LEU A 92 -7.211 -4.113 10.549 1.00 24.53 H new ATOM 0 HB2 LEU A 92 -5.262 -1.892 9.864 1.00 61.43 H new ATOM 0 HB3 LEU A 92 -6.697 -2.321 8.954 1.00 61.43 H new ATOM 0 HG LEU A 92 -6.561 -1.077 11.697 1.00 4.55 H new ATOM 0 HD11 LEU A 92 -7.780 0.765 10.620 1.00 63.23 H new ATOM 0 HD12 LEU A 92 -6.198 0.465 9.862 1.00 63.23 H new ATOM 0 HD13 LEU A 92 -7.688 -0.098 9.067 1.00 63.23 H new ATOM 0 HD21 LEU A 92 -9.007 -1.028 11.675 1.00 71.32 H new ATOM 0 HD22 LEU A 92 -9.003 -2.007 10.189 1.00 71.32 H new ATOM 0 HD23 LEU A 92 -8.359 -2.685 11.703 1.00 71.32 H new ATOM 1488 N ILE A 93 -4.056 -4.398 9.757 1.00 24.21 N ATOM 1489 CA ILE A 93 -3.137 -5.131 8.918 1.00 22.32 C ATOM 1490 C ILE A 93 -3.195 -6.620 9.218 1.00 11.45 C ATOM 1491 O ILE A 93 -3.143 -7.430 8.311 1.00 21.31 O ATOM 1492 CB ILE A 93 -1.680 -4.636 9.060 1.00 73.23 C ATOM 1493 CG1 ILE A 93 -1.570 -3.133 8.766 1.00 23.34 C ATOM 1494 CG2 ILE A 93 -0.757 -5.421 8.136 1.00 24.03 C ATOM 1495 CD1 ILE A 93 -1.978 -2.709 7.395 1.00 70.31 C ATOM 0 H ILE A 93 -3.613 -3.787 10.443 1.00 24.21 H new ATOM 0 HA ILE A 93 -3.454 -4.952 7.891 1.00 22.32 H new ATOM 0 HB ILE A 93 -1.372 -4.802 10.092 1.00 73.23 H new ATOM 0 HG12 ILE A 93 -2.182 -2.595 9.490 1.00 23.34 H new ATOM 0 HG13 ILE A 93 -0.537 -2.824 8.929 1.00 23.34 H new ATOM 0 HG21 ILE A 93 0.265 -5.059 8.249 1.00 24.03 H new ATOM 0 HG22 ILE A 93 -0.798 -6.479 8.394 1.00 24.03 H new ATOM 0 HG23 ILE A 93 -1.077 -5.287 7.103 1.00 24.03 H new ATOM 0 HD11 ILE A 93 -1.860 -1.630 7.298 1.00 70.31 H new ATOM 0 HD12 ILE A 93 -1.351 -3.210 6.657 1.00 70.31 H new ATOM 0 HD13 ILE A 93 -3.021 -2.977 7.227 1.00 70.31 H new ATOM 1507 N GLY A 94 -3.358 -6.976 10.486 1.00 45.52 N ATOM 1508 CA GLY A 94 -3.366 -8.394 10.859 1.00 51.15 C ATOM 1509 C GLY A 94 -4.651 -9.083 10.504 1.00 21.14 C ATOM 1510 O GLY A 94 -4.783 -10.295 10.667 1.00 40.14 O ATOM 0 H GLY A 94 -3.484 -6.324 11.260 1.00 45.52 H new ATOM 0 HA2 GLY A 94 -2.539 -8.900 10.362 1.00 51.15 H new ATOM 0 HA3 GLY A 94 -3.196 -8.483 11.932 1.00 51.15 H new ATOM 1514 N GLU A 95 -5.602 -8.324 10.028 1.00 34.23 N ATOM 1515 CA GLU A 95 -6.828 -8.894 9.575 1.00 60.21 C ATOM 1516 C GLU A 95 -6.586 -9.443 8.161 1.00 63.41 C ATOM 1517 O GLU A 95 -7.227 -10.398 7.709 1.00 4.02 O ATOM 1518 CB GLU A 95 -7.912 -7.835 9.555 1.00 22.42 C ATOM 1519 CG GLU A 95 -9.293 -8.397 9.360 1.00 20.21 C ATOM 1520 CD GLU A 95 -9.727 -9.242 10.536 1.00 32.44 C ATOM 1521 OE1 GLU A 95 -9.398 -10.449 10.586 1.00 13.31 O ATOM 1522 OE2 GLU A 95 -10.394 -8.709 11.432 1.00 51.43 O ATOM 0 H GLU A 95 -5.544 -7.309 9.947 1.00 34.23 H new ATOM 0 HA GLU A 95 -7.154 -9.694 10.240 1.00 60.21 H new ATOM 0 HB2 GLU A 95 -7.883 -7.279 10.492 1.00 22.42 H new ATOM 0 HB3 GLU A 95 -7.701 -7.125 8.756 1.00 22.42 H new ATOM 0 HG2 GLU A 95 -10.001 -7.580 9.218 1.00 20.21 H new ATOM 0 HG3 GLU A 95 -9.315 -8.999 8.452 1.00 20.21 H new ATOM 1529 N VAL A 96 -5.633 -8.820 7.489 1.00 71.25 N ATOM 1530 CA VAL A 96 -5.199 -9.215 6.168 1.00 51.14 C ATOM 1531 C VAL A 96 -4.013 -10.174 6.297 1.00 41.23 C ATOM 1532 O VAL A 96 -3.979 -11.239 5.682 1.00 32.11 O ATOM 1533 CB VAL A 96 -4.749 -7.968 5.349 1.00 1.02 C ATOM 1534 CG1 VAL A 96 -4.161 -8.365 4.019 1.00 70.23 C ATOM 1535 CG2 VAL A 96 -5.899 -7.029 5.116 1.00 1.14 C ATOM 0 H VAL A 96 -5.132 -8.011 7.857 1.00 71.25 H new ATOM 0 HA VAL A 96 -6.029 -9.701 5.654 1.00 51.14 H new ATOM 0 HB VAL A 96 -3.984 -7.463 5.939 1.00 1.02 H new ATOM 0 HG11 VAL A 96 -3.858 -7.471 3.474 1.00 70.23 H new ATOM 0 HG12 VAL A 96 -3.292 -9.003 4.181 1.00 70.23 H new ATOM 0 HG13 VAL A 96 -4.907 -8.908 3.439 1.00 70.23 H new ATOM 0 HG21 VAL A 96 -5.555 -6.168 4.542 1.00 1.14 H new ATOM 0 HG22 VAL A 96 -6.683 -7.545 4.562 1.00 1.14 H new ATOM 0 HG23 VAL A 96 -6.293 -6.692 6.075 1.00 1.14 H new ATOM 1545 N SER A 97 -3.065 -9.790 7.117 1.00 54.04 N ATOM 1546 CA SER A 97 -1.875 -10.545 7.326 1.00 3.04 C ATOM 1547 C SER A 97 -1.782 -10.960 8.797 1.00 73.52 C ATOM 1548 O SER A 97 -1.252 -10.234 9.630 1.00 33.31 O ATOM 1549 CB SER A 97 -0.653 -9.709 6.918 1.00 74.13 C ATOM 1550 OG SER A 97 0.545 -10.457 6.975 1.00 13.30 O ATOM 0 H SER A 97 -3.109 -8.929 7.662 1.00 54.04 H new ATOM 0 HA SER A 97 -1.899 -11.445 6.712 1.00 3.04 H new ATOM 0 HB2 SER A 97 -0.795 -9.329 5.906 1.00 74.13 H new ATOM 0 HB3 SER A 97 -0.571 -8.843 7.575 1.00 74.13 H new ATOM 0 HG SER A 97 1.110 -10.229 6.208 1.00 13.30 H new ATOM 1556 N SER A 98 -2.370 -12.079 9.105 1.00 4.01 N ATOM 1557 CA SER A 98 -2.383 -12.623 10.439 1.00 60.35 C ATOM 1558 C SER A 98 -1.142 -13.516 10.667 1.00 22.14 C ATOM 1559 O SER A 98 -0.748 -13.783 11.815 1.00 63.21 O ATOM 1560 CB SER A 98 -3.690 -13.425 10.619 1.00 2.34 C ATOM 1561 OG SER A 98 -3.850 -13.922 11.933 1.00 34.32 O ATOM 0 H SER A 98 -2.866 -12.654 8.424 1.00 4.01 H new ATOM 0 HA SER A 98 -2.344 -11.821 11.176 1.00 60.35 H new ATOM 0 HB2 SER A 98 -4.539 -12.788 10.370 1.00 2.34 H new ATOM 0 HB3 SER A 98 -3.700 -14.258 9.916 1.00 2.34 H new ATOM 0 HG SER A 98 -4.692 -14.420 11.994 1.00 34.32 H new ATOM 1567 N GLY A 99 -0.514 -13.946 9.576 1.00 24.32 N ATOM 1568 CA GLY A 99 0.640 -14.815 9.674 1.00 21.40 C ATOM 1569 C GLY A 99 1.900 -14.042 9.976 1.00 34.24 C ATOM 1570 O GLY A 99 2.482 -14.179 11.060 1.00 13.41 O ATOM 0 H GLY A 99 -0.787 -13.705 8.623 1.00 24.32 H new ATOM 0 HA2 GLY A 99 0.472 -15.556 10.456 1.00 21.40 H new ATOM 0 HA3 GLY A 99 0.764 -15.361 8.739 1.00 21.40 H new ATOM 1574 N SER A 100 2.324 -13.230 9.035 1.00 1.21 N ATOM 1575 CA SER A 100 3.490 -12.416 9.229 1.00 32.35 C ATOM 1576 C SER A 100 3.156 -11.203 10.095 1.00 5.23 C ATOM 1577 O SER A 100 3.854 -10.907 11.072 1.00 32.01 O ATOM 1578 CB SER A 100 4.114 -12.039 7.877 1.00 44.24 C ATOM 1579 OG SER A 100 3.142 -11.529 6.978 1.00 70.43 O ATOM 0 H SER A 100 1.874 -13.119 8.127 1.00 1.21 H new ATOM 0 HA SER A 100 4.245 -12.987 9.770 1.00 32.35 H new ATOM 0 HB2 SER A 100 4.895 -11.294 8.031 1.00 44.24 H new ATOM 0 HB3 SER A 100 4.592 -12.915 7.439 1.00 44.24 H new ATOM 0 HG SER A 100 2.314 -11.336 7.466 1.00 70.43 H new ATOM 1585 N GLY A 101 2.075 -10.530 9.759 1.00 33.12 N ATOM 1586 CA GLY A 101 1.620 -9.417 10.556 1.00 24.25 C ATOM 1587 C GLY A 101 2.374 -8.138 10.281 1.00 53.22 C ATOM 1588 O GLY A 101 3.537 -8.165 9.865 1.00 35.15 O ATOM 0 H GLY A 101 1.499 -10.735 8.942 1.00 33.12 H new ATOM 0 HA2 GLY A 101 0.559 -9.253 10.367 1.00 24.25 H new ATOM 0 HA3 GLY A 101 1.720 -9.670 11.612 1.00 24.25 H new ATOM 1592 N GLU A 102 1.692 -7.019 10.482 1.00 65.00 N ATOM 1593 CA GLU A 102 2.231 -5.649 10.306 1.00 15.20 C ATOM 1594 C GLU A 102 2.527 -5.261 8.861 1.00 24.25 C ATOM 1595 O GLU A 102 2.500 -4.090 8.525 1.00 55.40 O ATOM 1596 CB GLU A 102 3.409 -5.341 11.226 1.00 12.31 C ATOM 1597 CG GLU A 102 3.036 -5.379 12.688 1.00 20.54 C ATOM 1598 CD GLU A 102 4.130 -4.868 13.568 1.00 30.21 C ATOM 1599 OE1 GLU A 102 4.239 -3.641 13.716 1.00 44.35 O ATOM 1600 OE2 GLU A 102 4.894 -5.673 14.135 1.00 63.25 O ATOM 0 H GLU A 102 0.717 -7.024 10.782 1.00 65.00 H new ATOM 0 HA GLU A 102 1.405 -5.008 10.616 1.00 15.20 H new ATOM 0 HB2 GLU A 102 4.206 -6.061 11.041 1.00 12.31 H new ATOM 0 HB3 GLU A 102 3.806 -4.355 10.983 1.00 12.31 H new ATOM 0 HG2 GLU A 102 2.137 -4.783 12.847 1.00 20.54 H new ATOM 0 HG3 GLU A 102 2.793 -6.403 12.972 1.00 20.54 H new ATOM 1607 N THR A 103 2.795 -6.220 8.032 1.00 11.22 N ATOM 1608 CA THR A 103 3.023 -5.984 6.644 1.00 42.43 C ATOM 1609 C THR A 103 2.044 -6.861 5.851 1.00 65.41 C ATOM 1610 O THR A 103 1.939 -8.071 6.118 1.00 21.32 O ATOM 1611 CB THR A 103 4.446 -6.416 6.279 1.00 3.12 C ATOM 1612 OG1 THR A 103 5.374 -5.975 7.302 1.00 4.54 O ATOM 1613 CG2 THR A 103 4.846 -5.795 4.965 1.00 11.13 C ATOM 0 H THR A 103 2.862 -7.201 8.305 1.00 11.22 H new ATOM 0 HA THR A 103 2.886 -4.927 6.418 1.00 42.43 H new ATOM 0 HB THR A 103 4.472 -7.503 6.200 1.00 3.12 H new ATOM 0 HG1 THR A 103 5.481 -5.002 7.249 1.00 4.54 H new ATOM 0 HG21 THR A 103 5.859 -6.105 4.709 1.00 11.13 H new ATOM 0 HG22 THR A 103 4.159 -6.121 4.184 1.00 11.13 H new ATOM 0 HG23 THR A 103 4.810 -4.709 5.050 1.00 11.13 H new ATOM 1621 N PHE A 104 1.342 -6.289 4.896 1.00 63.04 N ATOM 1622 CA PHE A 104 0.406 -7.056 4.100 1.00 14.55 C ATOM 1623 C PHE A 104 0.828 -7.032 2.661 1.00 73.52 C ATOM 1624 O PHE A 104 1.632 -6.180 2.259 1.00 3.20 O ATOM 1625 CB PHE A 104 -1.039 -6.542 4.248 1.00 62.21 C ATOM 1626 CG PHE A 104 -1.306 -5.166 3.700 1.00 14.35 C ATOM 1627 CD1 PHE A 104 -0.956 -4.051 4.412 1.00 42.20 C ATOM 1628 CD2 PHE A 104 -1.939 -5.005 2.479 1.00 14.35 C ATOM 1629 CE1 PHE A 104 -1.227 -2.790 3.934 1.00 63.20 C ATOM 1630 CE2 PHE A 104 -2.205 -3.747 1.989 1.00 31.15 C ATOM 1631 CZ PHE A 104 -1.852 -2.638 2.717 1.00 42.32 C ATOM 0 H PHE A 104 1.401 -5.300 4.652 1.00 63.04 H new ATOM 0 HA PHE A 104 0.418 -8.082 4.466 1.00 14.55 H new ATOM 0 HB2 PHE A 104 -1.707 -7.246 3.752 1.00 62.21 H new ATOM 0 HB3 PHE A 104 -1.300 -6.547 5.306 1.00 62.21 H new ATOM 0 HD1 PHE A 104 -0.459 -4.163 5.364 1.00 42.20 H new ATOM 0 HD2 PHE A 104 -2.226 -5.874 1.906 1.00 14.35 H new ATOM 0 HE1 PHE A 104 -0.950 -1.921 4.512 1.00 63.20 H new ATOM 0 HE2 PHE A 104 -2.692 -3.632 1.032 1.00 31.15 H new ATOM 0 HZ PHE A 104 -2.064 -1.650 2.336 1.00 42.32 H new ATOM 1641 N SER A 105 0.299 -7.935 1.890 1.00 10.12 N ATOM 1642 CA SER A 105 0.638 -8.017 0.512 1.00 31.53 C ATOM 1643 C SER A 105 -0.612 -7.795 -0.345 1.00 53.44 C ATOM 1644 O SER A 105 -1.753 -7.948 0.137 1.00 41.35 O ATOM 1645 CB SER A 105 1.298 -9.376 0.227 1.00 62.22 C ATOM 1646 OG SER A 105 1.760 -9.481 -1.111 1.00 73.13 O ATOM 0 H SER A 105 -0.377 -8.631 2.203 1.00 10.12 H new ATOM 0 HA SER A 105 1.354 -7.237 0.255 1.00 31.53 H new ATOM 0 HB2 SER A 105 2.135 -9.521 0.910 1.00 62.22 H new ATOM 0 HB3 SER A 105 0.582 -10.174 0.425 1.00 62.22 H new ATOM 0 HG SER A 105 2.173 -10.359 -1.246 1.00 73.13 H new ATOM 1652 N TYR A 106 -0.382 -7.448 -1.594 1.00 62.30 N ATOM 1653 CA TYR A 106 -1.417 -7.142 -2.582 1.00 50.21 C ATOM 1654 C TYR A 106 -2.469 -8.293 -2.693 1.00 52.14 C ATOM 1655 O TYR A 106 -3.671 -8.038 -2.536 1.00 32.35 O ATOM 1656 CB TYR A 106 -0.726 -6.867 -3.935 1.00 40.20 C ATOM 1657 CG TYR A 106 -1.586 -6.285 -5.039 1.00 3.33 C ATOM 1658 CD1 TYR A 106 -2.317 -7.079 -5.891 1.00 1.35 C ATOM 1659 CD2 TYR A 106 -1.611 -4.933 -5.241 1.00 72.31 C ATOM 1660 CE1 TYR A 106 -3.057 -6.526 -6.921 1.00 32.41 C ATOM 1661 CE2 TYR A 106 -2.340 -4.359 -6.251 1.00 23.21 C ATOM 1662 CZ TYR A 106 -3.062 -5.166 -7.096 1.00 14.24 C ATOM 1663 OH TYR A 106 -3.792 -4.616 -8.105 1.00 43.41 O ATOM 0 H TYR A 106 0.562 -7.366 -1.971 1.00 62.30 H new ATOM 0 HA TYR A 106 -1.972 -6.258 -2.268 1.00 50.21 H new ATOM 0 HB2 TYR A 106 0.106 -6.186 -3.758 1.00 40.20 H new ATOM 0 HB3 TYR A 106 -0.300 -7.804 -4.295 1.00 40.20 H new ATOM 0 HD1 TYR A 106 -2.313 -8.150 -5.754 1.00 1.35 H new ATOM 0 HD2 TYR A 106 -1.038 -4.296 -4.584 1.00 72.31 H new ATOM 0 HE1 TYR A 106 -3.627 -7.161 -7.583 1.00 32.41 H new ATOM 0 HE2 TYR A 106 -2.346 -3.287 -6.380 1.00 23.21 H new ATOM 0 HH TYR A 106 -4.275 -5.323 -8.582 1.00 43.41 H new ATOM 1673 N PRO A 107 -2.049 -9.587 -2.937 1.00 60.51 N ATOM 1674 CA PRO A 107 -2.995 -10.710 -3.040 1.00 44.01 C ATOM 1675 C PRO A 107 -3.766 -10.962 -1.736 1.00 15.41 C ATOM 1676 O PRO A 107 -4.862 -11.519 -1.755 1.00 70.31 O ATOM 1677 CB PRO A 107 -2.096 -11.916 -3.367 1.00 60.53 C ATOM 1678 CG PRO A 107 -0.750 -11.519 -2.898 1.00 2.22 C ATOM 1679 CD PRO A 107 -0.655 -10.054 -3.155 1.00 24.34 C ATOM 0 HA PRO A 107 -3.763 -10.514 -3.789 1.00 44.01 H new ATOM 0 HB2 PRO A 107 -2.442 -12.817 -2.860 1.00 60.53 H new ATOM 0 HB3 PRO A 107 -2.096 -12.131 -4.435 1.00 60.53 H new ATOM 0 HG2 PRO A 107 -0.622 -11.741 -1.838 1.00 2.22 H new ATOM 0 HG3 PRO A 107 0.028 -12.063 -3.433 1.00 2.22 H new ATOM 0 HD2 PRO A 107 0.045 -9.569 -2.474 1.00 24.34 H new ATOM 0 HD3 PRO A 107 -0.312 -9.843 -4.168 1.00 24.34 H new ATOM 1687 N ASP A 108 -3.202 -10.539 -0.614 1.00 71.52 N ATOM 1688 CA ASP A 108 -3.848 -10.748 0.681 1.00 55.03 C ATOM 1689 C ASP A 108 -4.913 -9.718 0.912 1.00 62.33 C ATOM 1690 O ASP A 108 -5.959 -10.017 1.486 1.00 22.13 O ATOM 1691 CB ASP A 108 -2.854 -10.750 1.845 1.00 22.11 C ATOM 1692 CG ASP A 108 -1.839 -11.849 1.753 1.00 13.25 C ATOM 1693 OD1 ASP A 108 -2.202 -13.030 1.913 1.00 60.33 O ATOM 1694 OD2 ASP A 108 -0.655 -11.548 1.538 1.00 44.42 O ATOM 0 H ASP A 108 -2.306 -10.053 -0.570 1.00 71.52 H new ATOM 0 HA ASP A 108 -4.303 -11.738 0.647 1.00 55.03 H new ATOM 0 HB2 ASP A 108 -2.339 -9.790 1.876 1.00 22.11 H new ATOM 0 HB3 ASP A 108 -3.402 -10.848 2.782 1.00 22.11 H new ATOM 1699 N PHE A 109 -4.665 -8.500 0.460 1.00 21.42 N ATOM 1700 CA PHE A 109 -5.646 -7.437 0.595 1.00 74.02 C ATOM 1701 C PHE A 109 -6.855 -7.797 -0.265 1.00 31.12 C ATOM 1702 O PHE A 109 -8.004 -7.659 0.159 1.00 41.11 O ATOM 1703 CB PHE A 109 -5.053 -6.090 0.155 1.00 2.21 C ATOM 1704 CG PHE A 109 -5.898 -4.873 0.500 1.00 62.11 C ATOM 1705 CD1 PHE A 109 -7.106 -4.633 -0.125 1.00 72.23 C ATOM 1706 CD2 PHE A 109 -5.460 -3.964 1.442 1.00 73.23 C ATOM 1707 CE1 PHE A 109 -7.855 -3.518 0.182 1.00 42.40 C ATOM 1708 CE2 PHE A 109 -6.205 -2.848 1.751 1.00 21.40 C ATOM 1709 CZ PHE A 109 -7.403 -2.626 1.122 1.00 55.53 C ATOM 0 H PHE A 109 -3.798 -8.224 -0.001 1.00 21.42 H new ATOM 0 HA PHE A 109 -5.944 -7.337 1.639 1.00 74.02 H new ATOM 0 HB2 PHE A 109 -4.072 -5.974 0.615 1.00 2.21 H new ATOM 0 HB3 PHE A 109 -4.899 -6.113 -0.924 1.00 2.21 H new ATOM 0 HD1 PHE A 109 -7.469 -5.330 -0.866 1.00 72.23 H new ATOM 0 HD2 PHE A 109 -4.519 -4.131 1.944 1.00 73.23 H new ATOM 0 HE1 PHE A 109 -8.797 -3.346 -0.317 1.00 42.40 H new ATOM 0 HE2 PHE A 109 -5.845 -2.147 2.490 1.00 21.40 H new ATOM 0 HZ PHE A 109 -7.989 -1.752 1.365 1.00 55.53 H new ATOM 1719 N LEU A 110 -6.577 -8.292 -1.467 1.00 2.04 N ATOM 1720 CA LEU A 110 -7.600 -8.737 -2.376 1.00 44.14 C ATOM 1721 C LEU A 110 -8.368 -9.897 -1.794 1.00 64.44 C ATOM 1722 O LEU A 110 -9.565 -9.936 -1.882 1.00 61.14 O ATOM 1723 CB LEU A 110 -6.989 -9.087 -3.726 1.00 0.03 C ATOM 1724 CG LEU A 110 -6.417 -7.902 -4.491 1.00 15.15 C ATOM 1725 CD1 LEU A 110 -5.726 -8.352 -5.765 1.00 65.20 C ATOM 1726 CD2 LEU A 110 -7.532 -6.918 -4.809 1.00 60.24 C ATOM 0 H LEU A 110 -5.629 -8.392 -1.829 1.00 2.04 H new ATOM 0 HA LEU A 110 -8.310 -7.925 -2.530 1.00 44.14 H new ATOM 0 HB2 LEU A 110 -6.197 -9.820 -3.572 1.00 0.03 H new ATOM 0 HB3 LEU A 110 -7.751 -9.566 -4.341 1.00 0.03 H new ATOM 0 HG LEU A 110 -5.670 -7.413 -3.867 1.00 15.15 H new ATOM 0 HD11 LEU A 110 -5.328 -7.483 -6.289 1.00 65.20 H new ATOM 0 HD12 LEU A 110 -4.910 -9.031 -5.516 1.00 65.20 H new ATOM 0 HD13 LEU A 110 -6.443 -8.865 -6.406 1.00 65.20 H new ATOM 0 HD21 LEU A 110 -7.123 -6.069 -5.357 1.00 60.24 H new ATOM 0 HD22 LEU A 110 -8.290 -7.411 -5.417 1.00 60.24 H new ATOM 0 HD23 LEU A 110 -7.983 -6.567 -3.881 1.00 60.24 H new ATOM 1738 N ARG A 111 -7.660 -10.813 -1.168 1.00 12.23 N ATOM 1739 CA ARG A 111 -8.265 -11.965 -0.493 1.00 54.14 C ATOM 1740 C ARG A 111 -9.291 -11.453 0.542 1.00 52.11 C ATOM 1741 O ARG A 111 -10.365 -12.017 0.706 1.00 12.40 O ATOM 1742 CB ARG A 111 -7.118 -12.775 0.186 1.00 55.23 C ATOM 1743 CG ARG A 111 -7.458 -14.134 0.830 1.00 23.22 C ATOM 1744 CD ARG A 111 -8.344 -14.035 2.063 1.00 31.35 C ATOM 1745 NE ARG A 111 -8.551 -15.343 2.679 1.00 63.44 N ATOM 1746 CZ ARG A 111 -9.433 -15.616 3.634 1.00 31.45 C ATOM 1747 NH1 ARG A 111 -10.268 -14.677 4.072 1.00 12.44 N ATOM 1748 NH2 ARG A 111 -9.480 -16.837 4.153 1.00 23.42 N ATOM 0 H ARG A 111 -6.642 -10.788 -1.107 1.00 12.23 H new ATOM 0 HA ARG A 111 -8.790 -12.614 -1.193 1.00 54.14 H new ATOM 0 HB2 ARG A 111 -6.345 -12.947 -0.563 1.00 55.23 H new ATOM 0 HB3 ARG A 111 -6.678 -12.143 0.958 1.00 55.23 H new ATOM 0 HG2 ARG A 111 -7.954 -14.761 0.089 1.00 23.22 H new ATOM 0 HG3 ARG A 111 -6.530 -14.637 1.102 1.00 23.22 H new ATOM 0 HD2 ARG A 111 -7.888 -13.359 2.786 1.00 31.35 H new ATOM 0 HD3 ARG A 111 -9.307 -13.605 1.787 1.00 31.35 H new ATOM 0 HE ARG A 111 -7.969 -16.112 2.348 1.00 63.44 H new ATOM 0 HH11 ARG A 111 -10.234 -13.738 3.674 1.00 12.44 H new ATOM 0 HH12 ARG A 111 -10.942 -14.896 4.806 1.00 12.44 H new ATOM 0 HH21 ARG A 111 -8.841 -17.558 3.818 1.00 23.42 H new ATOM 0 HH22 ARG A 111 -10.155 -17.054 4.887 1.00 23.42 H new ATOM 1762 N MET A 112 -8.938 -10.376 1.199 1.00 5.13 N ATOM 1763 CA MET A 112 -9.767 -9.757 2.217 1.00 24.32 C ATOM 1764 C MET A 112 -10.985 -9.009 1.616 1.00 31.23 C ATOM 1765 O MET A 112 -12.140 -9.299 1.966 1.00 72.01 O ATOM 1766 CB MET A 112 -8.866 -8.842 3.096 1.00 1.31 C ATOM 1767 CG MET A 112 -9.551 -8.032 4.200 1.00 22.01 C ATOM 1768 SD MET A 112 -10.510 -6.599 3.617 1.00 21.03 S ATOM 1769 CE MET A 112 -9.229 -5.610 2.850 1.00 53.40 C ATOM 0 H MET A 112 -8.053 -9.893 1.043 1.00 5.13 H new ATOM 0 HA MET A 112 -10.205 -10.531 2.847 1.00 24.32 H new ATOM 0 HB2 MET A 112 -8.103 -9.466 3.560 1.00 1.31 H new ATOM 0 HB3 MET A 112 -8.350 -8.144 2.437 1.00 1.31 H new ATOM 0 HG2 MET A 112 -10.215 -8.693 4.757 1.00 22.01 H new ATOM 0 HG3 MET A 112 -8.791 -7.682 4.899 1.00 22.01 H new ATOM 0 HE1 MET A 112 -9.560 -4.574 2.783 1.00 53.40 H new ATOM 0 HE2 MET A 112 -8.320 -5.663 3.450 1.00 53.40 H new ATOM 0 HE3 MET A 112 -9.025 -5.991 1.849 1.00 53.40 H new ATOM 1779 N MET A 113 -10.733 -8.092 0.684 1.00 72.43 N ATOM 1780 CA MET A 113 -11.812 -7.243 0.127 1.00 72.43 C ATOM 1781 C MET A 113 -12.670 -7.961 -0.922 1.00 35.25 C ATOM 1782 O MET A 113 -13.749 -7.491 -1.273 1.00 21.24 O ATOM 1783 CB MET A 113 -11.277 -5.914 -0.445 1.00 45.34 C ATOM 1784 CG MET A 113 -10.293 -6.076 -1.590 1.00 33.00 C ATOM 1785 SD MET A 113 -9.797 -4.516 -2.354 1.00 35.41 S ATOM 1786 CE MET A 113 -11.367 -3.897 -2.949 1.00 53.42 C ATOM 0 H MET A 113 -9.808 -7.911 0.295 1.00 72.43 H new ATOM 0 HA MET A 113 -12.457 -7.018 0.976 1.00 72.43 H new ATOM 0 HB2 MET A 113 -12.120 -5.315 -0.788 1.00 45.34 H new ATOM 0 HB3 MET A 113 -10.794 -5.355 0.357 1.00 45.34 H new ATOM 0 HG2 MET A 113 -9.404 -6.588 -1.222 1.00 33.00 H new ATOM 0 HG3 MET A 113 -10.738 -6.717 -2.351 1.00 33.00 H new ATOM 0 HE1 MET A 113 -11.219 -3.382 -3.898 1.00 53.42 H new ATOM 0 HE2 MET A 113 -12.056 -4.730 -3.092 1.00 53.42 H new ATOM 0 HE3 MET A 113 -11.784 -3.202 -2.220 1.00 53.42 H new ATOM 1796 N LEU A 114 -12.188 -9.067 -1.430 1.00 1.54 N ATOM 1797 CA LEU A 114 -12.927 -9.872 -2.422 1.00 5.44 C ATOM 1798 C LEU A 114 -13.666 -11.018 -1.758 1.00 32.22 C ATOM 1799 O LEU A 114 -14.105 -11.964 -2.417 1.00 3.23 O ATOM 1800 CB LEU A 114 -11.979 -10.425 -3.508 1.00 4.12 C ATOM 1801 CG LEU A 114 -11.561 -9.495 -4.670 1.00 64.32 C ATOM 1802 CD1 LEU A 114 -11.051 -8.163 -4.191 1.00 72.14 C ATOM 1803 CD2 LEU A 114 -10.488 -10.165 -5.506 1.00 3.22 C ATOM 0 H LEU A 114 -11.276 -9.450 -1.181 1.00 1.54 H new ATOM 0 HA LEU A 114 -13.655 -9.212 -2.894 1.00 5.44 H new ATOM 0 HB2 LEU A 114 -11.070 -10.764 -3.012 1.00 4.12 H new ATOM 0 HB3 LEU A 114 -12.452 -11.306 -3.943 1.00 4.12 H new ATOM 0 HG LEU A 114 -12.455 -9.313 -5.267 1.00 64.32 H new ATOM 0 HD11 LEU A 114 -10.772 -7.551 -5.048 1.00 72.14 H new ATOM 0 HD12 LEU A 114 -11.832 -7.657 -3.623 1.00 72.14 H new ATOM 0 HD13 LEU A 114 -10.179 -8.315 -3.554 1.00 72.14 H new ATOM 0 HD21 LEU A 114 -10.198 -9.504 -6.323 1.00 3.22 H new ATOM 0 HD22 LEU A 114 -9.619 -10.374 -4.883 1.00 3.22 H new ATOM 0 HD23 LEU A 114 -10.875 -11.099 -5.914 1.00 3.22 H new ATOM 1815 N GLY A 115 -13.825 -10.938 -0.471 1.00 24.43 N ATOM 1816 CA GLY A 115 -14.492 -12.009 0.207 1.00 24.01 C ATOM 1817 C GLY A 115 -15.253 -11.609 1.447 1.00 3.15 C ATOM 1818 O GLY A 115 -16.236 -10.862 1.379 1.00 1.04 O ATOM 0 H GLY A 115 -13.512 -10.166 0.117 1.00 24.43 H new ATOM 0 HA2 GLY A 115 -15.185 -12.482 -0.488 1.00 24.01 H new ATOM 0 HA3 GLY A 115 -13.752 -12.761 0.481 1.00 24.01 H new ATOM 1822 N LYS A 116 -14.764 -12.076 2.575 1.00 40.11 N ATOM 1823 CA LYS A 116 -15.445 -11.993 3.876 1.00 1.24 C ATOM 1824 C LYS A 116 -15.289 -10.637 4.575 1.00 12.41 C ATOM 1825 O LYS A 116 -15.720 -10.480 5.727 1.00 60.11 O ATOM 1826 CB LYS A 116 -14.898 -13.096 4.778 1.00 61.32 C ATOM 1827 CG LYS A 116 -15.071 -14.495 4.212 1.00 63.10 C ATOM 1828 CD LYS A 116 -14.431 -15.527 5.110 1.00 13.14 C ATOM 1829 CE LYS A 116 -14.549 -16.923 4.529 1.00 54.33 C ATOM 1830 NZ LYS A 116 -13.890 -17.928 5.385 1.00 45.34 N ATOM 0 H LYS A 116 -13.857 -12.539 2.628 1.00 40.11 H new ATOM 0 HA LYS A 116 -16.512 -12.114 3.688 1.00 1.24 H new ATOM 0 HB2 LYS A 116 -13.838 -12.915 4.955 1.00 61.32 H new ATOM 0 HB3 LYS A 116 -15.397 -13.042 5.746 1.00 61.32 H new ATOM 0 HG2 LYS A 116 -16.132 -14.716 4.098 1.00 63.10 H new ATOM 0 HG3 LYS A 116 -14.626 -14.546 3.218 1.00 63.10 H new ATOM 0 HD2 LYS A 116 -13.379 -15.281 5.256 1.00 13.14 H new ATOM 0 HD3 LYS A 116 -14.904 -15.500 6.092 1.00 13.14 H new ATOM 0 HE2 LYS A 116 -15.602 -17.180 4.410 1.00 54.33 H new ATOM 0 HE3 LYS A 116 -14.102 -16.942 3.535 1.00 54.33 H new ATOM 0 HZ1 LYS A 116 -13.991 -18.870 4.956 1.00 45.34 H new ATOM 0 HZ2 LYS A 116 -12.880 -17.697 5.478 1.00 45.34 H new ATOM 0 HZ3 LYS A 116 -14.333 -17.927 6.326 1.00 45.34 H new ATOM 1844 N ARG A 117 -14.701 -9.674 3.884 1.00 53.23 N ATOM 1845 CA ARG A 117 -14.452 -8.324 4.419 1.00 23.24 C ATOM 1846 C ARG A 117 -13.514 -8.370 5.622 1.00 34.41 C ATOM 1847 O ARG A 117 -12.310 -8.419 5.455 1.00 71.31 O ATOM 1848 CB ARG A 117 -15.746 -7.495 4.752 1.00 54.22 C ATOM 1849 CG ARG A 117 -16.659 -7.147 3.564 1.00 12.43 C ATOM 1850 CD ARG A 117 -17.389 -8.353 2.997 1.00 10.31 C ATOM 1851 NE ARG A 117 -18.350 -8.922 3.951 1.00 41.23 N ATOM 1852 CZ ARG A 117 -18.994 -10.088 3.792 1.00 10.42 C ATOM 1853 NH1 ARG A 117 -18.709 -10.881 2.755 1.00 31.33 N ATOM 1854 NH2 ARG A 117 -19.907 -10.463 4.682 1.00 42.14 N ATOM 0 H ARG A 117 -14.376 -9.798 2.925 1.00 53.23 H new ATOM 0 HA ARG A 117 -13.969 -7.787 3.603 1.00 23.24 H new ATOM 0 HB2 ARG A 117 -16.332 -8.054 5.481 1.00 54.22 H new ATOM 0 HB3 ARG A 117 -15.442 -6.565 5.233 1.00 54.22 H new ATOM 0 HG2 ARG A 117 -17.390 -6.404 3.882 1.00 12.43 H new ATOM 0 HG3 ARG A 117 -16.061 -6.689 2.776 1.00 12.43 H new ATOM 0 HD2 ARG A 117 -17.913 -8.063 2.086 1.00 10.31 H new ATOM 0 HD3 ARG A 117 -16.663 -9.116 2.717 1.00 10.31 H new ATOM 0 HE ARG A 117 -18.542 -8.390 4.800 1.00 41.23 H new ATOM 0 HH11 ARG A 117 -17.998 -10.601 2.079 1.00 31.33 H new ATOM 0 HH12 ARG A 117 -19.202 -11.766 2.639 1.00 31.33 H new ATOM 0 HH21 ARG A 117 -20.115 -9.865 5.482 1.00 42.14 H new ATOM 0 HH22 ARG A 117 -20.399 -11.349 4.565 1.00 42.14 H new ATOM 1868 N SER A 118 -14.086 -8.413 6.827 1.00 70.25 N ATOM 1869 CA SER A 118 -13.343 -8.479 8.089 1.00 61.52 C ATOM 1870 C SER A 118 -12.536 -7.183 8.399 1.00 33.30 C ATOM 1871 O SER A 118 -12.742 -6.557 9.438 1.00 21.33 O ATOM 1872 CB SER A 118 -12.462 -9.739 8.122 1.00 24.20 C ATOM 1873 OG SER A 118 -13.262 -10.903 7.898 1.00 65.34 O ATOM 0 H SER A 118 -15.098 -8.403 6.956 1.00 70.25 H new ATOM 0 HA SER A 118 -14.076 -8.551 8.893 1.00 61.52 H new ATOM 0 HB2 SER A 118 -11.686 -9.670 7.360 1.00 24.20 H new ATOM 0 HB3 SER A 118 -11.958 -9.815 9.085 1.00 24.20 H new ATOM 0 HG SER A 118 -12.693 -11.700 7.919 1.00 65.34 H new ATOM 1879 N ALA A 119 -11.655 -6.777 7.497 1.00 34.44 N ATOM 1880 CA ALA A 119 -10.827 -5.599 7.707 1.00 42.23 C ATOM 1881 C ALA A 119 -11.580 -4.345 7.347 1.00 3.14 C ATOM 1882 O ALA A 119 -12.292 -4.295 6.336 1.00 11.34 O ATOM 1883 CB ALA A 119 -9.530 -5.686 6.902 1.00 11.31 C ATOM 0 H ALA A 119 -11.495 -7.249 6.607 1.00 34.44 H new ATOM 0 HA ALA A 119 -10.570 -5.559 8.766 1.00 42.23 H new ATOM 0 HB1 ALA A 119 -8.932 -4.792 7.079 1.00 11.31 H new ATOM 0 HB2 ALA A 119 -8.968 -6.567 7.212 1.00 11.31 H new ATOM 0 HB3 ALA A 119 -9.765 -5.761 5.840 1.00 11.31 H new ATOM 1889 N ILE A 120 -11.411 -3.323 8.171 1.00 30.42 N ATOM 1890 CA ILE A 120 -12.042 -2.015 7.966 1.00 64.10 C ATOM 1891 C ILE A 120 -11.519 -1.379 6.661 1.00 44.20 C ATOM 1892 O ILE A 120 -12.138 -0.496 6.085 1.00 12.25 O ATOM 1893 CB ILE A 120 -11.777 -1.086 9.198 1.00 1.33 C ATOM 1894 CG1 ILE A 120 -12.303 -1.768 10.474 1.00 62.34 C ATOM 1895 CG2 ILE A 120 -12.455 0.276 9.016 1.00 14.23 C ATOM 1896 CD1 ILE A 120 -12.031 -1.014 11.760 1.00 40.51 C ATOM 0 H ILE A 120 -10.830 -3.371 9.008 1.00 30.42 H new ATOM 0 HA ILE A 120 -13.120 -2.146 7.873 1.00 64.10 H new ATOM 0 HB ILE A 120 -10.703 -0.920 9.285 1.00 1.33 H new ATOM 0 HG12 ILE A 120 -13.379 -1.911 10.375 1.00 62.34 H new ATOM 0 HG13 ILE A 120 -11.855 -2.759 10.550 1.00 62.34 H new ATOM 0 HG21 ILE A 120 -12.255 0.901 9.886 1.00 14.23 H new ATOM 0 HG22 ILE A 120 -12.063 0.761 8.122 1.00 14.23 H new ATOM 0 HG23 ILE A 120 -13.531 0.136 8.910 1.00 14.23 H new ATOM 0 HD11 ILE A 120 -12.439 -1.573 12.603 1.00 40.51 H new ATOM 0 HD12 ILE A 120 -10.956 -0.894 11.891 1.00 40.51 H new ATOM 0 HD13 ILE A 120 -12.503 -0.033 11.713 1.00 40.51 H new ATOM 1908 N LEU A 121 -10.394 -1.890 6.196 1.00 13.33 N ATOM 1909 CA LEU A 121 -9.769 -1.487 4.935 1.00 61.30 C ATOM 1910 C LEU A 121 -10.704 -1.647 3.769 1.00 21.22 C ATOM 1911 O LEU A 121 -10.651 -0.876 2.856 1.00 32.04 O ATOM 1912 CB LEU A 121 -8.453 -2.261 4.688 1.00 35.34 C ATOM 1913 CG LEU A 121 -7.199 -1.745 5.413 1.00 44.14 C ATOM 1914 CD1 LEU A 121 -7.495 -1.476 6.847 1.00 13.24 C ATOM 1915 CD2 LEU A 121 -6.069 -2.759 5.309 1.00 35.22 C ATOM 0 H LEU A 121 -9.872 -2.614 6.690 1.00 13.33 H new ATOM 0 HA LEU A 121 -9.531 -0.427 5.024 1.00 61.30 H new ATOM 0 HB2 LEU A 121 -8.610 -3.300 4.978 1.00 35.34 H new ATOM 0 HB3 LEU A 121 -8.252 -2.257 3.617 1.00 35.34 H new ATOM 0 HG LEU A 121 -6.891 -0.816 4.934 1.00 44.14 H new ATOM 0 HD11 LEU A 121 -6.595 -1.112 7.342 1.00 13.24 H new ATOM 0 HD12 LEU A 121 -8.280 -0.723 6.922 1.00 13.24 H new ATOM 0 HD13 LEU A 121 -7.827 -2.396 7.329 1.00 13.24 H new ATOM 0 HD21 LEU A 121 -5.189 -2.378 5.827 1.00 35.22 H new ATOM 0 HD22 LEU A 121 -6.380 -3.699 5.765 1.00 35.22 H new ATOM 0 HD23 LEU A 121 -5.827 -2.928 4.260 1.00 35.22 H new ATOM 1927 N LYS A 122 -11.587 -2.628 3.829 1.00 71.10 N ATOM 1928 CA LYS A 122 -12.561 -2.837 2.765 1.00 11.40 C ATOM 1929 C LYS A 122 -13.506 -1.623 2.714 1.00 52.04 C ATOM 1930 O LYS A 122 -13.880 -1.152 1.641 1.00 11.20 O ATOM 1931 CB LYS A 122 -13.319 -4.178 3.016 1.00 32.12 C ATOM 1932 CG LYS A 122 -14.302 -4.662 1.919 1.00 71.45 C ATOM 1933 CD LYS A 122 -15.584 -3.832 1.823 1.00 51.15 C ATOM 1934 CE LYS A 122 -16.531 -4.400 0.775 1.00 4.53 C ATOM 1935 NZ LYS A 122 -17.762 -3.592 0.634 1.00 10.21 N ATOM 0 H LYS A 122 -11.652 -3.293 4.600 1.00 71.10 H new ATOM 0 HA LYS A 122 -12.073 -2.919 1.794 1.00 11.40 H new ATOM 0 HB2 LYS A 122 -12.576 -4.960 3.170 1.00 32.12 H new ATOM 0 HB3 LYS A 122 -13.877 -4.080 3.947 1.00 32.12 H new ATOM 0 HG2 LYS A 122 -13.794 -4.640 0.955 1.00 71.45 H new ATOM 0 HG3 LYS A 122 -14.568 -5.701 2.116 1.00 71.45 H new ATOM 0 HD2 LYS A 122 -16.081 -3.812 2.793 1.00 51.15 H new ATOM 0 HD3 LYS A 122 -15.335 -2.801 1.571 1.00 51.15 H new ATOM 0 HE2 LYS A 122 -16.019 -4.449 -0.186 1.00 4.53 H new ATOM 0 HE3 LYS A 122 -16.798 -5.421 1.046 1.00 4.53 H new ATOM 0 HZ1 LYS A 122 -18.375 -4.017 -0.090 1.00 10.21 H new ATOM 0 HZ2 LYS A 122 -18.266 -3.566 1.543 1.00 10.21 H new ATOM 0 HZ3 LYS A 122 -17.511 -2.624 0.350 1.00 10.21 H new ATOM 1949 N MET A 123 -13.822 -1.092 3.890 1.00 23.32 N ATOM 1950 CA MET A 123 -14.722 0.049 4.016 1.00 43.02 C ATOM 1951 C MET A 123 -13.998 1.321 3.586 1.00 73.21 C ATOM 1952 O MET A 123 -14.574 2.187 2.937 1.00 32.22 O ATOM 1953 CB MET A 123 -15.186 0.231 5.481 1.00 31.31 C ATOM 1954 CG MET A 123 -15.808 -0.996 6.133 1.00 73.30 C ATOM 1955 SD MET A 123 -17.220 -1.643 5.222 1.00 62.11 S ATOM 1956 CE MET A 123 -17.688 -3.020 6.273 1.00 63.52 C ATOM 0 H MET A 123 -13.463 -1.439 4.780 1.00 23.32 H new ATOM 0 HA MET A 123 -15.589 -0.136 3.382 1.00 43.02 H new ATOM 0 HB2 MET A 123 -14.329 0.542 6.078 1.00 31.31 H new ATOM 0 HB3 MET A 123 -15.911 1.045 5.515 1.00 31.31 H new ATOM 0 HG2 MET A 123 -15.052 -1.776 6.220 1.00 73.30 H new ATOM 0 HG3 MET A 123 -16.122 -0.742 7.145 1.00 73.30 H new ATOM 0 HE1 MET A 123 -18.552 -3.527 5.845 1.00 63.52 H new ATOM 0 HE2 MET A 123 -16.856 -3.720 6.347 1.00 63.52 H new ATOM 0 HE3 MET A 123 -17.940 -2.650 7.267 1.00 63.52 H new ATOM 1966 N ILE A 124 -12.731 1.414 3.965 1.00 30.52 N ATOM 1967 CA ILE A 124 -11.901 2.586 3.676 1.00 62.43 C ATOM 1968 C ILE A 124 -11.535 2.633 2.190 1.00 35.32 C ATOM 1969 O ILE A 124 -11.739 3.652 1.517 1.00 14.13 O ATOM 1970 CB ILE A 124 -10.576 2.559 4.509 1.00 21.35 C ATOM 1971 CG1 ILE A 124 -10.857 2.433 6.021 1.00 64.34 C ATOM 1972 CG2 ILE A 124 -9.716 3.793 4.224 1.00 44.32 C ATOM 1973 CD1 ILE A 124 -11.700 3.546 6.610 1.00 62.23 C ATOM 0 H ILE A 124 -12.245 0.681 4.482 1.00 30.52 H new ATOM 0 HA ILE A 124 -12.483 3.467 3.946 1.00 62.43 H new ATOM 0 HB ILE A 124 -10.020 1.675 4.197 1.00 21.35 H new ATOM 0 HG12 ILE A 124 -11.358 1.482 6.204 1.00 64.34 H new ATOM 0 HG13 ILE A 124 -9.905 2.399 6.551 1.00 64.34 H new ATOM 0 HG21 ILE A 124 -8.803 3.745 4.817 1.00 44.32 H new ATOM 0 HG22 ILE A 124 -9.459 3.821 3.165 1.00 44.32 H new ATOM 0 HG23 ILE A 124 -10.272 4.693 4.486 1.00 44.32 H new ATOM 0 HD11 ILE A 124 -11.843 3.369 7.676 1.00 62.23 H new ATOM 0 HD12 ILE A 124 -11.195 4.501 6.465 1.00 62.23 H new ATOM 0 HD13 ILE A 124 -12.670 3.570 6.113 1.00 62.23 H new ATOM 1985 N LEU A 125 -11.007 1.521 1.697 1.00 71.34 N ATOM 1986 CA LEU A 125 -10.549 1.392 0.309 1.00 71.44 C ATOM 1987 C LEU A 125 -11.708 1.620 -0.668 1.00 12.41 C ATOM 1988 O LEU A 125 -11.581 2.397 -1.623 1.00 51.04 O ATOM 1989 CB LEU A 125 -9.899 -0.017 0.118 1.00 22.13 C ATOM 1990 CG LEU A 125 -9.116 -0.350 -1.186 1.00 34.44 C ATOM 1991 CD1 LEU A 125 -9.990 -0.374 -2.432 1.00 64.30 C ATOM 1992 CD2 LEU A 125 -7.935 0.592 -1.355 1.00 74.32 C ATOM 0 H LEU A 125 -10.881 0.673 2.249 1.00 71.34 H new ATOM 0 HA LEU A 125 -9.800 2.155 0.095 1.00 71.44 H new ATOM 0 HB2 LEU A 125 -9.216 -0.174 0.953 1.00 22.13 H new ATOM 0 HB3 LEU A 125 -10.695 -0.755 0.214 1.00 22.13 H new ATOM 0 HG LEU A 125 -8.743 -1.368 -1.071 1.00 34.44 H new ATOM 0 HD11 LEU A 125 -9.377 -0.612 -3.302 1.00 64.30 H new ATOM 0 HD12 LEU A 125 -10.767 -1.130 -2.317 1.00 64.30 H new ATOM 0 HD13 LEU A 125 -10.452 0.603 -2.571 1.00 64.30 H new ATOM 0 HD21 LEU A 125 -7.400 0.344 -2.272 1.00 74.32 H new ATOM 0 HD22 LEU A 125 -8.294 1.620 -1.411 1.00 74.32 H new ATOM 0 HD23 LEU A 125 -7.263 0.489 -0.503 1.00 74.32 H new ATOM 2004 N MET A 126 -12.844 0.974 -0.418 1.00 24.11 N ATOM 2005 CA MET A 126 -13.980 1.085 -1.333 1.00 72.51 C ATOM 2006 C MET A 126 -14.790 2.352 -1.128 1.00 53.53 C ATOM 2007 O MET A 126 -15.731 2.615 -1.888 1.00 62.11 O ATOM 2008 CB MET A 126 -14.874 -0.158 -1.321 1.00 31.52 C ATOM 2009 CG MET A 126 -14.188 -1.411 -1.848 1.00 15.21 C ATOM 2010 SD MET A 126 -15.282 -2.852 -1.925 1.00 13.14 S ATOM 2011 CE MET A 126 -16.549 -2.262 -3.057 1.00 10.20 C ATOM 0 H MET A 126 -13.003 0.378 0.395 1.00 24.11 H new ATOM 0 HA MET A 126 -13.539 1.153 -2.327 1.00 72.51 H new ATOM 0 HB2 MET A 126 -15.212 -0.341 -0.301 1.00 31.52 H new ATOM 0 HB3 MET A 126 -15.762 0.039 -1.921 1.00 31.52 H new ATOM 0 HG2 MET A 126 -13.795 -1.209 -2.844 1.00 15.21 H new ATOM 0 HG3 MET A 126 -13.336 -1.645 -1.210 1.00 15.21 H new ATOM 0 HE1 MET A 126 -17.059 -3.113 -3.508 1.00 10.20 H new ATOM 0 HE2 MET A 126 -17.271 -1.654 -2.511 1.00 10.20 H new ATOM 0 HE3 MET A 126 -16.086 -1.660 -3.839 1.00 10.20 H new ATOM 2021 N TYR A 127 -14.432 3.140 -0.114 1.00 13.22 N ATOM 2022 CA TYR A 127 -15.066 4.435 0.106 1.00 50.22 C ATOM 2023 C TYR A 127 -14.639 5.382 -0.999 1.00 65.30 C ATOM 2024 O TYR A 127 -15.397 6.265 -1.415 1.00 63.33 O ATOM 2025 CB TYR A 127 -14.697 5.008 1.490 1.00 71.51 C ATOM 2026 CG TYR A 127 -15.242 6.402 1.763 1.00 25.03 C ATOM 2027 CD1 TYR A 127 -16.549 6.596 2.190 1.00 14.32 C ATOM 2028 CD2 TYR A 127 -14.439 7.524 1.589 1.00 3.11 C ATOM 2029 CE1 TYR A 127 -17.035 7.869 2.432 1.00 71.00 C ATOM 2030 CE2 TYR A 127 -14.915 8.789 1.828 1.00 33.00 C ATOM 2031 CZ TYR A 127 -16.210 8.961 2.250 1.00 11.13 C ATOM 2032 OH TYR A 127 -16.686 10.236 2.486 1.00 31.50 O ATOM 0 H TYR A 127 -13.708 2.903 0.565 1.00 13.22 H new ATOM 0 HA TYR A 127 -16.149 4.313 0.086 1.00 50.22 H new ATOM 0 HB2 TYR A 127 -15.066 4.330 2.260 1.00 71.51 H new ATOM 0 HB3 TYR A 127 -13.611 5.032 1.581 1.00 71.51 H new ATOM 0 HD1 TYR A 127 -17.195 5.742 2.335 1.00 14.32 H new ATOM 0 HD2 TYR A 127 -13.419 7.397 1.259 1.00 3.11 H new ATOM 0 HE1 TYR A 127 -18.054 8.007 2.761 1.00 71.00 H new ATOM 0 HE2 TYR A 127 -14.273 9.646 1.685 1.00 33.00 H new ATOM 0 HH TYR A 127 -15.976 10.888 2.311 1.00 31.50 H new ATOM 2042 N GLU A 128 -13.426 5.186 -1.478 1.00 72.20 N ATOM 2043 CA GLU A 128 -12.914 5.955 -2.579 1.00 65.32 C ATOM 2044 C GLU A 128 -13.523 5.378 -3.843 1.00 33.43 C ATOM 2045 O GLU A 128 -12.999 4.401 -4.405 1.00 61.43 O ATOM 2046 CB GLU A 128 -11.390 5.837 -2.653 1.00 21.02 C ATOM 2047 CG GLU A 128 -10.653 6.206 -1.376 1.00 1.21 C ATOM 2048 CD GLU A 128 -10.893 7.623 -0.948 1.00 33.12 C ATOM 2049 OE1 GLU A 128 -10.196 8.524 -1.435 1.00 14.30 O ATOM 2050 OE2 GLU A 128 -11.780 7.859 -0.108 1.00 2.54 O ATOM 0 H GLU A 128 -12.776 4.491 -1.112 1.00 72.20 H new ATOM 0 HA GLU A 128 -13.167 7.008 -2.456 1.00 65.32 H new ATOM 0 HB2 GLU A 128 -11.133 4.812 -2.919 1.00 21.02 H new ATOM 0 HB3 GLU A 128 -11.030 6.476 -3.460 1.00 21.02 H new ATOM 0 HG2 GLU A 128 -10.964 5.533 -0.577 1.00 1.21 H new ATOM 0 HG3 GLU A 128 -9.584 6.053 -1.523 1.00 1.21 H new