USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=33 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 71 MET CE :methyl 155:sc= -3.13! (180deg=-4.17!) USER MOD Set 1.2: A 86 HIS : no HD1:sc= 0 X(o=-3.1,f=-3.5) USER MOD Set 2.1: A 31 ASN : amide:sc= -4.15! C(o=-3.7!,f=-4.6!) USER MOD Set 2.2: A 106 TYR OH : rot 0:sc= 0.489 USER MOD Single : A 20 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0218) USER MOD Single : A 22 GLN :FLIP amide:sc= -1.05 F(o=-3.6!,f=-1.1) USER MOD Single : A 23 GLN :FLIP amide:sc= -2.56! C(o=-6.4!,f=-2.6!) USER MOD Single : A 32 LYS NZ :NH3+ -135:sc= -0.952 (180deg=-3.2!) USER MOD Single : A 33 GLN : amide:sc= 0.441 X(o=0.44,f=0) USER MOD Single : A 39 LYS NZ :NH3+ -143:sc= 0.0884 (180deg=0) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 66:sc= 0.859 USER MOD Single : A 42 SER OG : rot 80:sc= 0.358 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -139:sc= 1.12 (180deg=-0.0663!) USER MOD Single : A 54 LYS NZ :NH3+ 162:sc= 1.3 (180deg=0.703) USER MOD Single : A 56 LYS NZ :NH3+ -171:sc= 2.12 (180deg=1.91) USER MOD Single : A 57 TYR OH : rot 34:sc= 1.05 USER MOD Single : A 58 MET CE :methyl -152:sc= -0.602 (180deg=-2.04!) USER MOD Single : A 63 ASN : amide:sc= 1.24 K(o=1.2,f=-1.3) USER MOD Single : A 65 ASN : amide:sc= 0.0148 X(o=0.015,f=0) USER MOD Single : A 72 SER OG : rot 153:sc= 0.283 USER MOD Single : A 74 LYS NZ :NH3+ -167:sc= 1.04 (180deg=0.915) USER MOD Single : A 76 MET CE :methyl -132:sc= -1.8! (180deg=-3.97) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 170:sc= -0.0114 (180deg=-0.203) USER MOD Single : A 85 THR OG1 : rot 180:sc= -0.854 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 SER OG : rot -81:sc= 0.0118 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -104:sc= 1.21 USER MOD Single : A 105 SER OG : rot 7:sc= 1.23 USER MOD Single : A 112 MET CE :methyl -126:sc= -0.92 (180deg=-5.48!) USER MOD Single : A 113 MET CE :methyl -177:sc= -0.417 (180deg=-0.505) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot -140:sc= -0.199 USER MOD Single : A 122 LYS NZ :NH3+ 150:sc= 0 (180deg=-1.02) USER MOD Single : A 123 MET CE :methyl -167:sc= -0.0585 (180deg=-0.324) USER MOD Single : A 126 MET CE :methyl -163:sc= -0.0775 (180deg=-0.454) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 245 N LEU A 18 12.203 3.791 -9.250 1.00 65.03 N ATOM 246 CA LEU A 18 12.183 2.971 -10.459 1.00 52.32 C ATOM 247 C LEU A 18 11.172 1.812 -10.323 1.00 63.40 C ATOM 248 O LEU A 18 10.752 1.209 -11.311 1.00 74.03 O ATOM 249 CB LEU A 18 13.654 2.493 -10.747 1.00 12.10 C ATOM 250 CG LEU A 18 13.995 1.718 -12.064 1.00 52.54 C ATOM 251 CD1 LEU A 18 13.493 0.281 -12.065 1.00 42.12 C ATOM 252 CD2 LEU A 18 13.474 2.472 -13.283 1.00 12.12 C ATOM 0 HA LEU A 18 11.839 3.549 -11.317 1.00 52.32 H new ATOM 0 HB2 LEU A 18 14.291 3.377 -10.720 1.00 12.10 H new ATOM 0 HB3 LEU A 18 13.955 1.858 -9.913 1.00 12.10 H new ATOM 0 HG LEU A 18 15.082 1.663 -12.114 1.00 52.54 H new ATOM 0 HD11 LEU A 18 13.763 -0.198 -13.006 1.00 42.12 H new ATOM 0 HD12 LEU A 18 13.947 -0.264 -11.237 1.00 42.12 H new ATOM 0 HD13 LEU A 18 12.409 0.274 -11.952 1.00 42.12 H new ATOM 0 HD21 LEU A 18 13.721 1.916 -14.188 1.00 12.12 H new ATOM 0 HD22 LEU A 18 12.392 2.581 -13.208 1.00 12.12 H new ATOM 0 HD23 LEU A 18 13.936 3.458 -13.325 1.00 12.12 H new ATOM 264 N LEU A 19 10.732 1.551 -9.108 1.00 14.13 N ATOM 265 CA LEU A 19 9.833 0.447 -8.879 1.00 1.21 C ATOM 266 C LEU A 19 8.436 0.676 -9.382 1.00 30.13 C ATOM 267 O LEU A 19 7.732 -0.286 -9.625 1.00 13.42 O ATOM 268 CB LEU A 19 9.802 -0.054 -7.452 1.00 71.30 C ATOM 269 CG LEU A 19 11.070 -0.699 -6.927 1.00 33.14 C ATOM 270 CD1 LEU A 19 12.133 0.319 -6.530 1.00 42.25 C ATOM 271 CD2 LEU A 19 10.742 -1.663 -5.825 1.00 3.20 C ATOM 0 H LEU A 19 10.981 2.084 -8.275 1.00 14.13 H new ATOM 0 HA LEU A 19 10.274 -0.344 -9.485 1.00 1.21 H new ATOM 0 HB2 LEU A 19 9.554 0.785 -6.802 1.00 71.30 H new ATOM 0 HB3 LEU A 19 8.991 -0.777 -7.363 1.00 71.30 H new ATOM 0 HG LEU A 19 11.519 -1.266 -7.743 1.00 33.14 H new ATOM 0 HD11 LEU A 19 13.017 -0.202 -6.162 1.00 42.25 H new ATOM 0 HD12 LEU A 19 12.402 0.921 -7.398 1.00 42.25 H new ATOM 0 HD13 LEU A 19 11.741 0.967 -5.746 1.00 42.25 H new ATOM 0 HD21 LEU A 19 11.660 -2.120 -5.456 1.00 3.20 H new ATOM 0 HD22 LEU A 19 10.249 -1.131 -5.011 1.00 3.20 H new ATOM 0 HD23 LEU A 19 10.078 -2.439 -6.206 1.00 3.20 H new ATOM 283 N LYS A 20 8.021 1.933 -9.520 1.00 61.11 N ATOM 284 CA LYS A 20 6.679 2.240 -10.065 1.00 41.11 C ATOM 285 C LYS A 20 6.484 1.491 -11.391 1.00 31.34 C ATOM 286 O LYS A 20 5.468 0.815 -11.607 1.00 12.44 O ATOM 287 CB LYS A 20 6.494 3.749 -10.328 1.00 25.32 C ATOM 288 CG LYS A 20 6.660 4.673 -9.128 1.00 55.55 C ATOM 289 CD LYS A 20 6.348 6.116 -9.537 1.00 42.03 C ATOM 290 CE LYS A 20 6.501 7.105 -8.386 1.00 40.13 C ATOM 291 NZ LYS A 20 7.895 7.220 -7.918 1.00 34.11 N ATOM 0 H LYS A 20 8.576 2.751 -9.270 1.00 61.11 H new ATOM 0 HA LYS A 20 5.945 1.925 -9.323 1.00 41.11 H new ATOM 0 HB2 LYS A 20 7.208 4.052 -11.093 1.00 25.32 H new ATOM 0 HB3 LYS A 20 5.498 3.904 -10.743 1.00 25.32 H new ATOM 0 HG2 LYS A 20 5.995 4.362 -8.323 1.00 55.55 H new ATOM 0 HG3 LYS A 20 7.678 4.606 -8.744 1.00 55.55 H new ATOM 0 HD2 LYS A 20 7.010 6.409 -10.352 1.00 42.03 H new ATOM 0 HD3 LYS A 20 5.329 6.167 -9.921 1.00 42.03 H new ATOM 0 HE2 LYS A 20 6.147 8.085 -8.705 1.00 40.13 H new ATOM 0 HE3 LYS A 20 5.868 6.792 -7.556 1.00 40.13 H new ATOM 0 HZ1 LYS A 20 7.958 7.964 -7.195 1.00 34.11 H new ATOM 0 HZ2 LYS A 20 8.200 6.314 -7.509 1.00 34.11 H new ATOM 0 HZ3 LYS A 20 8.511 7.463 -8.720 1.00 34.11 H new ATOM 305 N ALA A 21 7.502 1.581 -12.240 1.00 54.33 N ATOM 306 CA ALA A 21 7.510 0.938 -13.541 1.00 54.23 C ATOM 307 C ALA A 21 7.431 -0.578 -13.412 1.00 42.02 C ATOM 308 O ALA A 21 6.742 -1.246 -14.189 1.00 61.22 O ATOM 309 CB ALA A 21 8.766 1.327 -14.296 1.00 54.11 C ATOM 0 H ALA A 21 8.351 2.109 -12.039 1.00 54.33 H new ATOM 0 HA ALA A 21 6.632 1.275 -14.092 1.00 54.23 H new ATOM 0 HB1 ALA A 21 8.768 0.842 -15.272 1.00 54.11 H new ATOM 0 HB2 ALA A 21 8.791 2.409 -14.428 1.00 54.11 H new ATOM 0 HB3 ALA A 21 9.643 1.010 -13.731 1.00 54.11 H new ATOM 315 N GLN A 22 8.136 -1.109 -12.433 1.00 34.03 N ATOM 316 CA GLN A 22 8.190 -2.549 -12.199 1.00 65.34 C ATOM 317 C GLN A 22 6.863 -3.054 -11.660 1.00 61.04 C ATOM 318 O GLN A 22 6.318 -4.048 -12.140 1.00 4.15 O ATOM 319 CB GLN A 22 9.259 -2.887 -11.166 1.00 54.14 C ATOM 320 CG GLN A 22 10.672 -2.428 -11.493 1.00 1.54 C ATOM 321 CD GLN A 22 11.658 -2.811 -10.414 1.00 74.42 C ATOM 322 OE1 GLN A 22 11.180 -2.910 -9.207 1.00 62.43 O flip ATOM 323 NE2 GLN A 22 12.846 -3.027 -10.670 1.00 22.33 N flip ATOM 0 H GLN A 22 8.689 -0.560 -11.775 1.00 34.03 H new ATOM 0 HA GLN A 22 8.419 -3.022 -13.154 1.00 65.34 H new ATOM 0 HB2 GLN A 22 8.967 -2.447 -10.213 1.00 54.14 H new ATOM 0 HB3 GLN A 22 9.273 -3.968 -11.027 1.00 54.14 H new ATOM 0 HG2 GLN A 22 10.985 -2.866 -12.441 1.00 1.54 H new ATOM 0 HG3 GLN A 22 10.680 -1.346 -11.623 1.00 1.54 H new ATOM 0 HE21 GLN A 22 13.185 -2.940 -11.628 1.00 22.33 H new ATOM 0 HE22 GLN A 22 13.488 -3.293 -9.924 1.00 22.33 H new ATOM 332 N GLN A 23 6.341 -2.354 -10.663 1.00 12.14 N ATOM 333 CA GLN A 23 5.155 -2.792 -9.971 1.00 45.22 C ATOM 334 C GLN A 23 3.933 -2.818 -10.854 1.00 4.43 C ATOM 335 O GLN A 23 3.112 -3.682 -10.686 1.00 64.24 O ATOM 336 CB GLN A 23 4.896 -2.013 -8.688 1.00 1.25 C ATOM 337 CG GLN A 23 6.045 -2.081 -7.684 1.00 21.12 C ATOM 338 CD GLN A 23 5.697 -1.485 -6.356 1.00 15.13 C ATOM 339 OE1 GLN A 23 4.473 -1.613 -5.972 1.00 52.50 O flip ATOM 340 NE2 GLN A 23 6.547 -0.943 -5.665 1.00 41.21 N flip ATOM 0 H GLN A 23 6.729 -1.476 -10.319 1.00 12.14 H new ATOM 0 HA GLN A 23 5.359 -3.823 -9.682 1.00 45.22 H new ATOM 0 HB2 GLN A 23 4.707 -0.969 -8.939 1.00 1.25 H new ATOM 0 HB3 GLN A 23 3.991 -2.397 -8.217 1.00 1.25 H new ATOM 0 HG2 GLN A 23 6.337 -3.122 -7.544 1.00 21.12 H new ATOM 0 HG3 GLN A 23 6.910 -1.560 -8.094 1.00 21.12 H new ATOM 0 HE21 GLN A 23 7.505 -0.862 -6.005 1.00 41.21 H new ATOM 0 HE22 GLN A 23 6.298 -0.572 -4.748 1.00 41.21 H new ATOM 349 N GLU A 24 3.825 -1.879 -11.799 1.00 11.22 N ATOM 350 CA GLU A 24 2.699 -1.852 -12.767 1.00 11.11 C ATOM 351 C GLU A 24 2.529 -3.223 -13.429 1.00 13.52 C ATOM 352 O GLU A 24 1.414 -3.760 -13.521 1.00 73.44 O ATOM 353 CB GLU A 24 2.951 -0.760 -13.829 1.00 43.44 C ATOM 354 CG GLU A 24 1.977 -0.745 -15.016 1.00 32.03 C ATOM 355 CD GLU A 24 0.518 -0.599 -14.637 1.00 4.14 C ATOM 356 OE1 GLU A 24 0.083 0.505 -14.323 1.00 51.53 O ATOM 357 OE2 GLU A 24 -0.224 -1.602 -14.694 1.00 14.20 O ATOM 0 H GLU A 24 4.498 -1.123 -11.923 1.00 11.22 H new ATOM 0 HA GLU A 24 1.777 -1.618 -12.234 1.00 11.11 H new ATOM 0 HB2 GLU A 24 2.912 0.213 -13.339 1.00 43.44 H new ATOM 0 HB3 GLU A 24 3.963 -0.882 -14.215 1.00 43.44 H new ATOM 0 HG2 GLU A 24 2.249 0.075 -15.681 1.00 32.03 H new ATOM 0 HG3 GLU A 24 2.101 -1.669 -15.581 1.00 32.03 H new ATOM 364 N GLU A 25 3.644 -3.796 -13.819 1.00 33.25 N ATOM 365 CA GLU A 25 3.686 -5.082 -14.469 1.00 13.42 C ATOM 366 C GLU A 25 3.086 -6.166 -13.552 1.00 55.30 C ATOM 367 O GLU A 25 2.270 -6.975 -13.983 1.00 33.53 O ATOM 368 CB GLU A 25 5.139 -5.392 -14.802 1.00 23.32 C ATOM 369 CG GLU A 25 5.373 -6.639 -15.618 1.00 25.15 C ATOM 370 CD GLU A 25 6.837 -6.827 -15.898 1.00 73.15 C ATOM 371 OE1 GLU A 25 7.345 -6.236 -16.879 1.00 64.03 O ATOM 372 OE2 GLU A 25 7.512 -7.546 -15.122 1.00 60.24 O ATOM 0 H GLU A 25 4.563 -3.372 -13.690 1.00 33.25 H new ATOM 0 HA GLU A 25 3.093 -5.066 -15.384 1.00 13.42 H new ATOM 0 HB2 GLU A 25 5.558 -4.543 -15.342 1.00 23.32 H new ATOM 0 HB3 GLU A 25 5.695 -5.481 -13.869 1.00 23.32 H new ATOM 0 HG2 GLU A 25 4.986 -7.507 -15.083 1.00 25.15 H new ATOM 0 HG3 GLU A 25 4.824 -6.573 -16.557 1.00 25.15 H new ATOM 379 N ARG A 26 3.482 -6.147 -12.283 1.00 21.11 N ATOM 380 CA ARG A 26 2.996 -7.104 -11.306 1.00 41.51 C ATOM 381 C ARG A 26 1.551 -6.785 -10.856 1.00 60.34 C ATOM 382 O ARG A 26 0.786 -7.683 -10.560 1.00 13.44 O ATOM 383 CB ARG A 26 3.919 -7.171 -10.088 1.00 0.22 C ATOM 384 CG ARG A 26 3.511 -8.249 -9.100 1.00 30.50 C ATOM 385 CD ARG A 26 4.400 -8.293 -7.881 1.00 63.11 C ATOM 386 NE ARG A 26 4.031 -9.415 -7.006 1.00 72.55 N ATOM 387 CZ ARG A 26 4.151 -9.439 -5.669 1.00 75.14 C ATOM 388 NH1 ARG A 26 4.615 -8.378 -5.003 1.00 4.21 N ATOM 389 NH2 ARG A 26 3.805 -10.531 -5.002 1.00 31.43 N ATOM 0 H ARG A 26 4.146 -5.469 -11.908 1.00 21.11 H new ATOM 0 HA ARG A 26 2.991 -8.077 -11.796 1.00 41.51 H new ATOM 0 HB2 ARG A 26 4.940 -7.357 -10.421 1.00 0.22 H new ATOM 0 HB3 ARG A 26 3.920 -6.204 -9.584 1.00 0.22 H new ATOM 0 HG2 ARG A 26 2.481 -8.077 -8.787 1.00 30.50 H new ATOM 0 HG3 ARG A 26 3.536 -9.219 -9.597 1.00 30.50 H new ATOM 0 HD2 ARG A 26 5.441 -8.393 -8.188 1.00 63.11 H new ATOM 0 HD3 ARG A 26 4.318 -7.355 -7.332 1.00 63.11 H new ATOM 0 HE ARG A 26 3.650 -10.249 -7.454 1.00 72.55 H new ATOM 0 HH11 ARG A 26 4.884 -7.535 -5.510 1.00 4.21 H new ATOM 0 HH12 ARG A 26 4.701 -8.411 -3.987 1.00 4.21 H new ATOM 0 HH21 ARG A 26 3.451 -11.345 -5.505 1.00 31.43 H new ATOM 0 HH22 ARG A 26 3.893 -10.557 -3.986 1.00 31.43 H new ATOM 403 N LEU A 27 1.199 -5.517 -10.804 1.00 42.32 N ATOM 404 CA LEU A 27 -0.146 -5.096 -10.391 1.00 34.02 C ATOM 405 C LEU A 27 -1.196 -5.666 -11.316 1.00 53.03 C ATOM 406 O LEU A 27 -2.152 -6.309 -10.876 1.00 5.40 O ATOM 407 CB LEU A 27 -0.258 -3.570 -10.346 1.00 73.43 C ATOM 408 CG LEU A 27 0.633 -2.849 -9.330 1.00 55.34 C ATOM 409 CD1 LEU A 27 0.444 -1.344 -9.425 1.00 14.43 C ATOM 410 CD2 LEU A 27 0.328 -3.326 -7.932 1.00 42.00 C ATOM 0 H LEU A 27 1.823 -4.746 -11.042 1.00 42.32 H new ATOM 0 HA LEU A 27 -0.318 -5.483 -9.387 1.00 34.02 H new ATOM 0 HB2 LEU A 27 -0.028 -3.182 -11.338 1.00 73.43 H new ATOM 0 HB3 LEU A 27 -1.295 -3.310 -10.135 1.00 73.43 H new ATOM 0 HG LEU A 27 1.673 -3.082 -9.560 1.00 55.34 H new ATOM 0 HD11 LEU A 27 1.086 -0.850 -8.695 1.00 14.43 H new ATOM 0 HD12 LEU A 27 0.708 -1.007 -10.427 1.00 14.43 H new ATOM 0 HD13 LEU A 27 -0.597 -1.094 -9.221 1.00 14.43 H new ATOM 0 HD21 LEU A 27 0.969 -2.804 -7.222 1.00 42.00 H new ATOM 0 HD22 LEU A 27 -0.716 -3.120 -7.697 1.00 42.00 H new ATOM 0 HD23 LEU A 27 0.510 -4.399 -7.866 1.00 42.00 H new ATOM 422 N ASP A 28 -0.991 -5.462 -12.597 1.00 52.43 N ATOM 423 CA ASP A 28 -1.906 -5.975 -13.603 1.00 65.14 C ATOM 424 C ASP A 28 -1.857 -7.496 -13.624 1.00 3.20 C ATOM 425 O ASP A 28 -2.871 -8.162 -13.812 1.00 75.54 O ATOM 426 CB ASP A 28 -1.562 -5.386 -14.967 1.00 53.30 C ATOM 427 CG ASP A 28 -2.460 -5.878 -16.075 1.00 42.24 C ATOM 428 OD1 ASP A 28 -3.623 -5.404 -16.175 1.00 22.21 O ATOM 429 OD2 ASP A 28 -2.011 -6.709 -16.879 1.00 74.44 O ATOM 0 H ASP A 28 -0.197 -4.943 -12.973 1.00 52.43 H new ATOM 0 HA ASP A 28 -2.925 -5.676 -13.355 1.00 65.14 H new ATOM 0 HB2 ASP A 28 -1.627 -4.299 -14.912 1.00 53.30 H new ATOM 0 HB3 ASP A 28 -0.528 -5.632 -15.211 1.00 53.30 H new ATOM 434 N GLU A 29 -0.677 -8.018 -13.339 1.00 71.14 N ATOM 435 CA GLU A 29 -0.398 -9.452 -13.278 1.00 53.44 C ATOM 436 C GLU A 29 -1.300 -10.107 -12.225 1.00 53.44 C ATOM 437 O GLU A 29 -1.892 -11.187 -12.454 1.00 44.35 O ATOM 438 CB GLU A 29 1.066 -9.596 -12.871 1.00 11.21 C ATOM 439 CG GLU A 29 1.617 -10.980 -12.774 1.00 35.10 C ATOM 440 CD GLU A 29 1.555 -11.716 -14.078 1.00 13.42 C ATOM 441 OE1 GLU A 29 2.318 -11.364 -14.997 1.00 20.21 O ATOM 442 OE2 GLU A 29 0.754 -12.658 -14.204 1.00 71.00 O ATOM 0 H GLU A 29 0.141 -7.443 -13.137 1.00 71.14 H new ATOM 0 HA GLU A 29 -0.587 -9.935 -14.237 1.00 53.44 H new ATOM 0 HB2 GLU A 29 1.671 -9.041 -13.588 1.00 11.21 H new ATOM 0 HB3 GLU A 29 1.196 -9.113 -11.903 1.00 11.21 H new ATOM 0 HG2 GLU A 29 2.652 -10.932 -12.436 1.00 35.10 H new ATOM 0 HG3 GLU A 29 1.061 -11.537 -12.020 1.00 35.10 H new ATOM 449 N ILE A 30 -1.404 -9.448 -11.093 1.00 31.12 N ATOM 450 CA ILE A 30 -2.227 -9.896 -10.002 1.00 70.32 C ATOM 451 C ILE A 30 -3.717 -9.758 -10.351 1.00 52.14 C ATOM 452 O ILE A 30 -4.492 -10.693 -10.155 1.00 73.02 O ATOM 453 CB ILE A 30 -1.880 -9.135 -8.688 1.00 13.15 C ATOM 454 CG1 ILE A 30 -0.415 -9.399 -8.302 1.00 3.14 C ATOM 455 CG2 ILE A 30 -2.791 -9.560 -7.564 1.00 74.11 C ATOM 456 CD1 ILE A 30 0.058 -8.643 -7.074 1.00 43.14 C ATOM 0 H ILE A 30 -0.911 -8.575 -10.906 1.00 31.12 H new ATOM 0 HA ILE A 30 -2.020 -10.953 -9.833 1.00 70.32 H new ATOM 0 HB ILE A 30 -2.022 -8.068 -8.861 1.00 13.15 H new ATOM 0 HG12 ILE A 30 -0.285 -10.467 -8.128 1.00 3.14 H new ATOM 0 HG13 ILE A 30 0.223 -9.133 -9.145 1.00 3.14 H new ATOM 0 HG21 ILE A 30 -2.529 -9.015 -6.657 1.00 74.11 H new ATOM 0 HG22 ILE A 30 -3.825 -9.343 -7.832 1.00 74.11 H new ATOM 0 HG23 ILE A 30 -2.678 -10.630 -7.389 1.00 74.11 H new ATOM 0 HD11 ILE A 30 1.101 -8.889 -6.875 1.00 43.14 H new ATOM 0 HD12 ILE A 30 -0.035 -7.571 -7.248 1.00 43.14 H new ATOM 0 HD13 ILE A 30 -0.552 -8.925 -6.216 1.00 43.14 H new ATOM 468 N ASN A 31 -4.103 -8.618 -10.906 1.00 60.01 N ATOM 469 CA ASN A 31 -5.509 -8.399 -11.287 1.00 12.25 C ATOM 470 C ASN A 31 -5.990 -9.434 -12.279 1.00 74.53 C ATOM 471 O ASN A 31 -7.050 -10.007 -12.107 1.00 25.30 O ATOM 472 CB ASN A 31 -5.770 -6.987 -11.838 1.00 3.14 C ATOM 473 CG ASN A 31 -5.561 -5.904 -10.808 1.00 73.12 C ATOM 474 OD1 ASN A 31 -5.706 -6.134 -9.612 1.00 70.21 O ATOM 475 ND2 ASN A 31 -5.282 -4.711 -11.253 1.00 1.15 N ATOM 0 H ASN A 31 -3.480 -7.835 -11.104 1.00 60.01 H new ATOM 0 HA ASN A 31 -6.079 -8.503 -10.364 1.00 12.25 H new ATOM 0 HB2 ASN A 31 -5.110 -6.806 -12.686 1.00 3.14 H new ATOM 0 HB3 ASN A 31 -6.792 -6.932 -12.212 1.00 3.14 H new ATOM 0 HD21 ASN A 31 -5.178 -3.935 -10.600 1.00 1.15 H new ATOM 0 HD22 ASN A 31 -5.168 -4.554 -12.254 1.00 1.15 H new ATOM 482 N LYS A 32 -5.179 -9.685 -13.298 1.00 3.14 N ATOM 483 CA LYS A 32 -5.487 -10.663 -14.355 1.00 15.44 C ATOM 484 C LYS A 32 -5.903 -12.014 -13.800 1.00 25.13 C ATOM 485 O LYS A 32 -6.921 -12.552 -14.188 1.00 65.12 O ATOM 486 CB LYS A 32 -4.287 -10.860 -15.289 1.00 1.32 C ATOM 487 CG LYS A 32 -3.967 -9.678 -16.180 1.00 72.25 C ATOM 488 CD LYS A 32 -2.683 -9.869 -17.028 1.00 43.11 C ATOM 489 CE LYS A 32 -2.742 -11.016 -18.069 1.00 1.44 C ATOM 490 NZ LYS A 32 -2.740 -12.387 -17.476 1.00 33.30 N ATOM 0 H LYS A 32 -4.281 -9.217 -13.423 1.00 3.14 H new ATOM 0 HA LYS A 32 -6.328 -10.248 -14.911 1.00 15.44 H new ATOM 0 HB2 LYS A 32 -3.409 -11.088 -14.684 1.00 1.32 H new ATOM 0 HB3 LYS A 32 -4.475 -11.730 -15.919 1.00 1.32 H new ATOM 0 HG2 LYS A 32 -4.810 -9.498 -16.848 1.00 72.25 H new ATOM 0 HG3 LYS A 32 -3.855 -8.787 -15.562 1.00 72.25 H new ATOM 0 HD2 LYS A 32 -2.470 -8.936 -17.551 1.00 43.11 H new ATOM 0 HD3 LYS A 32 -1.847 -10.055 -16.354 1.00 43.11 H new ATOM 0 HE2 LYS A 32 -3.641 -10.896 -18.674 1.00 1.44 H new ATOM 0 HE3 LYS A 32 -1.890 -10.923 -18.743 1.00 1.44 H new ATOM 0 HZ1 LYS A 32 -2.076 -12.991 -18.001 1.00 33.30 H new ATOM 0 HZ2 LYS A 32 -2.446 -12.334 -16.480 1.00 33.30 H new ATOM 0 HZ3 LYS A 32 -3.696 -12.792 -17.534 1.00 33.30 H new ATOM 504 N GLN A 33 -5.130 -12.533 -12.877 1.00 14.11 N ATOM 505 CA GLN A 33 -5.382 -13.861 -12.345 1.00 41.34 C ATOM 506 C GLN A 33 -6.659 -13.923 -11.492 1.00 72.24 C ATOM 507 O GLN A 33 -7.381 -14.917 -11.523 1.00 74.34 O ATOM 508 CB GLN A 33 -4.138 -14.400 -11.623 1.00 32.41 C ATOM 509 CG GLN A 33 -3.659 -13.553 -10.466 1.00 12.33 C ATOM 510 CD GLN A 33 -2.313 -13.987 -9.951 1.00 64.22 C ATOM 511 OE1 GLN A 33 -2.212 -14.837 -9.063 1.00 14.11 O ATOM 512 NE2 GLN A 33 -1.268 -13.408 -10.497 1.00 1.20 N ATOM 0 H GLN A 33 -4.320 -12.061 -12.475 1.00 14.11 H new ATOM 0 HA GLN A 33 -5.576 -14.528 -13.185 1.00 41.34 H new ATOM 0 HB2 GLN A 33 -4.355 -15.403 -11.255 1.00 32.41 H new ATOM 0 HB3 GLN A 33 -3.328 -14.494 -12.346 1.00 32.41 H new ATOM 0 HG2 GLN A 33 -3.605 -12.511 -10.781 1.00 12.33 H new ATOM 0 HG3 GLN A 33 -4.387 -13.604 -9.657 1.00 12.33 H new ATOM 0 HE21 GLN A 33 -1.396 -12.710 -11.229 1.00 1.20 H new ATOM 0 HE22 GLN A 33 -0.328 -13.657 -10.189 1.00 1.20 H new ATOM 521 N PHE A 34 -6.938 -12.871 -10.740 1.00 61.22 N ATOM 522 CA PHE A 34 -8.186 -12.800 -9.976 1.00 32.10 C ATOM 523 C PHE A 34 -9.398 -12.557 -10.881 1.00 54.30 C ATOM 524 O PHE A 34 -10.473 -13.086 -10.650 1.00 41.21 O ATOM 525 CB PHE A 34 -8.112 -11.753 -8.854 1.00 44.21 C ATOM 526 CG PHE A 34 -7.226 -12.158 -7.704 1.00 1.15 C ATOM 527 CD1 PHE A 34 -5.867 -11.926 -7.730 1.00 10.55 C ATOM 528 CD2 PHE A 34 -7.769 -12.786 -6.599 1.00 42.31 C ATOM 529 CE1 PHE A 34 -5.062 -12.308 -6.674 1.00 34.21 C ATOM 530 CE2 PHE A 34 -6.971 -13.172 -5.539 1.00 45.22 C ATOM 531 CZ PHE A 34 -5.614 -12.933 -5.578 1.00 2.41 C ATOM 0 H PHE A 34 -6.329 -12.059 -10.638 1.00 61.22 H new ATOM 0 HA PHE A 34 -8.320 -13.774 -9.506 1.00 32.10 H new ATOM 0 HB2 PHE A 34 -7.747 -10.814 -9.269 1.00 44.21 H new ATOM 0 HB3 PHE A 34 -9.118 -11.565 -8.478 1.00 44.21 H new ATOM 0 HD1 PHE A 34 -5.426 -11.439 -8.587 1.00 10.55 H new ATOM 0 HD2 PHE A 34 -8.831 -12.978 -6.564 1.00 42.31 H new ATOM 0 HE1 PHE A 34 -4.000 -12.116 -6.708 1.00 34.21 H new ATOM 0 HE2 PHE A 34 -7.410 -13.660 -4.681 1.00 45.22 H new ATOM 0 HZ PHE A 34 -4.986 -13.235 -4.753 1.00 2.41 H new ATOM 541 N LEU A 35 -9.185 -11.777 -11.917 1.00 21.13 N ATOM 542 CA LEU A 35 -10.235 -11.374 -12.853 1.00 23.10 C ATOM 543 C LEU A 35 -10.606 -12.526 -13.795 1.00 61.51 C ATOM 544 O LEU A 35 -11.775 -12.709 -14.146 1.00 21.55 O ATOM 545 CB LEU A 35 -9.717 -10.128 -13.634 1.00 65.21 C ATOM 546 CG LEU A 35 -10.662 -9.339 -14.585 1.00 13.43 C ATOM 547 CD1 LEU A 35 -9.968 -8.058 -15.018 1.00 1.41 C ATOM 548 CD2 LEU A 35 -11.023 -10.134 -15.835 1.00 62.35 C ATOM 0 H LEU A 35 -8.267 -11.394 -12.145 1.00 21.13 H new ATOM 0 HA LEU A 35 -11.148 -11.117 -12.316 1.00 23.10 H new ATOM 0 HB2 LEU A 35 -9.341 -9.420 -12.896 1.00 65.21 H new ATOM 0 HB3 LEU A 35 -8.863 -10.454 -14.228 1.00 65.21 H new ATOM 0 HG LEU A 35 -11.581 -9.133 -14.037 1.00 13.43 H new ATOM 0 HD11 LEU A 35 -10.622 -7.497 -15.685 1.00 1.41 H new ATOM 0 HD12 LEU A 35 -9.740 -7.453 -14.140 1.00 1.41 H new ATOM 0 HD13 LEU A 35 -9.043 -8.304 -15.539 1.00 1.41 H new ATOM 0 HD21 LEU A 35 -11.684 -9.540 -16.466 1.00 62.35 H new ATOM 0 HD22 LEU A 35 -10.115 -10.376 -16.387 1.00 62.35 H new ATOM 0 HD23 LEU A 35 -11.529 -11.056 -15.547 1.00 62.35 H new ATOM 560 N ASP A 36 -9.619 -13.299 -14.191 1.00 74.31 N ATOM 561 CA ASP A 36 -9.830 -14.388 -15.149 1.00 63.31 C ATOM 562 C ASP A 36 -10.535 -15.583 -14.512 1.00 44.11 C ATOM 563 O ASP A 36 -11.140 -16.406 -15.212 1.00 53.40 O ATOM 564 CB ASP A 36 -8.493 -14.813 -15.787 1.00 41.22 C ATOM 565 CG ASP A 36 -8.637 -15.908 -16.826 1.00 3.33 C ATOM 566 OD1 ASP A 36 -9.084 -15.614 -17.962 1.00 71.02 O ATOM 567 OD2 ASP A 36 -8.289 -17.070 -16.542 1.00 24.41 O ATOM 0 H ASP A 36 -8.656 -13.202 -13.870 1.00 74.31 H new ATOM 0 HA ASP A 36 -10.486 -14.011 -15.933 1.00 63.31 H new ATOM 0 HB2 ASP A 36 -8.028 -13.943 -16.251 1.00 41.22 H new ATOM 0 HB3 ASP A 36 -7.818 -15.155 -15.002 1.00 41.22 H new ATOM 572 N ASP A 37 -10.491 -15.657 -13.192 1.00 70.53 N ATOM 573 CA ASP A 37 -11.076 -16.777 -12.469 1.00 42.11 C ATOM 574 C ASP A 37 -12.618 -16.660 -12.443 1.00 52.32 C ATOM 575 O ASP A 37 -13.174 -15.663 -11.934 1.00 75.51 O ATOM 576 CB ASP A 37 -10.552 -16.799 -11.051 1.00 22.44 C ATOM 577 CG ASP A 37 -10.974 -18.029 -10.269 1.00 64.34 C ATOM 578 OD1 ASP A 37 -12.141 -18.121 -9.858 1.00 73.21 O ATOM 579 OD2 ASP A 37 -10.131 -18.917 -10.040 1.00 32.21 O ATOM 0 H ASP A 37 -10.055 -14.953 -12.597 1.00 70.53 H new ATOM 0 HA ASP A 37 -10.800 -17.700 -12.978 1.00 42.11 H new ATOM 0 HB2 ASP A 37 -9.463 -16.748 -11.073 1.00 22.44 H new ATOM 0 HB3 ASP A 37 -10.902 -15.908 -10.529 1.00 22.44 H new ATOM 584 N PRO A 38 -13.333 -17.668 -12.989 1.00 2.53 N ATOM 585 CA PRO A 38 -14.807 -17.676 -13.046 1.00 34.54 C ATOM 586 C PRO A 38 -15.494 -17.665 -11.667 1.00 61.25 C ATOM 587 O PRO A 38 -16.661 -17.259 -11.558 1.00 13.42 O ATOM 588 CB PRO A 38 -15.141 -18.979 -13.786 1.00 3.35 C ATOM 589 CG PRO A 38 -13.890 -19.347 -14.499 1.00 22.04 C ATOM 590 CD PRO A 38 -12.763 -18.860 -13.640 1.00 10.23 C ATOM 0 HA PRO A 38 -15.170 -16.772 -13.534 1.00 34.54 H new ATOM 0 HB2 PRO A 38 -15.444 -19.762 -13.090 1.00 3.35 H new ATOM 0 HB3 PRO A 38 -15.966 -18.836 -14.484 1.00 3.35 H new ATOM 0 HG2 PRO A 38 -13.829 -20.425 -14.648 1.00 22.04 H new ATOM 0 HG3 PRO A 38 -13.854 -18.887 -15.486 1.00 22.04 H new ATOM 0 HD2 PRO A 38 -12.458 -19.611 -12.911 1.00 10.23 H new ATOM 0 HD3 PRO A 38 -11.882 -18.614 -14.232 1.00 10.23 H new ATOM 598 N LYS A 39 -14.785 -18.081 -10.622 1.00 31.21 N ATOM 599 CA LYS A 39 -15.374 -18.137 -9.298 1.00 52.00 C ATOM 600 C LYS A 39 -15.383 -16.731 -8.733 1.00 23.23 C ATOM 601 O LYS A 39 -16.384 -16.291 -8.177 1.00 14.40 O ATOM 602 CB LYS A 39 -14.601 -19.136 -8.392 1.00 11.44 C ATOM 603 CG LYS A 39 -15.290 -19.559 -7.078 1.00 51.02 C ATOM 604 CD LYS A 39 -15.400 -18.463 -6.025 1.00 22.55 C ATOM 605 CE LYS A 39 -14.039 -18.032 -5.500 1.00 53.35 C ATOM 606 NZ LYS A 39 -14.159 -17.017 -4.434 1.00 35.21 N ATOM 0 H LYS A 39 -13.811 -18.381 -10.670 1.00 31.21 H new ATOM 0 HA LYS A 39 -16.398 -18.507 -9.347 1.00 52.00 H new ATOM 0 HB2 LYS A 39 -14.398 -20.035 -8.974 1.00 11.44 H new ATOM 0 HB3 LYS A 39 -13.637 -18.693 -8.143 1.00 11.44 H new ATOM 0 HG2 LYS A 39 -16.292 -19.920 -7.311 1.00 51.02 H new ATOM 0 HG3 LYS A 39 -14.740 -20.398 -6.651 1.00 51.02 H new ATOM 0 HD2 LYS A 39 -15.912 -17.601 -6.452 1.00 22.55 H new ATOM 0 HD3 LYS A 39 -16.012 -18.818 -5.196 1.00 22.55 H new ATOM 0 HE2 LYS A 39 -13.506 -18.901 -5.116 1.00 53.35 H new ATOM 0 HE3 LYS A 39 -13.444 -17.630 -6.320 1.00 53.35 H new ATOM 0 HZ1 LYS A 39 -13.387 -16.326 -4.524 1.00 35.21 H new ATOM 0 HZ2 LYS A 39 -15.073 -16.528 -4.522 1.00 35.21 H new ATOM 0 HZ3 LYS A 39 -14.102 -17.481 -3.505 1.00 35.21 H new ATOM 620 N TYR A 40 -14.268 -16.006 -8.917 1.00 51.43 N ATOM 621 CA TYR A 40 -14.204 -14.603 -8.490 1.00 13.41 C ATOM 622 C TYR A 40 -15.140 -13.755 -9.312 1.00 12.34 C ATOM 623 O TYR A 40 -15.557 -12.672 -8.887 1.00 43.05 O ATOM 624 CB TYR A 40 -12.786 -14.025 -8.523 1.00 2.13 C ATOM 625 CG TYR A 40 -11.860 -14.629 -7.506 1.00 44.23 C ATOM 626 CD1 TYR A 40 -12.097 -14.457 -6.161 1.00 2.35 C ATOM 627 CD2 TYR A 40 -10.754 -15.361 -7.886 1.00 62.15 C ATOM 628 CE1 TYR A 40 -11.263 -15.002 -5.224 1.00 35.35 C ATOM 629 CE2 TYR A 40 -9.909 -15.910 -6.965 1.00 3.32 C ATOM 630 CZ TYR A 40 -10.163 -15.731 -5.625 1.00 62.30 C ATOM 631 OH TYR A 40 -9.330 -16.291 -4.677 1.00 64.55 O ATOM 0 H TYR A 40 -13.415 -16.361 -9.350 1.00 51.43 H new ATOM 0 HA TYR A 40 -14.521 -14.584 -7.447 1.00 13.41 H new ATOM 0 HB2 TYR A 40 -12.366 -14.175 -9.517 1.00 2.13 H new ATOM 0 HB3 TYR A 40 -12.839 -12.949 -8.358 1.00 2.13 H new ATOM 0 HD1 TYR A 40 -12.954 -13.883 -5.841 1.00 2.35 H new ATOM 0 HD2 TYR A 40 -10.552 -15.503 -8.937 1.00 62.15 H new ATOM 0 HE1 TYR A 40 -11.465 -14.862 -4.172 1.00 35.35 H new ATOM 0 HE2 TYR A 40 -9.049 -16.480 -7.285 1.00 3.32 H new ATOM 0 HH TYR A 40 -8.603 -16.773 -5.124 1.00 64.55 H new ATOM 641 N SER A 41 -15.476 -14.246 -10.485 1.00 30.20 N ATOM 642 CA SER A 41 -16.435 -13.602 -11.318 1.00 14.23 C ATOM 643 C SER A 41 -17.837 -13.785 -10.716 1.00 11.12 C ATOM 644 O SER A 41 -18.546 -14.745 -11.011 1.00 54.44 O ATOM 645 CB SER A 41 -16.369 -14.148 -12.743 1.00 61.41 C ATOM 646 OG SER A 41 -15.063 -13.991 -13.296 1.00 31.34 O ATOM 0 H SER A 41 -15.085 -15.103 -10.877 1.00 30.20 H new ATOM 0 HA SER A 41 -16.210 -12.537 -11.368 1.00 14.23 H new ATOM 0 HB2 SER A 41 -16.643 -15.203 -12.744 1.00 61.41 H new ATOM 0 HB3 SER A 41 -17.096 -13.629 -13.368 1.00 61.41 H new ATOM 0 HG SER A 41 -14.430 -14.557 -12.806 1.00 31.34 H new ATOM 652 N SER A 42 -18.146 -12.925 -9.779 1.00 12.52 N ATOM 653 CA SER A 42 -19.427 -12.891 -9.110 1.00 52.55 C ATOM 654 C SER A 42 -19.875 -11.446 -8.973 1.00 33.33 C ATOM 655 O SER A 42 -21.072 -11.140 -9.002 1.00 60.34 O ATOM 656 CB SER A 42 -19.322 -13.540 -7.721 1.00 22.10 C ATOM 657 OG SER A 42 -18.903 -14.896 -7.812 1.00 13.32 O ATOM 0 H SER A 42 -17.498 -12.209 -9.450 1.00 12.52 H new ATOM 0 HA SER A 42 -20.156 -13.450 -9.697 1.00 52.55 H new ATOM 0 HB2 SER A 42 -18.616 -12.980 -7.108 1.00 22.10 H new ATOM 0 HB3 SER A 42 -20.289 -13.489 -7.220 1.00 22.10 H new ATOM 0 HG SER A 42 -17.932 -14.930 -7.941 1.00 13.32 H new ATOM 663 N ASP A 43 -18.905 -10.558 -8.828 1.00 33.13 N ATOM 664 CA ASP A 43 -19.188 -9.145 -8.733 1.00 3.12 C ATOM 665 C ASP A 43 -19.283 -8.600 -10.143 1.00 41.11 C ATOM 666 O ASP A 43 -18.440 -8.915 -10.984 1.00 23.53 O ATOM 667 CB ASP A 43 -18.076 -8.418 -7.955 1.00 14.23 C ATOM 668 CG ASP A 43 -18.396 -6.958 -7.679 1.00 1.31 C ATOM 669 OD1 ASP A 43 -18.339 -6.138 -8.595 1.00 25.00 O ATOM 670 OD2 ASP A 43 -18.725 -6.619 -6.515 1.00 64.25 O ATOM 0 H ASP A 43 -17.915 -10.796 -8.774 1.00 33.13 H new ATOM 0 HA ASP A 43 -20.123 -8.985 -8.196 1.00 3.12 H new ATOM 0 HB2 ASP A 43 -17.908 -8.932 -7.009 1.00 14.23 H new ATOM 0 HB3 ASP A 43 -17.146 -8.479 -8.520 1.00 14.23 H new ATOM 675 N GLU A 44 -20.295 -7.817 -10.403 1.00 71.04 N ATOM 676 CA GLU A 44 -20.551 -7.272 -11.727 1.00 64.20 C ATOM 677 C GLU A 44 -19.404 -6.386 -12.215 1.00 14.25 C ATOM 678 O GLU A 44 -19.053 -6.402 -13.398 1.00 12.24 O ATOM 679 CB GLU A 44 -21.880 -6.515 -11.725 1.00 62.12 C ATOM 680 CG GLU A 44 -22.252 -5.876 -13.048 1.00 71.04 C ATOM 681 CD GLU A 44 -23.613 -5.243 -13.007 1.00 54.12 C ATOM 682 OE1 GLU A 44 -24.605 -5.943 -13.305 1.00 1.54 O ATOM 683 OE2 GLU A 44 -23.725 -4.045 -12.668 1.00 15.24 O ATOM 0 H GLU A 44 -20.977 -7.531 -9.701 1.00 71.04 H new ATOM 0 HA GLU A 44 -20.619 -8.102 -12.430 1.00 64.20 H new ATOM 0 HB2 GLU A 44 -22.673 -7.204 -11.435 1.00 62.12 H new ATOM 0 HB3 GLU A 44 -21.838 -5.738 -10.962 1.00 62.12 H new ATOM 0 HG2 GLU A 44 -21.509 -5.121 -13.307 1.00 71.04 H new ATOM 0 HG3 GLU A 44 -22.227 -6.631 -13.834 1.00 71.04 H new ATOM 690 N ASP A 45 -18.788 -5.676 -11.311 1.00 30.23 N ATOM 691 CA ASP A 45 -17.724 -4.759 -11.657 1.00 61.23 C ATOM 692 C ASP A 45 -16.412 -5.260 -11.125 1.00 33.13 C ATOM 693 O ASP A 45 -15.481 -4.488 -10.939 1.00 43.43 O ATOM 694 CB ASP A 45 -18.014 -3.337 -11.148 1.00 30.33 C ATOM 695 CG ASP A 45 -19.187 -2.687 -11.842 1.00 64.52 C ATOM 696 OD1 ASP A 45 -19.015 -2.182 -12.978 1.00 52.14 O ATOM 697 OD2 ASP A 45 -20.301 -2.662 -11.270 1.00 30.21 O ATOM 0 H ASP A 45 -19.004 -5.712 -10.315 1.00 30.23 H new ATOM 0 HA ASP A 45 -17.665 -4.709 -12.744 1.00 61.23 H new ATOM 0 HB2 ASP A 45 -18.209 -3.374 -10.076 1.00 30.33 H new ATOM 0 HB3 ASP A 45 -17.127 -2.719 -11.290 1.00 30.33 H new ATOM 702 N LEU A 46 -16.335 -6.577 -10.936 1.00 10.44 N ATOM 703 CA LEU A 46 -15.120 -7.271 -10.465 1.00 54.41 C ATOM 704 C LEU A 46 -13.880 -6.795 -11.269 1.00 52.40 C ATOM 705 O LEU A 46 -12.918 -6.319 -10.666 1.00 51.32 O ATOM 706 CB LEU A 46 -15.349 -8.821 -10.555 1.00 63.43 C ATOM 707 CG LEU A 46 -14.304 -9.817 -9.947 1.00 24.53 C ATOM 708 CD1 LEU A 46 -13.018 -9.872 -10.739 1.00 62.44 C ATOM 709 CD2 LEU A 46 -14.020 -9.507 -8.477 1.00 2.42 C ATOM 0 H LEU A 46 -17.120 -7.206 -11.106 1.00 10.44 H new ATOM 0 HA LEU A 46 -14.921 -7.025 -9.422 1.00 54.41 H new ATOM 0 HB2 LEU A 46 -16.308 -9.032 -10.081 1.00 63.43 H new ATOM 0 HB3 LEU A 46 -15.453 -9.070 -11.611 1.00 63.43 H new ATOM 0 HG LEU A 46 -14.759 -10.805 -10.008 1.00 24.53 H new ATOM 0 HD11 LEU A 46 -12.332 -10.578 -10.271 1.00 62.44 H new ATOM 0 HD12 LEU A 46 -13.232 -10.195 -11.758 1.00 62.44 H new ATOM 0 HD13 LEU A 46 -12.561 -8.883 -10.760 1.00 62.44 H new ATOM 0 HD21 LEU A 46 -13.291 -10.218 -8.089 1.00 2.42 H new ATOM 0 HD22 LEU A 46 -13.623 -8.496 -8.389 1.00 2.42 H new ATOM 0 HD23 LEU A 46 -14.944 -9.586 -7.904 1.00 2.42 H new ATOM 721 N PRO A 47 -13.899 -6.874 -12.650 1.00 54.41 N ATOM 722 CA PRO A 47 -12.793 -6.392 -13.500 1.00 52.21 C ATOM 723 C PRO A 47 -12.367 -4.953 -13.161 1.00 63.40 C ATOM 724 O PRO A 47 -11.173 -4.618 -13.188 1.00 13.32 O ATOM 725 CB PRO A 47 -13.399 -6.429 -14.928 1.00 44.32 C ATOM 726 CG PRO A 47 -14.866 -6.648 -14.722 1.00 43.34 C ATOM 727 CD PRO A 47 -14.965 -7.462 -13.492 1.00 12.02 C ATOM 0 HA PRO A 47 -11.897 -6.999 -13.371 1.00 52.21 H new ATOM 0 HB2 PRO A 47 -13.210 -5.497 -15.461 1.00 44.32 H new ATOM 0 HB3 PRO A 47 -12.960 -7.230 -15.522 1.00 44.32 H new ATOM 0 HG2 PRO A 47 -15.394 -5.701 -14.612 1.00 43.34 H new ATOM 0 HG3 PRO A 47 -15.311 -7.164 -15.573 1.00 43.34 H new ATOM 0 HD2 PRO A 47 -15.947 -7.379 -13.025 1.00 12.02 H new ATOM 0 HD3 PRO A 47 -14.794 -8.520 -13.688 1.00 12.02 H new ATOM 735 N SER A 48 -13.337 -4.131 -12.834 1.00 54.04 N ATOM 736 CA SER A 48 -13.098 -2.733 -12.549 1.00 21.15 C ATOM 737 C SER A 48 -12.554 -2.531 -11.135 1.00 72.01 C ATOM 738 O SER A 48 -11.646 -1.737 -10.919 1.00 11.23 O ATOM 739 CB SER A 48 -14.381 -1.932 -12.764 1.00 11.33 C ATOM 740 OG SER A 48 -14.869 -2.121 -14.090 1.00 14.20 O ATOM 0 H SER A 48 -14.315 -4.412 -12.758 1.00 54.04 H new ATOM 0 HA SER A 48 -12.336 -2.369 -13.238 1.00 21.15 H new ATOM 0 HB2 SER A 48 -15.137 -2.244 -12.044 1.00 11.33 H new ATOM 0 HB3 SER A 48 -14.190 -0.873 -12.587 1.00 11.33 H new ATOM 0 HG SER A 48 -15.692 -1.603 -14.213 1.00 14.20 H new ATOM 746 N LYS A 49 -13.090 -3.279 -10.184 1.00 20.40 N ATOM 747 CA LYS A 49 -12.711 -3.138 -8.783 1.00 13.22 C ATOM 748 C LYS A 49 -11.260 -3.512 -8.528 1.00 21.30 C ATOM 749 O LYS A 49 -10.594 -2.869 -7.723 1.00 4.11 O ATOM 750 CB LYS A 49 -13.691 -3.865 -7.859 1.00 72.24 C ATOM 751 CG LYS A 49 -15.084 -3.256 -7.918 1.00 25.20 C ATOM 752 CD LYS A 49 -16.087 -3.970 -7.039 1.00 52.41 C ATOM 753 CE LYS A 49 -17.445 -3.290 -7.150 1.00 72.41 C ATOM 754 NZ LYS A 49 -18.496 -3.973 -6.376 1.00 55.11 N ATOM 0 H LYS A 49 -13.795 -3.996 -10.357 1.00 20.40 H new ATOM 0 HA LYS A 49 -12.782 -2.078 -8.538 1.00 13.22 H new ATOM 0 HB2 LYS A 49 -13.742 -4.917 -8.140 1.00 72.24 H new ATOM 0 HB3 LYS A 49 -13.321 -3.826 -6.834 1.00 72.24 H new ATOM 0 HG2 LYS A 49 -15.028 -2.210 -7.618 1.00 25.20 H new ATOM 0 HG3 LYS A 49 -15.437 -3.274 -8.949 1.00 25.20 H new ATOM 0 HD2 LYS A 49 -16.168 -5.015 -7.338 1.00 52.41 H new ATOM 0 HD3 LYS A 49 -15.749 -3.960 -6.003 1.00 52.41 H new ATOM 0 HE2 LYS A 49 -17.359 -2.260 -6.805 1.00 72.41 H new ATOM 0 HE3 LYS A 49 -17.741 -3.251 -8.198 1.00 72.41 H new ATOM 0 HZ1 LYS A 49 -19.377 -3.993 -6.929 1.00 55.11 H new ATOM 0 HZ2 LYS A 49 -18.196 -4.947 -6.167 1.00 55.11 H new ATOM 0 HZ3 LYS A 49 -18.658 -3.462 -5.485 1.00 55.11 H new ATOM 768 N LEU A 50 -10.761 -4.532 -9.230 1.00 52.30 N ATOM 769 CA LEU A 50 -9.327 -4.880 -9.150 1.00 13.01 C ATOM 770 C LEU A 50 -8.470 -3.712 -9.591 1.00 62.12 C ATOM 771 O LEU A 50 -7.441 -3.418 -8.996 1.00 60.32 O ATOM 772 CB LEU A 50 -8.962 -6.101 -10.033 1.00 13.14 C ATOM 773 CG LEU A 50 -9.214 -7.520 -9.492 1.00 20.15 C ATOM 774 CD1 LEU A 50 -8.388 -7.772 -8.259 1.00 43.10 C ATOM 775 CD2 LEU A 50 -10.665 -7.771 -9.207 1.00 22.11 C ATOM 0 H LEU A 50 -11.310 -5.126 -9.851 1.00 52.30 H new ATOM 0 HA LEU A 50 -9.134 -5.130 -8.107 1.00 13.01 H new ATOM 0 HB2 LEU A 50 -9.511 -6.005 -10.970 1.00 13.14 H new ATOM 0 HB3 LEU A 50 -7.902 -6.026 -10.276 1.00 13.14 H new ATOM 0 HG LEU A 50 -8.911 -8.217 -10.273 1.00 20.15 H new ATOM 0 HD11 LEU A 50 -8.580 -8.780 -7.892 1.00 43.10 H new ATOM 0 HD12 LEU A 50 -7.330 -7.670 -8.502 1.00 43.10 H new ATOM 0 HD13 LEU A 50 -8.654 -7.048 -7.489 1.00 43.10 H new ATOM 0 HD21 LEU A 50 -10.791 -8.785 -8.828 1.00 22.11 H new ATOM 0 HD22 LEU A 50 -11.018 -7.058 -8.462 1.00 22.11 H new ATOM 0 HD23 LEU A 50 -11.242 -7.652 -10.124 1.00 22.11 H new ATOM 787 N GLU A 51 -8.933 -3.032 -10.606 1.00 32.41 N ATOM 788 CA GLU A 51 -8.190 -1.972 -11.227 1.00 2.14 C ATOM 789 C GLU A 51 -8.271 -0.694 -10.382 1.00 24.22 C ATOM 790 O GLU A 51 -7.283 0.037 -10.239 1.00 42.45 O ATOM 791 CB GLU A 51 -8.758 -1.733 -12.597 1.00 62.05 C ATOM 792 CG GLU A 51 -7.879 -0.924 -13.497 1.00 51.34 C ATOM 793 CD GLU A 51 -6.592 -1.620 -13.770 1.00 14.44 C ATOM 794 OE1 GLU A 51 -6.629 -2.772 -14.267 1.00 40.32 O ATOM 795 OE2 GLU A 51 -5.517 -1.035 -13.556 1.00 31.10 O ATOM 0 H GLU A 51 -9.846 -3.201 -11.028 1.00 32.41 H new ATOM 0 HA GLU A 51 -7.140 -2.253 -11.306 1.00 2.14 H new ATOM 0 HB2 GLU A 51 -8.953 -2.696 -13.069 1.00 62.05 H new ATOM 0 HB3 GLU A 51 -9.718 -1.227 -12.496 1.00 62.05 H new ATOM 0 HG2 GLU A 51 -8.397 -0.732 -14.437 1.00 51.34 H new ATOM 0 HG3 GLU A 51 -7.680 0.045 -13.039 1.00 51.34 H new ATOM 802 N GLY A 52 -9.453 -0.432 -9.829 1.00 31.11 N ATOM 803 CA GLY A 52 -9.628 0.697 -8.937 1.00 63.55 C ATOM 804 C GLY A 52 -8.756 0.530 -7.718 1.00 34.35 C ATOM 805 O GLY A 52 -8.085 1.470 -7.282 1.00 74.43 O ATOM 0 H GLY A 52 -10.295 -0.986 -9.985 1.00 31.11 H new ATOM 0 HA2 GLY A 52 -9.372 1.622 -9.453 1.00 63.55 H new ATOM 0 HA3 GLY A 52 -10.673 0.777 -8.639 1.00 63.55 H new ATOM 809 N PHE A 53 -8.753 -0.687 -7.190 1.00 61.30 N ATOM 810 CA PHE A 53 -7.900 -1.065 -6.085 1.00 13.15 C ATOM 811 C PHE A 53 -6.432 -0.896 -6.454 1.00 41.13 C ATOM 812 O PHE A 53 -5.673 -0.364 -5.697 1.00 33.14 O ATOM 813 CB PHE A 53 -8.194 -2.512 -5.657 1.00 30.34 C ATOM 814 CG PHE A 53 -7.164 -3.098 -4.740 1.00 72.21 C ATOM 815 CD1 PHE A 53 -7.009 -2.636 -3.451 1.00 62.12 C ATOM 816 CD2 PHE A 53 -6.341 -4.117 -5.184 1.00 43.12 C ATOM 817 CE1 PHE A 53 -6.052 -3.177 -2.628 1.00 15.25 C ATOM 818 CE2 PHE A 53 -5.387 -4.662 -4.362 1.00 45.12 C ATOM 819 CZ PHE A 53 -5.238 -4.192 -3.085 1.00 54.02 C ATOM 0 H PHE A 53 -9.351 -1.443 -7.524 1.00 61.30 H new ATOM 0 HA PHE A 53 -8.112 -0.407 -5.242 1.00 13.15 H new ATOM 0 HB2 PHE A 53 -9.165 -2.544 -5.163 1.00 30.34 H new ATOM 0 HB3 PHE A 53 -8.269 -3.135 -6.548 1.00 30.34 H new ATOM 0 HD1 PHE A 53 -7.645 -1.843 -3.086 1.00 62.12 H new ATOM 0 HD2 PHE A 53 -6.451 -4.489 -6.192 1.00 43.12 H new ATOM 0 HE1 PHE A 53 -5.937 -2.807 -1.620 1.00 15.25 H new ATOM 0 HE2 PHE A 53 -4.755 -5.460 -4.722 1.00 45.12 H new ATOM 0 HZ PHE A 53 -4.485 -4.615 -2.437 1.00 54.02 H new ATOM 829 N LYS A 54 -6.083 -1.342 -7.624 1.00 1.14 N ATOM 830 CA LYS A 54 -4.727 -1.271 -8.166 1.00 22.20 C ATOM 831 C LYS A 54 -4.148 0.136 -8.146 1.00 2.51 C ATOM 832 O LYS A 54 -3.038 0.352 -7.649 1.00 53.40 O ATOM 833 CB LYS A 54 -4.817 -1.822 -9.597 1.00 53.31 C ATOM 834 CG LYS A 54 -3.561 -1.858 -10.482 1.00 62.53 C ATOM 835 CD LYS A 54 -3.181 -0.496 -11.051 1.00 43.20 C ATOM 836 CE LYS A 54 -2.048 -0.613 -12.047 1.00 11.54 C ATOM 837 NZ LYS A 54 -2.434 -1.421 -13.234 1.00 41.01 N ATOM 0 H LYS A 54 -6.745 -1.783 -8.262 1.00 1.14 H new ATOM 0 HA LYS A 54 -4.044 -1.854 -7.548 1.00 22.20 H new ATOM 0 HB2 LYS A 54 -5.197 -2.842 -9.530 1.00 53.31 H new ATOM 0 HB3 LYS A 54 -5.570 -1.236 -10.124 1.00 53.31 H new ATOM 0 HG2 LYS A 54 -2.726 -2.245 -9.899 1.00 62.53 H new ATOM 0 HG3 LYS A 54 -3.725 -2.554 -11.305 1.00 62.53 H new ATOM 0 HD2 LYS A 54 -4.048 -0.047 -11.535 1.00 43.20 H new ATOM 0 HD3 LYS A 54 -2.888 0.170 -10.240 1.00 43.20 H new ATOM 0 HE2 LYS A 54 -1.744 0.383 -12.369 1.00 11.54 H new ATOM 0 HE3 LYS A 54 -1.185 -1.069 -11.563 1.00 11.54 H new ATOM 0 HZ1 LYS A 54 -1.771 -1.233 -14.013 1.00 41.01 H new ATOM 0 HZ2 LYS A 54 -2.404 -2.432 -12.991 1.00 41.01 H new ATOM 0 HZ3 LYS A 54 -3.397 -1.165 -13.530 1.00 41.01 H new ATOM 851 N GLU A 55 -4.895 1.076 -8.647 1.00 44.30 N ATOM 852 CA GLU A 55 -4.419 2.435 -8.780 1.00 44.14 C ATOM 853 C GLU A 55 -4.431 3.105 -7.400 1.00 33.45 C ATOM 854 O GLU A 55 -3.585 3.931 -7.090 1.00 60.31 O ATOM 855 CB GLU A 55 -5.316 3.139 -9.830 1.00 71.25 C ATOM 856 CG GLU A 55 -4.832 4.474 -10.432 1.00 30.11 C ATOM 857 CD GLU A 55 -4.955 5.685 -9.554 1.00 50.44 C ATOM 858 OE1 GLU A 55 -6.103 6.065 -9.195 1.00 13.14 O ATOM 859 OE2 GLU A 55 -3.927 6.340 -9.292 1.00 5.14 O ATOM 0 H GLU A 55 -5.849 0.930 -8.976 1.00 44.30 H new ATOM 0 HA GLU A 55 -3.389 2.490 -9.133 1.00 44.14 H new ATOM 0 HB2 GLU A 55 -5.474 2.442 -10.653 1.00 71.25 H new ATOM 0 HB3 GLU A 55 -6.289 3.315 -9.371 1.00 71.25 H new ATOM 0 HG2 GLU A 55 -3.785 4.362 -10.715 1.00 30.11 H new ATOM 0 HG3 GLU A 55 -5.392 4.658 -11.349 1.00 30.11 H new ATOM 866 N LYS A 56 -5.362 2.688 -6.569 1.00 61.20 N ATOM 867 CA LYS A 56 -5.497 3.229 -5.236 1.00 11.31 C ATOM 868 C LYS A 56 -4.423 2.626 -4.297 1.00 1.10 C ATOM 869 O LYS A 56 -3.850 3.334 -3.493 1.00 43.44 O ATOM 870 CB LYS A 56 -6.911 2.947 -4.724 1.00 22.35 C ATOM 871 CG LYS A 56 -7.471 3.963 -3.727 1.00 43.33 C ATOM 872 CD LYS A 56 -6.682 4.061 -2.443 1.00 53.40 C ATOM 873 CE LYS A 56 -7.248 5.143 -1.555 1.00 40.10 C ATOM 874 NZ LYS A 56 -7.208 6.471 -2.213 1.00 74.11 N ATOM 0 H LYS A 56 -6.045 1.966 -6.799 1.00 61.20 H new ATOM 0 HA LYS A 56 -5.341 4.308 -5.257 1.00 11.31 H new ATOM 0 HB2 LYS A 56 -7.584 2.897 -5.580 1.00 22.35 H new ATOM 0 HB3 LYS A 56 -6.918 1.963 -4.255 1.00 22.35 H new ATOM 0 HG2 LYS A 56 -7.499 4.944 -4.201 1.00 43.33 H new ATOM 0 HG3 LYS A 56 -8.500 3.695 -3.490 1.00 43.33 H new ATOM 0 HD2 LYS A 56 -6.706 3.105 -1.921 1.00 53.40 H new ATOM 0 HD3 LYS A 56 -5.637 4.276 -2.667 1.00 53.40 H new ATOM 0 HE2 LYS A 56 -8.277 4.898 -1.294 1.00 40.10 H new ATOM 0 HE3 LYS A 56 -6.683 5.181 -0.624 1.00 40.10 H new ATOM 0 HZ1 LYS A 56 -7.460 7.208 -1.524 1.00 74.11 H new ATOM 0 HZ2 LYS A 56 -6.250 6.650 -2.576 1.00 74.11 H new ATOM 0 HZ3 LYS A 56 -7.886 6.488 -3.002 1.00 74.11 H new ATOM 888 N TYR A 57 -4.145 1.323 -4.429 1.00 14.21 N ATOM 889 CA TYR A 57 -3.170 0.633 -3.595 1.00 34.25 C ATOM 890 C TYR A 57 -1.797 1.188 -3.876 1.00 2.41 C ATOM 891 O TYR A 57 -0.962 1.325 -2.990 1.00 30.25 O ATOM 892 CB TYR A 57 -3.212 -0.873 -3.909 1.00 72.34 C ATOM 893 CG TYR A 57 -2.216 -1.724 -3.158 1.00 41.41 C ATOM 894 CD1 TYR A 57 -0.936 -1.913 -3.653 1.00 35.41 C ATOM 895 CD2 TYR A 57 -2.556 -2.354 -1.972 1.00 61.54 C ATOM 896 CE1 TYR A 57 -0.029 -2.691 -2.994 1.00 34.44 C ATOM 897 CE2 TYR A 57 -1.646 -3.144 -1.304 1.00 33.23 C ATOM 898 CZ TYR A 57 -0.381 -3.305 -1.824 1.00 32.43 C ATOM 899 OH TYR A 57 0.531 -4.091 -1.176 1.00 32.10 O ATOM 0 H TYR A 57 -4.594 0.722 -5.120 1.00 14.21 H new ATOM 0 HA TYR A 57 -3.405 0.783 -2.541 1.00 34.25 H new ATOM 0 HB2 TYR A 57 -4.214 -1.243 -3.694 1.00 72.34 H new ATOM 0 HB3 TYR A 57 -3.045 -1.008 -4.978 1.00 72.34 H new ATOM 0 HD1 TYR A 57 -0.650 -1.435 -4.579 1.00 35.41 H new ATOM 0 HD2 TYR A 57 -3.548 -2.224 -1.565 1.00 61.54 H new ATOM 0 HE1 TYR A 57 0.965 -2.822 -3.396 1.00 34.44 H new ATOM 0 HE2 TYR A 57 -1.922 -3.632 -0.381 1.00 33.23 H new ATOM 0 HH TYR A 57 1.429 -3.718 -1.298 1.00 32.10 H new ATOM 909 N MET A 58 -1.595 1.528 -5.112 1.00 61.44 N ATOM 910 CA MET A 58 -0.361 2.078 -5.567 1.00 14.03 C ATOM 911 C MET A 58 -0.150 3.511 -5.003 1.00 10.45 C ATOM 912 O MET A 58 0.980 3.998 -4.931 1.00 41.54 O ATOM 913 CB MET A 58 -0.302 1.945 -7.122 1.00 13.11 C ATOM 914 CG MET A 58 0.889 2.550 -7.883 1.00 44.40 C ATOM 915 SD MET A 58 0.981 4.346 -7.815 1.00 42.10 S ATOM 916 CE MET A 58 -0.680 4.749 -8.296 1.00 0.02 C ATOM 0 H MET A 58 -2.298 1.428 -5.844 1.00 61.44 H new ATOM 0 HA MET A 58 0.493 1.522 -5.180 1.00 14.03 H new ATOM 0 HB2 MET A 58 -0.339 0.882 -7.362 1.00 13.11 H new ATOM 0 HB3 MET A 58 -1.210 2.394 -7.524 1.00 13.11 H new ATOM 0 HG2 MET A 58 1.812 2.136 -7.477 1.00 44.40 H new ATOM 0 HG3 MET A 58 0.832 2.241 -8.927 1.00 44.40 H new ATOM 0 HE1 MET A 58 -0.692 5.725 -8.780 1.00 0.02 H new ATOM 0 HE2 MET A 58 -1.051 3.995 -8.990 1.00 0.02 H new ATOM 0 HE3 MET A 58 -1.318 4.774 -7.413 1.00 0.02 H new ATOM 926 N GLU A 59 -1.249 4.162 -4.566 1.00 34.41 N ATOM 927 CA GLU A 59 -1.169 5.490 -3.941 1.00 30.30 C ATOM 928 C GLU A 59 -0.459 5.419 -2.592 1.00 11.24 C ATOM 929 O GLU A 59 0.172 6.396 -2.150 1.00 64.23 O ATOM 930 CB GLU A 59 -2.560 6.122 -3.786 1.00 13.52 C ATOM 931 CG GLU A 59 -2.546 7.456 -3.063 1.00 22.14 C ATOM 932 CD GLU A 59 -3.855 8.183 -3.105 1.00 54.15 C ATOM 933 OE1 GLU A 59 -4.869 7.676 -2.562 1.00 2.42 O ATOM 934 OE2 GLU A 59 -3.885 9.310 -3.652 1.00 72.43 O ATOM 0 H GLU A 59 -2.195 3.788 -4.636 1.00 34.41 H new ATOM 0 HA GLU A 59 -0.583 6.127 -4.603 1.00 30.30 H new ATOM 0 HB2 GLU A 59 -2.999 6.259 -4.774 1.00 13.52 H new ATOM 0 HB3 GLU A 59 -3.205 5.431 -3.243 1.00 13.52 H new ATOM 0 HG2 GLU A 59 -2.266 7.291 -2.022 1.00 22.14 H new ATOM 0 HG3 GLU A 59 -1.776 8.089 -3.504 1.00 22.14 H new ATOM 941 N PHE A 60 -0.546 4.270 -1.949 1.00 23.21 N ATOM 942 CA PHE A 60 0.102 4.060 -0.681 1.00 63.03 C ATOM 943 C PHE A 60 1.601 4.048 -0.893 1.00 3.13 C ATOM 944 O PHE A 60 2.077 3.806 -2.016 1.00 30.14 O ATOM 945 CB PHE A 60 -0.338 2.726 -0.062 1.00 35.14 C ATOM 946 CG PHE A 60 -1.812 2.612 0.296 1.00 41.01 C ATOM 947 CD1 PHE A 60 -2.779 2.517 -0.684 1.00 44.52 C ATOM 948 CD2 PHE A 60 -2.216 2.577 1.613 1.00 41.52 C ATOM 949 CE1 PHE A 60 -4.114 2.399 -0.361 1.00 45.12 C ATOM 950 CE2 PHE A 60 -3.553 2.459 1.942 1.00 21.31 C ATOM 951 CZ PHE A 60 -4.501 2.371 0.953 1.00 33.13 C ATOM 0 H PHE A 60 -1.067 3.463 -2.294 1.00 23.21 H new ATOM 0 HA PHE A 60 -0.177 4.865 -0.001 1.00 63.03 H new ATOM 0 HB2 PHE A 60 -0.091 1.925 -0.759 1.00 35.14 H new ATOM 0 HB3 PHE A 60 0.249 2.556 0.840 1.00 35.14 H new ATOM 0 HD1 PHE A 60 -2.485 2.535 -1.723 1.00 44.52 H new ATOM 0 HD2 PHE A 60 -1.478 2.643 2.399 1.00 41.52 H new ATOM 0 HE1 PHE A 60 -4.855 2.329 -1.144 1.00 45.12 H new ATOM 0 HE2 PHE A 60 -3.853 2.436 2.979 1.00 21.31 H new ATOM 0 HZ PHE A 60 -5.546 2.280 1.209 1.00 33.13 H new ATOM 961 N ASP A 61 2.345 4.342 0.144 1.00 4.22 N ATOM 962 CA ASP A 61 3.789 4.301 0.062 1.00 34.11 C ATOM 963 C ASP A 61 4.241 2.855 -0.049 1.00 70.13 C ATOM 964 O ASP A 61 4.335 2.136 0.956 1.00 52.42 O ATOM 965 CB ASP A 61 4.454 5.024 1.252 1.00 34.24 C ATOM 966 CG ASP A 61 4.160 6.517 1.275 1.00 15.44 C ATOM 967 OD1 ASP A 61 3.079 6.924 1.762 1.00 41.31 O ATOM 968 OD2 ASP A 61 5.011 7.312 0.797 1.00 51.32 O ATOM 0 H ASP A 61 1.977 4.613 1.056 1.00 4.22 H new ATOM 0 HA ASP A 61 4.108 4.839 -0.831 1.00 34.11 H new ATOM 0 HB2 ASP A 61 4.107 4.576 2.183 1.00 34.24 H new ATOM 0 HB3 ASP A 61 5.532 4.871 1.207 1.00 34.24 H new ATOM 973 N LEU A 62 4.453 2.434 -1.286 1.00 41.53 N ATOM 974 CA LEU A 62 4.796 1.066 -1.640 1.00 3.42 C ATOM 975 C LEU A 62 6.243 0.760 -1.298 1.00 33.11 C ATOM 976 O LEU A 62 7.154 1.534 -1.639 1.00 32.40 O ATOM 977 CB LEU A 62 4.597 0.851 -3.155 1.00 73.52 C ATOM 978 CG LEU A 62 3.196 1.165 -3.738 1.00 41.42 C ATOM 979 CD1 LEU A 62 3.225 1.169 -5.255 1.00 5.14 C ATOM 980 CD2 LEU A 62 2.218 0.122 -3.307 1.00 32.15 C ATOM 0 H LEU A 62 4.389 3.053 -2.094 1.00 41.53 H new ATOM 0 HA LEU A 62 4.145 0.402 -1.072 1.00 3.42 H new ATOM 0 HB2 LEU A 62 5.327 1.465 -3.682 1.00 73.52 H new ATOM 0 HB3 LEU A 62 4.832 -0.189 -3.382 1.00 73.52 H new ATOM 0 HG LEU A 62 2.902 2.149 -3.371 1.00 41.42 H new ATOM 0 HD11 LEU A 62 2.229 1.392 -5.637 1.00 5.14 H new ATOM 0 HD12 LEU A 62 3.926 1.928 -5.604 1.00 5.14 H new ATOM 0 HD13 LEU A 62 3.541 0.190 -5.615 1.00 5.14 H new ATOM 0 HD21 LEU A 62 1.236 0.351 -3.721 1.00 32.15 H new ATOM 0 HD22 LEU A 62 2.545 -0.854 -3.666 1.00 32.15 H new ATOM 0 HD23 LEU A 62 2.158 0.107 -2.219 1.00 32.15 H new ATOM 992 N ASN A 63 6.433 -0.349 -0.635 1.00 73.22 N ATOM 993 CA ASN A 63 7.749 -0.877 -0.273 1.00 55.24 C ATOM 994 C ASN A 63 8.399 -1.575 -1.470 1.00 21.55 C ATOM 995 O ASN A 63 7.915 -1.469 -2.600 1.00 24.31 O ATOM 996 CB ASN A 63 7.580 -1.893 0.841 1.00 71.14 C ATOM 997 CG ASN A 63 7.201 -1.328 2.185 1.00 12.23 C ATOM 998 OD1 ASN A 63 6.669 -0.230 2.303 1.00 11.14 O ATOM 999 ND2 ASN A 63 7.375 -2.124 3.188 1.00 64.43 N ATOM 0 H ASN A 63 5.663 -0.937 -0.316 1.00 73.22 H new ATOM 0 HA ASN A 63 8.383 -0.050 0.046 1.00 55.24 H new ATOM 0 HB2 ASN A 63 6.817 -2.611 0.541 1.00 71.14 H new ATOM 0 HB3 ASN A 63 8.513 -2.446 0.949 1.00 71.14 H new ATOM 0 HD21 ASN A 63 7.065 -1.846 4.119 1.00 64.43 H new ATOM 0 HD22 ASN A 63 7.822 -3.030 3.048 1.00 64.43 H new ATOM 1006 N GLY A 64 9.467 -2.328 -1.200 1.00 3.13 N ATOM 1007 CA GLY A 64 10.227 -3.001 -2.235 1.00 42.45 C ATOM 1008 C GLY A 64 9.431 -4.018 -3.045 1.00 45.12 C ATOM 1009 O GLY A 64 9.704 -4.214 -4.219 1.00 32.33 O ATOM 0 H GLY A 64 9.823 -2.483 -0.257 1.00 3.13 H new ATOM 0 HA2 GLY A 64 10.633 -2.252 -2.915 1.00 42.45 H new ATOM 0 HA3 GLY A 64 11.076 -3.507 -1.774 1.00 42.45 H new ATOM 1013 N ASN A 65 8.467 -4.672 -2.439 1.00 34.14 N ATOM 1014 CA ASN A 65 7.666 -5.656 -3.181 1.00 21.32 C ATOM 1015 C ASN A 65 6.327 -5.063 -3.513 1.00 62.30 C ATOM 1016 O ASN A 65 5.444 -5.741 -4.056 1.00 44.14 O ATOM 1017 CB ASN A 65 7.441 -6.942 -2.368 1.00 52.42 C ATOM 1018 CG ASN A 65 8.716 -7.621 -1.937 1.00 75.11 C ATOM 1019 OD1 ASN A 65 9.280 -8.447 -2.664 1.00 34.44 O ATOM 1020 ND2 ASN A 65 9.164 -7.314 -0.744 1.00 62.32 N ATOM 0 H ASN A 65 8.212 -4.555 -1.458 1.00 34.14 H new ATOM 0 HA ASN A 65 8.216 -5.911 -4.087 1.00 21.32 H new ATOM 0 HB2 ASN A 65 6.851 -6.703 -1.483 1.00 52.42 H new ATOM 0 HB3 ASN A 65 6.853 -7.639 -2.964 1.00 52.42 H new ATOM 0 HD21 ASN A 65 10.007 -7.762 -0.385 1.00 62.32 H new ATOM 0 HD22 ASN A 65 8.670 -6.627 -0.175 1.00 62.32 H new ATOM 1027 N GLY A 66 6.178 -3.792 -3.216 1.00 22.53 N ATOM 1028 CA GLY A 66 4.909 -3.156 -3.374 1.00 75.35 C ATOM 1029 C GLY A 66 4.053 -3.404 -2.178 1.00 23.52 C ATOM 1030 O GLY A 66 2.846 -3.306 -2.234 1.00 73.54 O ATOM 0 H GLY A 66 6.922 -3.188 -2.866 1.00 22.53 H new ATOM 0 HA2 GLY A 66 5.047 -2.084 -3.515 1.00 75.35 H new ATOM 0 HA3 GLY A 66 4.414 -3.534 -4.269 1.00 75.35 H new ATOM 1034 N ASP A 67 4.698 -3.709 -1.103 1.00 15.02 N ATOM 1035 CA ASP A 67 4.046 -4.052 0.143 1.00 12.45 C ATOM 1036 C ASP A 67 3.842 -2.814 0.995 1.00 44.22 C ATOM 1037 O ASP A 67 4.438 -1.776 0.720 1.00 44.02 O ATOM 1038 CB ASP A 67 4.813 -5.191 0.876 1.00 35.54 C ATOM 1039 CG ASP A 67 6.304 -4.929 1.072 1.00 54.13 C ATOM 1040 OD1 ASP A 67 7.065 -4.947 0.066 1.00 73.44 O ATOM 1041 OD2 ASP A 67 6.751 -4.748 2.210 1.00 62.44 O ATOM 0 H ASP A 67 5.716 -3.731 -1.051 1.00 15.02 H new ATOM 0 HA ASP A 67 3.052 -4.447 -0.068 1.00 12.45 H new ATOM 0 HB2 ASP A 67 4.354 -5.351 1.852 1.00 35.54 H new ATOM 0 HB3 ASP A 67 4.691 -6.115 0.311 1.00 35.54 H new ATOM 1046 N ILE A 68 2.975 -2.894 1.983 1.00 42.32 N ATOM 1047 CA ILE A 68 2.635 -1.731 2.798 1.00 71.15 C ATOM 1048 C ILE A 68 2.713 -2.098 4.289 1.00 71.34 C ATOM 1049 O ILE A 68 2.047 -3.041 4.738 1.00 15.13 O ATOM 1050 CB ILE A 68 1.180 -1.228 2.459 1.00 23.12 C ATOM 1051 CG1 ILE A 68 1.030 -0.953 0.943 1.00 71.21 C ATOM 1052 CG2 ILE A 68 0.851 0.042 3.247 1.00 73.22 C ATOM 1053 CD1 ILE A 68 -0.383 -0.593 0.505 1.00 53.04 C ATOM 0 H ILE A 68 2.489 -3.751 2.247 1.00 42.32 H new ATOM 0 HA ILE A 68 3.346 -0.935 2.579 1.00 71.15 H new ATOM 0 HB ILE A 68 0.482 -2.015 2.744 1.00 23.12 H new ATOM 0 HG12 ILE A 68 1.701 -0.140 0.666 1.00 71.21 H new ATOM 0 HG13 ILE A 68 1.354 -1.836 0.392 1.00 71.21 H new ATOM 0 HG21 ILE A 68 -0.157 0.373 2.999 1.00 73.22 H new ATOM 0 HG22 ILE A 68 0.912 -0.166 4.315 1.00 73.22 H new ATOM 0 HG23 ILE A 68 1.564 0.825 2.989 1.00 73.22 H new ATOM 0 HD11 ILE A 68 -0.397 -0.417 -0.571 1.00 53.04 H new ATOM 0 HD12 ILE A 68 -1.059 -1.413 0.747 1.00 53.04 H new ATOM 0 HD13 ILE A 68 -0.706 0.309 1.025 1.00 53.04 H new ATOM 1065 N ASP A 69 3.534 -1.376 5.051 1.00 71.51 N ATOM 1066 CA ASP A 69 3.665 -1.649 6.493 1.00 31.22 C ATOM 1067 C ASP A 69 2.636 -0.899 7.303 1.00 53.14 C ATOM 1068 O ASP A 69 1.972 0.021 6.806 1.00 54.44 O ATOM 1069 CB ASP A 69 5.036 -1.260 7.072 1.00 4.21 C ATOM 1070 CG ASP A 69 6.220 -1.940 6.460 1.00 3.32 C ATOM 1071 OD1 ASP A 69 6.485 -3.092 6.807 1.00 35.24 O ATOM 1072 OD2 ASP A 69 6.918 -1.310 5.648 1.00 22.44 O ATOM 0 H ASP A 69 4.112 -0.609 4.707 1.00 71.51 H new ATOM 0 HA ASP A 69 3.526 -2.727 6.569 1.00 31.22 H new ATOM 0 HB2 ASP A 69 5.163 -0.183 6.962 1.00 4.21 H new ATOM 0 HB3 ASP A 69 5.031 -1.473 8.141 1.00 4.21 H new ATOM 1077 N ILE A 70 2.545 -1.274 8.578 1.00 74.52 N ATOM 1078 CA ILE A 70 1.711 -0.597 9.571 1.00 62.23 C ATOM 1079 C ILE A 70 2.165 0.849 9.771 1.00 73.52 C ATOM 1080 O ILE A 70 1.392 1.699 10.170 1.00 3.24 O ATOM 1081 CB ILE A 70 1.632 -1.405 10.937 1.00 2.41 C ATOM 1082 CG1 ILE A 70 2.997 -1.743 11.548 1.00 52.51 C ATOM 1083 CG2 ILE A 70 0.800 -2.646 10.814 1.00 11.11 C ATOM 1084 CD1 ILE A 70 3.623 -0.621 12.295 1.00 13.43 C ATOM 0 H ILE A 70 3.057 -2.070 8.957 1.00 74.52 H new ATOM 0 HA ILE A 70 0.693 -0.565 9.183 1.00 62.23 H new ATOM 0 HB ILE A 70 1.142 -0.719 11.628 1.00 2.41 H new ATOM 0 HG12 ILE A 70 2.881 -2.593 12.220 1.00 52.51 H new ATOM 0 HG13 ILE A 70 3.672 -2.056 10.751 1.00 52.51 H new ATOM 0 HG21 ILE A 70 0.776 -3.164 11.773 1.00 11.11 H new ATOM 0 HG22 ILE A 70 -0.215 -2.376 10.522 1.00 11.11 H new ATOM 0 HG23 ILE A 70 1.233 -3.301 10.058 1.00 11.11 H new ATOM 0 HD11 ILE A 70 4.585 -0.942 12.695 1.00 13.43 H new ATOM 0 HD12 ILE A 70 3.773 0.224 11.623 1.00 13.43 H new ATOM 0 HD13 ILE A 70 2.971 -0.321 13.115 1.00 13.43 H new ATOM 1096 N MET A 71 3.436 1.111 9.461 1.00 33.22 N ATOM 1097 CA MET A 71 3.987 2.462 9.521 1.00 12.15 C ATOM 1098 C MET A 71 3.522 3.269 8.318 1.00 12.13 C ATOM 1099 O MET A 71 3.119 4.428 8.455 1.00 35.03 O ATOM 1100 CB MET A 71 5.527 2.439 9.585 1.00 33.54 C ATOM 1101 CG MET A 71 6.150 1.823 10.855 1.00 52.05 C ATOM 1102 SD MET A 71 6.108 2.874 12.367 1.00 42.12 S ATOM 1103 CE MET A 71 4.368 3.173 12.660 1.00 32.12 C ATOM 0 H MET A 71 4.104 0.400 9.165 1.00 33.22 H new ATOM 0 HA MET A 71 3.622 2.935 10.433 1.00 12.15 H new ATOM 0 HB2 MET A 71 5.897 1.888 8.721 1.00 33.54 H new ATOM 0 HB3 MET A 71 5.889 3.463 9.489 1.00 33.54 H new ATOM 0 HG2 MET A 71 5.633 0.888 11.072 1.00 52.05 H new ATOM 0 HG3 MET A 71 7.189 1.571 10.641 1.00 52.05 H new ATOM 0 HE1 MET A 71 4.208 3.386 13.717 1.00 32.12 H new ATOM 0 HE2 MET A 71 4.040 4.025 12.065 1.00 32.12 H new ATOM 0 HE3 MET A 71 3.794 2.290 12.377 1.00 32.12 H new ATOM 1113 N SER A 72 3.564 2.642 7.153 1.00 33.44 N ATOM 1114 CA SER A 72 3.145 3.263 5.906 1.00 72.25 C ATOM 1115 C SER A 72 1.659 3.591 5.951 1.00 72.25 C ATOM 1116 O SER A 72 1.258 4.728 5.711 1.00 52.51 O ATOM 1117 CB SER A 72 3.449 2.324 4.725 1.00 2.23 C ATOM 1118 OG SER A 72 3.032 2.873 3.488 1.00 53.23 O ATOM 0 H SER A 72 3.892 1.682 7.045 1.00 33.44 H new ATOM 0 HA SER A 72 3.699 4.192 5.771 1.00 72.25 H new ATOM 0 HB2 SER A 72 4.520 2.122 4.689 1.00 2.23 H new ATOM 0 HB3 SER A 72 2.949 1.368 4.884 1.00 2.23 H new ATOM 0 HG SER A 72 3.585 2.509 2.765 1.00 53.23 H new ATOM 1124 N LEU A 73 0.852 2.595 6.300 1.00 51.41 N ATOM 1125 CA LEU A 73 -0.590 2.759 6.358 1.00 41.14 C ATOM 1126 C LEU A 73 -0.959 3.829 7.393 1.00 15.53 C ATOM 1127 O LEU A 73 -1.855 4.621 7.167 1.00 62.52 O ATOM 1128 CB LEU A 73 -1.268 1.429 6.718 1.00 71.41 C ATOM 1129 CG LEU A 73 -2.802 1.427 6.664 1.00 40.32 C ATOM 1130 CD1 LEU A 73 -3.285 1.677 5.251 1.00 34.14 C ATOM 1131 CD2 LEU A 73 -3.374 0.133 7.203 1.00 43.10 C ATOM 0 H LEU A 73 1.178 1.661 6.548 1.00 51.41 H new ATOM 0 HA LEU A 73 -0.941 3.077 5.376 1.00 41.14 H new ATOM 0 HB2 LEU A 73 -0.898 0.659 6.041 1.00 71.41 H new ATOM 0 HB3 LEU A 73 -0.958 1.145 7.724 1.00 71.41 H new ATOM 0 HG LEU A 73 -3.158 2.236 7.301 1.00 40.32 H new ATOM 0 HD11 LEU A 73 -4.375 1.672 5.233 1.00 34.14 H new ATOM 0 HD12 LEU A 73 -2.921 2.645 4.908 1.00 34.14 H new ATOM 0 HD13 LEU A 73 -2.908 0.894 4.594 1.00 34.14 H new ATOM 0 HD21 LEU A 73 -4.462 0.166 7.150 1.00 43.10 H new ATOM 0 HD22 LEU A 73 -3.007 -0.703 6.608 1.00 43.10 H new ATOM 0 HD23 LEU A 73 -3.065 0.003 8.240 1.00 43.10 H new ATOM 1143 N LYS A 74 -0.236 3.853 8.515 1.00 43.22 N ATOM 1144 CA LYS A 74 -0.485 4.837 9.571 1.00 63.32 C ATOM 1145 C LYS A 74 -0.340 6.254 9.030 1.00 54.34 C ATOM 1146 O LYS A 74 -1.214 7.104 9.218 1.00 12.35 O ATOM 1147 CB LYS A 74 0.535 4.626 10.673 1.00 23.44 C ATOM 1148 CG LYS A 74 0.447 5.624 11.776 1.00 24.13 C ATOM 1149 CD LYS A 74 1.478 5.358 12.833 1.00 64.05 C ATOM 1150 CE LYS A 74 1.343 6.364 13.919 1.00 64.42 C ATOM 1151 NZ LYS A 74 1.740 7.725 13.509 1.00 3.35 N ATOM 0 H LYS A 74 0.525 3.204 8.716 1.00 43.22 H new ATOM 0 HA LYS A 74 -1.499 4.708 9.949 1.00 63.32 H new ATOM 0 HB2 LYS A 74 0.405 3.627 11.089 1.00 23.44 H new ATOM 0 HB3 LYS A 74 1.535 4.664 10.241 1.00 23.44 H new ATOM 0 HG2 LYS A 74 0.586 6.628 11.374 1.00 24.13 H new ATOM 0 HG3 LYS A 74 -0.548 5.593 12.219 1.00 24.13 H new ATOM 0 HD2 LYS A 74 1.351 4.353 13.235 1.00 64.05 H new ATOM 0 HD3 LYS A 74 2.478 5.405 12.401 1.00 64.05 H new ATOM 0 HE2 LYS A 74 0.308 6.383 14.260 1.00 64.42 H new ATOM 0 HE3 LYS A 74 1.953 6.056 14.768 1.00 64.42 H new ATOM 0 HZ1 LYS A 74 1.835 8.328 14.351 1.00 3.35 H new ATOM 0 HZ2 LYS A 74 2.650 7.685 13.008 1.00 3.35 H new ATOM 0 HZ3 LYS A 74 1.015 8.123 12.879 1.00 3.35 H new ATOM 1165 N ARG A 75 0.750 6.469 8.341 1.00 51.42 N ATOM 1166 CA ARG A 75 1.031 7.725 7.660 1.00 42.15 C ATOM 1167 C ARG A 75 -0.088 8.070 6.665 1.00 10.55 C ATOM 1168 O ARG A 75 -0.486 9.226 6.554 1.00 73.50 O ATOM 1169 CB ARG A 75 2.449 7.670 6.992 1.00 45.33 C ATOM 1170 CG ARG A 75 2.904 8.940 6.245 1.00 23.35 C ATOM 1171 CD ARG A 75 2.257 9.084 4.871 1.00 2.43 C ATOM 1172 NE ARG A 75 2.542 10.381 4.256 1.00 25.22 N ATOM 1173 CZ ARG A 75 2.640 10.598 2.946 1.00 45.34 C ATOM 1174 NH1 ARG A 75 2.706 9.576 2.089 1.00 71.40 N ATOM 1175 NH2 ARG A 75 2.714 11.843 2.488 1.00 10.30 N ATOM 0 H ARG A 75 1.485 5.771 8.230 1.00 51.42 H new ATOM 0 HA ARG A 75 1.052 8.535 8.389 1.00 42.15 H new ATOM 0 HB2 ARG A 75 3.183 7.447 7.766 1.00 45.33 H new ATOM 0 HB3 ARG A 75 2.464 6.837 6.290 1.00 45.33 H new ATOM 0 HG2 ARG A 75 2.664 9.816 6.848 1.00 23.35 H new ATOM 0 HG3 ARG A 75 3.988 8.919 6.130 1.00 23.35 H new ATOM 0 HD2 ARG A 75 2.615 8.288 4.218 1.00 2.43 H new ATOM 0 HD3 ARG A 75 1.178 8.958 4.965 1.00 2.43 H new ATOM 0 HE ARG A 75 2.676 11.179 4.878 1.00 25.22 H new ATOM 0 HH11 ARG A 75 2.681 8.617 2.436 1.00 71.40 H new ATOM 0 HH12 ARG A 75 2.781 9.754 1.087 1.00 71.40 H new ATOM 0 HH21 ARG A 75 2.696 12.628 3.139 1.00 10.30 H new ATOM 0 HH22 ARG A 75 2.789 12.014 1.485 1.00 10.30 H new ATOM 1189 N MET A 76 -0.596 7.063 5.972 1.00 71.50 N ATOM 1190 CA MET A 76 -1.672 7.235 5.007 1.00 12.24 C ATOM 1191 C MET A 76 -2.912 7.787 5.686 1.00 31.54 C ATOM 1192 O MET A 76 -3.427 8.814 5.278 1.00 35.41 O ATOM 1193 CB MET A 76 -1.984 5.907 4.319 1.00 53.30 C ATOM 1194 CG MET A 76 -0.833 5.360 3.485 1.00 14.31 C ATOM 1195 SD MET A 76 -0.482 6.341 2.014 1.00 60.21 S ATOM 1196 CE MET A 76 -2.025 6.120 1.140 1.00 12.42 C ATOM 0 H MET A 76 -0.273 6.100 6.063 1.00 71.50 H new ATOM 0 HA MET A 76 -1.349 7.950 4.250 1.00 12.24 H new ATOM 0 HB2 MET A 76 -2.253 5.171 5.076 1.00 53.30 H new ATOM 0 HB3 MET A 76 -2.855 6.037 3.677 1.00 53.30 H new ATOM 0 HG2 MET A 76 0.063 5.313 4.103 1.00 14.31 H new ATOM 0 HG3 MET A 76 -1.066 4.339 3.184 1.00 14.31 H new ATOM 0 HE1 MET A 76 -1.821 5.849 0.104 1.00 12.42 H new ATOM 0 HE2 MET A 76 -2.602 5.327 1.615 1.00 12.42 H new ATOM 0 HE3 MET A 76 -2.595 7.049 1.167 1.00 12.42 H new ATOM 1206 N LEU A 77 -3.367 7.118 6.746 1.00 72.01 N ATOM 1207 CA LEU A 77 -4.534 7.576 7.511 1.00 70.40 C ATOM 1208 C LEU A 77 -4.336 8.989 8.056 1.00 61.03 C ATOM 1209 O LEU A 77 -5.253 9.814 7.988 1.00 61.42 O ATOM 1210 CB LEU A 77 -4.938 6.584 8.635 1.00 0.05 C ATOM 1211 CG LEU A 77 -5.690 5.281 8.224 1.00 72.31 C ATOM 1212 CD1 LEU A 77 -6.999 5.594 7.524 1.00 52.33 C ATOM 1213 CD2 LEU A 77 -4.850 4.379 7.360 1.00 53.33 C ATOM 0 H LEU A 77 -2.947 6.257 7.097 1.00 72.01 H new ATOM 0 HA LEU A 77 -5.367 7.608 6.809 1.00 70.40 H new ATOM 0 HB2 LEU A 77 -4.032 6.293 9.166 1.00 0.05 H new ATOM 0 HB3 LEU A 77 -5.565 7.122 9.346 1.00 0.05 H new ATOM 0 HG LEU A 77 -5.903 4.749 9.151 1.00 72.31 H new ATOM 0 HD11 LEU A 77 -7.497 4.664 7.251 1.00 52.33 H new ATOM 0 HD12 LEU A 77 -7.641 6.167 8.193 1.00 52.33 H new ATOM 0 HD13 LEU A 77 -6.800 6.176 6.624 1.00 52.33 H new ATOM 0 HD21 LEU A 77 -5.421 3.487 7.102 1.00 53.33 H new ATOM 0 HD22 LEU A 77 -4.570 4.906 6.448 1.00 53.33 H new ATOM 0 HD23 LEU A 77 -3.950 4.090 7.903 1.00 53.33 H new ATOM 1225 N GLU A 78 -3.139 9.283 8.557 1.00 64.53 N ATOM 1226 CA GLU A 78 -2.831 10.626 9.046 1.00 63.31 C ATOM 1227 C GLU A 78 -2.921 11.650 7.918 1.00 51.04 C ATOM 1228 O GLU A 78 -3.518 12.709 8.081 1.00 65.54 O ATOM 1229 CB GLU A 78 -1.459 10.690 9.694 1.00 71.23 C ATOM 1230 CG GLU A 78 -1.316 9.850 10.943 1.00 5.01 C ATOM 1231 CD GLU A 78 0.035 10.021 11.569 1.00 14.45 C ATOM 1232 OE1 GLU A 78 0.276 11.071 12.209 1.00 63.05 O ATOM 1233 OE2 GLU A 78 0.884 9.124 11.451 1.00 74.13 O ATOM 0 H GLU A 78 -2.371 8.616 8.635 1.00 64.53 H new ATOM 0 HA GLU A 78 -3.575 10.867 9.805 1.00 63.31 H new ATOM 0 HB2 GLU A 78 -0.713 10.368 8.968 1.00 71.23 H new ATOM 0 HB3 GLU A 78 -1.236 11.728 9.942 1.00 71.23 H new ATOM 0 HG2 GLU A 78 -2.088 10.128 11.660 1.00 5.01 H new ATOM 0 HG3 GLU A 78 -1.474 8.800 10.696 1.00 5.01 H new ATOM 1240 N LYS A 79 -2.344 11.304 6.775 1.00 4.32 N ATOM 1241 CA LYS A 79 -2.373 12.133 5.562 1.00 71.14 C ATOM 1242 C LYS A 79 -3.824 12.409 5.149 1.00 45.45 C ATOM 1243 O LYS A 79 -4.164 13.499 4.689 1.00 55.11 O ATOM 1244 CB LYS A 79 -1.647 11.379 4.434 1.00 32.22 C ATOM 1245 CG LYS A 79 -1.627 12.072 3.083 1.00 45.02 C ATOM 1246 CD LYS A 79 -1.011 11.162 2.029 1.00 64.31 C ATOM 1247 CE LYS A 79 -1.042 11.793 0.647 1.00 55.35 C ATOM 1248 NZ LYS A 79 -0.544 10.859 -0.395 1.00 75.22 N ATOM 0 H LYS A 79 -1.834 10.429 6.655 1.00 4.32 H new ATOM 0 HA LYS A 79 -1.878 13.085 5.755 1.00 71.14 H new ATOM 0 HB2 LYS A 79 -0.618 11.201 4.745 1.00 32.22 H new ATOM 0 HB3 LYS A 79 -2.117 10.403 4.314 1.00 32.22 H new ATOM 0 HG2 LYS A 79 -2.642 12.343 2.791 1.00 45.02 H new ATOM 0 HG3 LYS A 79 -1.057 12.999 3.151 1.00 45.02 H new ATOM 0 HD2 LYS A 79 0.020 10.936 2.302 1.00 64.31 H new ATOM 0 HD3 LYS A 79 -1.550 10.215 2.008 1.00 64.31 H new ATOM 0 HE2 LYS A 79 -2.062 12.095 0.408 1.00 55.35 H new ATOM 0 HE3 LYS A 79 -0.433 12.697 0.646 1.00 55.35 H new ATOM 0 HZ1 LYS A 79 -0.580 11.324 -1.324 1.00 75.22 H new ATOM 0 HZ2 LYS A 79 0.437 10.591 -0.180 1.00 75.22 H new ATOM 0 HZ3 LYS A 79 -1.140 10.007 -0.411 1.00 75.22 H new ATOM 1262 N LEU A 80 -4.660 11.413 5.345 1.00 23.33 N ATOM 1263 CA LEU A 80 -6.074 11.476 5.010 1.00 44.23 C ATOM 1264 C LEU A 80 -6.870 12.287 6.035 1.00 33.04 C ATOM 1265 O LEU A 80 -8.049 12.589 5.825 1.00 51.54 O ATOM 1266 CB LEU A 80 -6.629 10.065 4.905 1.00 61.41 C ATOM 1267 CG LEU A 80 -5.976 9.194 3.840 1.00 63.25 C ATOM 1268 CD1 LEU A 80 -6.501 7.787 3.908 1.00 54.21 C ATOM 1269 CD2 LEU A 80 -6.190 9.785 2.456 1.00 42.44 C ATOM 0 H LEU A 80 -4.376 10.520 5.748 1.00 23.33 H new ATOM 0 HA LEU A 80 -6.174 11.985 4.052 1.00 44.23 H new ATOM 0 HB2 LEU A 80 -6.519 9.574 5.872 1.00 61.41 H new ATOM 0 HB3 LEU A 80 -7.698 10.125 4.698 1.00 61.41 H new ATOM 0 HG LEU A 80 -4.904 9.165 4.034 1.00 63.25 H new ATOM 0 HD11 LEU A 80 -6.021 7.182 3.139 1.00 54.21 H new ATOM 0 HD12 LEU A 80 -6.284 7.365 4.889 1.00 54.21 H new ATOM 0 HD13 LEU A 80 -7.579 7.793 3.746 1.00 54.21 H new ATOM 0 HD21 LEU A 80 -5.715 9.147 1.711 1.00 42.44 H new ATOM 0 HD22 LEU A 80 -7.258 9.851 2.250 1.00 42.44 H new ATOM 0 HD23 LEU A 80 -5.750 10.781 2.414 1.00 42.44 H new ATOM 1281 N GLY A 81 -6.236 12.628 7.135 1.00 33.23 N ATOM 1282 CA GLY A 81 -6.885 13.426 8.146 1.00 60.24 C ATOM 1283 C GLY A 81 -7.632 12.585 9.149 1.00 43.33 C ATOM 1284 O GLY A 81 -8.358 13.101 9.990 1.00 1.34 O ATOM 0 H GLY A 81 -5.274 12.365 7.350 1.00 33.23 H new ATOM 0 HA2 GLY A 81 -6.139 14.028 8.665 1.00 60.24 H new ATOM 0 HA3 GLY A 81 -7.578 14.119 7.669 1.00 60.24 H new ATOM 1288 N VAL A 82 -7.452 11.295 9.064 1.00 65.10 N ATOM 1289 CA VAL A 82 -8.092 10.366 9.956 1.00 50.44 C ATOM 1290 C VAL A 82 -7.061 9.582 10.764 1.00 51.41 C ATOM 1291 O VAL A 82 -6.595 8.534 10.350 1.00 31.13 O ATOM 1292 CB VAL A 82 -9.098 9.414 9.227 1.00 73.23 C ATOM 1293 CG1 VAL A 82 -10.365 10.165 8.859 1.00 72.32 C ATOM 1294 CG2 VAL A 82 -8.482 8.850 7.951 1.00 70.31 C ATOM 0 H VAL A 82 -6.851 10.855 8.367 1.00 65.10 H new ATOM 0 HA VAL A 82 -8.687 10.959 10.650 1.00 50.44 H new ATOM 0 HB VAL A 82 -9.334 8.598 9.910 1.00 73.23 H new ATOM 0 HG11 VAL A 82 -11.054 9.489 8.353 1.00 72.32 H new ATOM 0 HG12 VAL A 82 -10.834 10.552 9.764 1.00 72.32 H new ATOM 0 HG13 VAL A 82 -10.117 10.994 8.196 1.00 72.32 H new ATOM 0 HG21 VAL A 82 -9.199 8.191 7.461 1.00 70.31 H new ATOM 0 HG22 VAL A 82 -8.223 9.668 7.279 1.00 70.31 H new ATOM 0 HG23 VAL A 82 -7.583 8.287 8.199 1.00 70.31 H new ATOM 1304 N PRO A 83 -6.658 10.109 11.919 1.00 34.52 N ATOM 1305 CA PRO A 83 -5.634 9.485 12.726 1.00 24.22 C ATOM 1306 C PRO A 83 -6.123 8.237 13.451 1.00 53.43 C ATOM 1307 O PRO A 83 -6.989 8.297 14.337 1.00 32.11 O ATOM 1308 CB PRO A 83 -5.247 10.573 13.723 1.00 30.20 C ATOM 1309 CG PRO A 83 -6.471 11.407 13.865 1.00 54.11 C ATOM 1310 CD PRO A 83 -7.168 11.355 12.533 1.00 41.13 C ATOM 0 HA PRO A 83 -4.802 9.136 12.114 1.00 24.22 H new ATOM 0 HB2 PRO A 83 -4.946 10.145 14.679 1.00 30.20 H new ATOM 0 HB3 PRO A 83 -4.406 11.163 13.359 1.00 30.20 H new ATOM 0 HG2 PRO A 83 -7.114 11.023 14.657 1.00 54.11 H new ATOM 0 HG3 PRO A 83 -6.215 12.433 14.131 1.00 54.11 H new ATOM 0 HD2 PRO A 83 -8.252 11.330 12.649 1.00 41.13 H new ATOM 0 HD3 PRO A 83 -6.933 12.227 11.923 1.00 41.13 H new ATOM 1318 N LYS A 84 -5.600 7.119 13.044 1.00 10.30 N ATOM 1319 CA LYS A 84 -5.849 5.856 13.698 1.00 32.41 C ATOM 1320 C LYS A 84 -4.748 5.600 14.702 1.00 1.42 C ATOM 1321 O LYS A 84 -3.654 6.179 14.593 1.00 12.22 O ATOM 1322 CB LYS A 84 -5.944 4.695 12.678 1.00 75.04 C ATOM 1323 CG LYS A 84 -7.310 4.508 11.983 1.00 62.23 C ATOM 1324 CD LYS A 84 -7.832 5.768 11.313 1.00 74.43 C ATOM 1325 CE LYS A 84 -9.131 5.501 10.563 1.00 25.30 C ATOM 1326 NZ LYS A 84 -10.177 4.911 11.429 1.00 0.35 N ATOM 0 H LYS A 84 -4.979 7.051 12.238 1.00 10.30 H new ATOM 0 HA LYS A 84 -6.810 5.907 14.210 1.00 32.41 H new ATOM 0 HB2 LYS A 84 -5.187 4.852 11.909 1.00 75.04 H new ATOM 0 HB3 LYS A 84 -5.691 3.767 13.191 1.00 75.04 H new ATOM 0 HG2 LYS A 84 -7.223 3.719 11.236 1.00 62.23 H new ATOM 0 HG3 LYS A 84 -8.039 4.170 12.719 1.00 62.23 H new ATOM 0 HD2 LYS A 84 -7.996 6.540 12.064 1.00 74.43 H new ATOM 0 HD3 LYS A 84 -7.082 6.151 10.621 1.00 74.43 H new ATOM 0 HE2 LYS A 84 -9.500 6.435 10.139 1.00 25.30 H new ATOM 0 HE3 LYS A 84 -8.933 4.828 9.729 1.00 25.30 H new ATOM 0 HZ1 LYS A 84 -11.085 4.906 10.922 1.00 0.35 H new ATOM 0 HZ2 LYS A 84 -9.913 3.936 11.677 1.00 0.35 H new ATOM 0 HZ3 LYS A 84 -10.269 5.476 12.297 1.00 0.35 H new ATOM 1340 N THR A 85 -5.016 4.768 15.664 1.00 75.11 N ATOM 1341 CA THR A 85 -4.042 4.486 16.697 1.00 35.30 C ATOM 1342 C THR A 85 -3.019 3.442 16.241 1.00 65.54 C ATOM 1343 O THR A 85 -3.334 2.573 15.440 1.00 63.44 O ATOM 1344 CB THR A 85 -4.723 4.100 18.031 1.00 3.11 C ATOM 1345 OG1 THR A 85 -5.683 3.060 17.820 1.00 32.03 O ATOM 1346 CG2 THR A 85 -5.426 5.293 18.609 1.00 75.40 C ATOM 0 H THR A 85 -5.900 4.268 15.762 1.00 75.11 H new ATOM 0 HA THR A 85 -3.487 5.405 16.883 1.00 35.30 H new ATOM 0 HB THR A 85 -3.953 3.750 18.719 1.00 3.11 H new ATOM 0 HG1 THR A 85 -6.104 2.826 18.673 1.00 32.03 H new ATOM 0 HG21 THR A 85 -5.903 5.014 19.548 1.00 75.40 H new ATOM 0 HG22 THR A 85 -4.703 6.088 18.791 1.00 75.40 H new ATOM 0 HG23 THR A 85 -6.183 5.644 17.908 1.00 75.40 H new ATOM 1354 N HIS A 86 -1.809 3.534 16.766 1.00 24.30 N ATOM 1355 CA HIS A 86 -0.675 2.697 16.350 1.00 3.14 C ATOM 1356 C HIS A 86 -0.971 1.193 16.456 1.00 70.14 C ATOM 1357 O HIS A 86 -0.590 0.420 15.575 1.00 40.11 O ATOM 1358 CB HIS A 86 0.587 3.090 17.142 1.00 74.13 C ATOM 1359 CG HIS A 86 1.832 2.338 16.773 1.00 14.01 C ATOM 1360 ND1 HIS A 86 2.676 1.798 17.702 1.00 73.24 N ATOM 1361 CD2 HIS A 86 2.397 2.087 15.567 1.00 22.34 C ATOM 1362 CE1 HIS A 86 3.703 1.256 17.099 1.00 41.32 C ATOM 1363 NE2 HIS A 86 3.559 1.413 15.805 1.00 35.33 N ATOM 0 H HIS A 86 -1.574 4.198 17.504 1.00 24.30 H new ATOM 0 HA HIS A 86 -0.497 2.886 15.291 1.00 3.14 H new ATOM 0 HB2 HIS A 86 0.769 4.155 16.999 1.00 74.13 H new ATOM 0 HB3 HIS A 86 0.392 2.939 18.204 1.00 74.13 H new ATOM 0 HD2 HIS A 86 2.003 2.367 14.601 1.00 22.34 H new ATOM 0 HE1 HIS A 86 4.531 0.762 17.586 1.00 41.32 H new ATOM 0 HE2 HIS A 86 4.210 1.084 15.092 1.00 35.33 H new ATOM 1372 N LEU A 87 -1.645 0.794 17.513 1.00 50.50 N ATOM 1373 CA LEU A 87 -2.024 -0.602 17.687 1.00 55.41 C ATOM 1374 C LEU A 87 -3.161 -0.965 16.751 1.00 22.01 C ATOM 1375 O LEU A 87 -3.260 -2.089 16.287 1.00 32.41 O ATOM 1376 CB LEU A 87 -2.411 -0.900 19.138 1.00 4.45 C ATOM 1377 CG LEU A 87 -1.304 -0.742 20.182 1.00 12.11 C ATOM 1378 CD1 LEU A 87 -1.842 -1.042 21.569 1.00 72.55 C ATOM 1379 CD2 LEU A 87 -0.131 -1.659 19.860 1.00 71.20 C ATOM 0 H LEU A 87 -1.944 1.412 18.267 1.00 50.50 H new ATOM 0 HA LEU A 87 -1.157 -1.214 17.440 1.00 55.41 H new ATOM 0 HB2 LEU A 87 -3.237 -0.244 19.413 1.00 4.45 H new ATOM 0 HB3 LEU A 87 -2.786 -1.922 19.189 1.00 4.45 H new ATOM 0 HG LEU A 87 -0.952 0.289 20.159 1.00 12.11 H new ATOM 0 HD11 LEU A 87 -1.044 -0.926 22.302 1.00 72.55 H new ATOM 0 HD12 LEU A 87 -2.652 -0.351 21.802 1.00 72.55 H new ATOM 0 HD13 LEU A 87 -2.217 -2.065 21.600 1.00 72.55 H new ATOM 0 HD21 LEU A 87 0.647 -1.533 20.613 1.00 71.20 H new ATOM 0 HD22 LEU A 87 -0.469 -2.695 19.857 1.00 71.20 H new ATOM 0 HD23 LEU A 87 0.270 -1.406 18.879 1.00 71.20 H new ATOM 1391 N GLU A 88 -3.991 0.004 16.461 1.00 61.02 N ATOM 1392 CA GLU A 88 -5.136 -0.163 15.596 1.00 4.31 C ATOM 1393 C GLU A 88 -4.708 -0.453 14.168 1.00 23.13 C ATOM 1394 O GLU A 88 -5.252 -1.362 13.544 1.00 14.13 O ATOM 1395 CB GLU A 88 -6.007 1.055 15.705 1.00 22.31 C ATOM 1396 CG GLU A 88 -7.223 1.123 14.835 1.00 72.33 C ATOM 1397 CD GLU A 88 -8.019 2.341 15.190 1.00 1.44 C ATOM 1398 OE1 GLU A 88 -7.436 3.444 15.258 1.00 72.12 O ATOM 1399 OE2 GLU A 88 -9.208 2.209 15.495 1.00 52.55 O ATOM 0 H GLU A 88 -3.890 0.951 16.826 1.00 61.02 H new ATOM 0 HA GLU A 88 -5.718 -1.029 15.912 1.00 4.31 H new ATOM 0 HB2 GLU A 88 -6.332 1.143 16.742 1.00 22.31 H new ATOM 0 HB3 GLU A 88 -5.391 1.928 15.489 1.00 22.31 H new ATOM 0 HG2 GLU A 88 -6.932 1.158 13.785 1.00 72.33 H new ATOM 0 HG3 GLU A 88 -7.829 0.227 14.967 1.00 72.33 H new ATOM 1406 N LEU A 89 -3.720 0.303 13.652 1.00 0.33 N ATOM 1407 CA LEU A 89 -3.159 -0.025 12.315 1.00 13.33 C ATOM 1408 C LEU A 89 -2.668 -1.469 12.296 1.00 10.14 C ATOM 1409 O LEU A 89 -2.911 -2.213 11.336 1.00 4.30 O ATOM 1410 CB LEU A 89 -2.004 0.912 11.849 1.00 32.33 C ATOM 1411 CG LEU A 89 -2.338 2.369 11.459 1.00 42.55 C ATOM 1412 CD1 LEU A 89 -3.452 2.447 10.440 1.00 62.21 C ATOM 1413 CD2 LEU A 89 -2.606 3.249 12.646 1.00 51.15 C ATOM 0 H LEU A 89 -3.304 1.113 14.112 1.00 0.33 H new ATOM 0 HA LEU A 89 -3.979 0.124 11.612 1.00 13.33 H new ATOM 0 HB2 LEU A 89 -1.264 0.946 12.648 1.00 32.33 H new ATOM 0 HB3 LEU A 89 -1.524 0.442 10.990 1.00 32.33 H new ATOM 0 HG LEU A 89 -1.439 2.762 10.985 1.00 42.55 H new ATOM 0 HD11 LEU A 89 -3.651 3.491 10.197 1.00 62.21 H new ATOM 0 HD12 LEU A 89 -3.156 1.914 9.536 1.00 62.21 H new ATOM 0 HD13 LEU A 89 -4.353 1.992 10.851 1.00 62.21 H new ATOM 0 HD21 LEU A 89 -2.834 4.259 12.306 1.00 51.15 H new ATOM 0 HD22 LEU A 89 -3.453 2.855 13.207 1.00 51.15 H new ATOM 0 HD23 LEU A 89 -1.725 3.273 13.288 1.00 51.15 H new ATOM 1425 N LYS A 90 -2.007 -1.870 13.377 1.00 62.43 N ATOM 1426 CA LYS A 90 -1.514 -3.222 13.509 1.00 11.21 C ATOM 1427 C LYS A 90 -2.647 -4.257 13.549 1.00 14.11 C ATOM 1428 O LYS A 90 -2.505 -5.354 13.009 1.00 70.13 O ATOM 1429 CB LYS A 90 -0.583 -3.378 14.712 1.00 30.51 C ATOM 1430 CG LYS A 90 0.769 -2.703 14.536 1.00 35.51 C ATOM 1431 CD LYS A 90 1.649 -2.900 15.760 1.00 2.31 C ATOM 1432 CE LYS A 90 3.027 -2.303 15.548 1.00 3.13 C ATOM 1433 NZ LYS A 90 3.936 -2.580 16.679 1.00 55.04 N ATOM 0 H LYS A 90 -1.803 -1.268 14.175 1.00 62.43 H new ATOM 0 HA LYS A 90 -0.929 -3.420 12.611 1.00 11.21 H new ATOM 0 HB2 LYS A 90 -1.072 -2.965 15.594 1.00 30.51 H new ATOM 0 HB3 LYS A 90 -0.426 -4.440 14.903 1.00 30.51 H new ATOM 0 HG2 LYS A 90 1.269 -3.110 13.657 1.00 35.51 H new ATOM 0 HG3 LYS A 90 0.625 -1.638 14.357 1.00 35.51 H new ATOM 0 HD2 LYS A 90 1.179 -2.437 16.627 1.00 2.31 H new ATOM 0 HD3 LYS A 90 1.741 -3.964 15.978 1.00 2.31 H new ATOM 0 HE2 LYS A 90 3.458 -2.705 14.631 1.00 3.13 H new ATOM 0 HE3 LYS A 90 2.937 -1.225 15.412 1.00 3.13 H new ATOM 0 HZ1 LYS A 90 4.865 -2.153 16.490 1.00 55.04 H new ATOM 0 HZ2 LYS A 90 3.539 -2.174 17.551 1.00 55.04 H new ATOM 0 HZ3 LYS A 90 4.044 -3.608 16.794 1.00 55.04 H new ATOM 1447 N LYS A 91 -3.773 -3.907 14.182 1.00 32.11 N ATOM 1448 CA LYS A 91 -4.924 -4.820 14.236 1.00 71.12 C ATOM 1449 C LYS A 91 -5.505 -5.022 12.851 1.00 25.44 C ATOM 1450 O LYS A 91 -5.890 -6.129 12.482 1.00 2.11 O ATOM 1451 CB LYS A 91 -6.065 -4.306 15.139 1.00 35.11 C ATOM 1452 CG LYS A 91 -5.735 -4.075 16.608 1.00 34.04 C ATOM 1453 CD LYS A 91 -7.013 -3.784 17.412 1.00 44.40 C ATOM 1454 CE LYS A 91 -7.774 -2.565 16.887 1.00 43.50 C ATOM 1455 NZ LYS A 91 -9.063 -2.365 17.586 1.00 33.35 N ATOM 0 H LYS A 91 -3.913 -3.015 14.657 1.00 32.11 H new ATOM 0 HA LYS A 91 -4.538 -5.751 14.651 1.00 71.12 H new ATOM 0 HB2 LYS A 91 -6.430 -3.367 14.722 1.00 35.11 H new ATOM 0 HB3 LYS A 91 -6.887 -5.020 15.085 1.00 35.11 H new ATOM 0 HG2 LYS A 91 -5.235 -4.953 17.016 1.00 34.04 H new ATOM 0 HG3 LYS A 91 -5.041 -3.240 16.703 1.00 34.04 H new ATOM 0 HD2 LYS A 91 -7.665 -4.657 17.379 1.00 44.40 H new ATOM 0 HD3 LYS A 91 -6.751 -3.621 18.457 1.00 44.40 H new ATOM 0 HE2 LYS A 91 -7.156 -1.675 17.006 1.00 43.50 H new ATOM 0 HE3 LYS A 91 -7.957 -2.686 15.819 1.00 43.50 H new ATOM 0 HZ1 LYS A 91 -9.543 -1.528 17.197 1.00 33.35 H new ATOM 0 HZ2 LYS A 91 -9.664 -3.203 17.452 1.00 33.35 H new ATOM 0 HZ3 LYS A 91 -8.889 -2.223 18.601 1.00 33.35 H new ATOM 1469 N LEU A 92 -5.579 -3.946 12.097 1.00 64.25 N ATOM 1470 CA LEU A 92 -6.184 -3.977 10.782 1.00 23.03 C ATOM 1471 C LEU A 92 -5.327 -4.739 9.792 1.00 62.43 C ATOM 1472 O LEU A 92 -5.835 -5.517 8.987 1.00 1.12 O ATOM 1473 CB LEU A 92 -6.453 -2.567 10.280 1.00 33.34 C ATOM 1474 CG LEU A 92 -7.235 -1.663 11.235 1.00 70.11 C ATOM 1475 CD1 LEU A 92 -7.621 -0.360 10.569 1.00 4.10 C ATOM 1476 CD2 LEU A 92 -8.441 -2.374 11.815 1.00 62.25 C ATOM 0 H LEU A 92 -5.224 -3.031 12.375 1.00 64.25 H new ATOM 0 HA LEU A 92 -7.135 -4.502 10.871 1.00 23.03 H new ATOM 0 HB2 LEU A 92 -5.498 -2.091 10.058 1.00 33.34 H new ATOM 0 HB3 LEU A 92 -7.002 -2.634 9.340 1.00 33.34 H new ATOM 0 HG LEU A 92 -6.575 -1.420 12.068 1.00 70.11 H new ATOM 0 HD11 LEU A 92 -8.175 0.259 11.275 1.00 4.10 H new ATOM 0 HD12 LEU A 92 -6.721 0.167 10.253 1.00 4.10 H new ATOM 0 HD13 LEU A 92 -8.245 -0.567 9.700 1.00 4.10 H new ATOM 0 HD21 LEU A 92 -8.971 -1.701 12.488 1.00 62.25 H new ATOM 0 HD22 LEU A 92 -9.107 -2.679 11.008 1.00 62.25 H new ATOM 0 HD23 LEU A 92 -8.113 -3.255 12.367 1.00 62.25 H new ATOM 1488 N ILE A 93 -4.044 -4.526 9.850 1.00 34.04 N ATOM 1489 CA ILE A 93 -3.138 -5.233 8.983 1.00 24.43 C ATOM 1490 C ILE A 93 -2.992 -6.694 9.432 1.00 64.11 C ATOM 1491 O ILE A 93 -2.807 -7.603 8.613 1.00 2.23 O ATOM 1492 CB ILE A 93 -1.785 -4.493 8.819 1.00 55.53 C ATOM 1493 CG1 ILE A 93 -2.055 -3.129 8.166 1.00 42.22 C ATOM 1494 CG2 ILE A 93 -0.818 -5.302 7.971 1.00 34.14 C ATOM 1495 CD1 ILE A 93 -0.824 -2.303 7.880 1.00 74.12 C ATOM 0 H ILE A 93 -3.598 -3.868 10.489 1.00 34.04 H new ATOM 0 HA ILE A 93 -3.567 -5.254 7.981 1.00 24.43 H new ATOM 0 HB ILE A 93 -1.326 -4.357 9.798 1.00 55.53 H new ATOM 0 HG12 ILE A 93 -2.591 -3.291 7.231 1.00 42.22 H new ATOM 0 HG13 ILE A 93 -2.715 -2.556 8.817 1.00 42.22 H new ATOM 0 HG21 ILE A 93 0.122 -4.759 7.873 1.00 34.14 H new ATOM 0 HG22 ILE A 93 -0.633 -6.264 8.448 1.00 34.14 H new ATOM 0 HG23 ILE A 93 -1.248 -5.464 6.983 1.00 34.14 H new ATOM 0 HD11 ILE A 93 -1.118 -1.360 7.420 1.00 74.12 H new ATOM 0 HD12 ILE A 93 -0.295 -2.103 8.812 1.00 74.12 H new ATOM 0 HD13 ILE A 93 -0.169 -2.849 7.201 1.00 74.12 H new ATOM 1507 N GLY A 94 -3.112 -6.918 10.732 1.00 4.21 N ATOM 1508 CA GLY A 94 -3.107 -8.275 11.272 1.00 72.11 C ATOM 1509 C GLY A 94 -4.322 -9.049 10.796 1.00 23.14 C ATOM 1510 O GLY A 94 -4.278 -10.264 10.616 1.00 42.43 O ATOM 0 H GLY A 94 -3.214 -6.183 11.432 1.00 4.21 H new ATOM 0 HA2 GLY A 94 -2.198 -8.791 10.963 1.00 72.11 H new ATOM 0 HA3 GLY A 94 -3.098 -8.238 12.361 1.00 72.11 H new ATOM 1514 N GLU A 95 -5.387 -8.316 10.570 1.00 50.15 N ATOM 1515 CA GLU A 95 -6.640 -8.840 10.087 1.00 14.45 C ATOM 1516 C GLU A 95 -6.464 -9.290 8.613 1.00 53.43 C ATOM 1517 O GLU A 95 -6.934 -10.353 8.209 1.00 33.15 O ATOM 1518 CB GLU A 95 -7.668 -7.713 10.182 1.00 24.20 C ATOM 1519 CG GLU A 95 -9.104 -8.110 9.999 1.00 71.20 C ATOM 1520 CD GLU A 95 -9.589 -9.015 11.100 1.00 71.44 C ATOM 1521 OE1 GLU A 95 -9.970 -8.500 12.169 1.00 52.53 O ATOM 1522 OE2 GLU A 95 -9.614 -10.248 10.918 1.00 70.40 O ATOM 0 H GLU A 95 -5.404 -7.308 10.722 1.00 50.15 H new ATOM 0 HA GLU A 95 -6.968 -9.699 10.673 1.00 14.45 H new ATOM 0 HB2 GLU A 95 -7.566 -7.237 11.157 1.00 24.20 H new ATOM 0 HB3 GLU A 95 -7.422 -6.961 9.433 1.00 24.20 H new ATOM 0 HG2 GLU A 95 -9.725 -7.215 9.967 1.00 71.20 H new ATOM 0 HG3 GLU A 95 -9.220 -8.614 9.039 1.00 71.20 H new ATOM 1529 N VAL A 96 -5.765 -8.455 7.835 1.00 31.53 N ATOM 1530 CA VAL A 96 -5.464 -8.737 6.419 1.00 0.24 C ATOM 1531 C VAL A 96 -4.533 -9.938 6.276 1.00 33.41 C ATOM 1532 O VAL A 96 -4.795 -10.866 5.506 1.00 64.53 O ATOM 1533 CB VAL A 96 -4.769 -7.502 5.756 1.00 51.05 C ATOM 1534 CG1 VAL A 96 -4.240 -7.836 4.396 1.00 74.21 C ATOM 1535 CG2 VAL A 96 -5.712 -6.370 5.610 1.00 52.10 C ATOM 0 H VAL A 96 -5.391 -7.565 8.165 1.00 31.53 H new ATOM 0 HA VAL A 96 -6.412 -8.953 5.926 1.00 0.24 H new ATOM 0 HB VAL A 96 -3.947 -7.222 6.415 1.00 51.05 H new ATOM 0 HG11 VAL A 96 -3.764 -6.956 3.965 1.00 74.21 H new ATOM 0 HG12 VAL A 96 -3.509 -8.641 4.477 1.00 74.21 H new ATOM 0 HG13 VAL A 96 -5.061 -8.155 3.754 1.00 74.21 H new ATOM 0 HG21 VAL A 96 -5.200 -5.527 5.146 1.00 52.10 H new ATOM 0 HG22 VAL A 96 -6.551 -6.674 4.984 1.00 52.10 H new ATOM 0 HG23 VAL A 96 -6.081 -6.075 6.592 1.00 52.10 H new ATOM 1545 N SER A 97 -3.479 -9.917 7.044 1.00 31.34 N ATOM 1546 CA SER A 97 -2.438 -10.916 6.975 1.00 1.34 C ATOM 1547 C SER A 97 -2.903 -12.254 7.512 1.00 15.30 C ATOM 1548 O SER A 97 -2.338 -13.301 7.165 1.00 4.54 O ATOM 1549 CB SER A 97 -1.263 -10.431 7.787 1.00 72.13 C ATOM 1550 OG SER A 97 -1.690 -10.116 9.098 1.00 2.12 O ATOM 0 H SER A 97 -3.313 -9.197 7.747 1.00 31.34 H new ATOM 0 HA SER A 97 -2.162 -11.060 5.930 1.00 1.34 H new ATOM 0 HB2 SER A 97 -0.489 -11.198 7.820 1.00 72.13 H new ATOM 0 HB3 SER A 97 -0.821 -9.553 7.317 1.00 72.13 H new ATOM 0 HG SER A 97 -2.088 -9.220 9.106 1.00 2.12 H new ATOM 1556 N SER A 98 -3.929 -12.200 8.377 1.00 12.55 N ATOM 1557 CA SER A 98 -4.472 -13.364 9.047 1.00 3.02 C ATOM 1558 C SER A 98 -3.414 -13.935 10.010 1.00 31.00 C ATOM 1559 O SER A 98 -3.435 -15.119 10.364 1.00 31.40 O ATOM 1560 CB SER A 98 -4.935 -14.404 8.009 1.00 55.31 C ATOM 1561 OG SER A 98 -5.877 -13.819 7.105 1.00 54.42 O ATOM 0 H SER A 98 -4.401 -11.331 8.625 1.00 12.55 H new ATOM 0 HA SER A 98 -5.347 -13.086 9.634 1.00 3.02 H new ATOM 0 HB2 SER A 98 -4.076 -14.782 7.455 1.00 55.31 H new ATOM 0 HB3 SER A 98 -5.388 -15.256 8.515 1.00 55.31 H new ATOM 0 HG SER A 98 -6.162 -14.490 6.450 1.00 54.42 H new ATOM 1567 N GLY A 99 -2.516 -13.061 10.465 1.00 41.31 N ATOM 1568 CA GLY A 99 -1.464 -13.453 11.371 1.00 3.52 C ATOM 1569 C GLY A 99 -0.481 -12.326 11.605 1.00 52.14 C ATOM 1570 O GLY A 99 -0.775 -11.378 12.353 1.00 34.33 O ATOM 0 H GLY A 99 -2.506 -12.073 10.212 1.00 41.31 H new ATOM 0 HA2 GLY A 99 -1.898 -13.761 12.322 1.00 3.52 H new ATOM 0 HA3 GLY A 99 -0.938 -14.317 10.966 1.00 3.52 H new ATOM 1574 N SER A 100 0.666 -12.406 10.960 1.00 21.54 N ATOM 1575 CA SER A 100 1.695 -11.398 11.102 1.00 52.12 C ATOM 1576 C SER A 100 1.384 -10.211 10.201 1.00 21.12 C ATOM 1577 O SER A 100 1.649 -10.240 8.987 1.00 22.41 O ATOM 1578 CB SER A 100 3.055 -11.984 10.764 1.00 45.31 C ATOM 1579 OG SER A 100 3.313 -13.160 11.533 1.00 32.12 O ATOM 0 H SER A 100 0.909 -13.167 10.326 1.00 21.54 H new ATOM 0 HA SER A 100 1.718 -11.055 12.136 1.00 52.12 H new ATOM 0 HB2 SER A 100 3.097 -12.224 9.702 1.00 45.31 H new ATOM 0 HB3 SER A 100 3.831 -11.243 10.955 1.00 45.31 H new ATOM 0 HG SER A 100 4.193 -13.519 11.296 1.00 32.12 H new ATOM 1585 N GLY A 101 0.776 -9.205 10.777 1.00 44.42 N ATOM 1586 CA GLY A 101 0.383 -8.073 10.025 1.00 11.52 C ATOM 1587 C GLY A 101 1.047 -6.812 10.442 1.00 12.10 C ATOM 1588 O GLY A 101 0.432 -5.952 11.064 1.00 22.25 O ATOM 0 H GLY A 101 0.548 -9.161 11.770 1.00 44.42 H new ATOM 0 HA2 GLY A 101 0.600 -8.255 8.973 1.00 11.52 H new ATOM 0 HA3 GLY A 101 -0.697 -7.949 10.111 1.00 11.52 H new ATOM 1592 N GLU A 102 2.290 -6.717 10.156 1.00 52.01 N ATOM 1593 CA GLU A 102 3.019 -5.485 10.301 1.00 75.42 C ATOM 1594 C GLU A 102 3.289 -4.945 8.918 1.00 73.32 C ATOM 1595 O GLU A 102 3.656 -3.786 8.738 1.00 15.10 O ATOM 1596 CB GLU A 102 4.301 -5.702 11.082 1.00 73.10 C ATOM 1597 CG GLU A 102 4.045 -6.100 12.518 1.00 20.54 C ATOM 1598 CD GLU A 102 5.293 -6.450 13.255 1.00 61.33 C ATOM 1599 OE1 GLU A 102 6.035 -5.541 13.661 1.00 33.12 O ATOM 1600 OE2 GLU A 102 5.543 -7.658 13.474 1.00 4.35 O ATOM 0 H GLU A 102 2.851 -7.495 9.809 1.00 52.01 H new ATOM 0 HA GLU A 102 2.435 -4.761 10.868 1.00 75.42 H new ATOM 0 HB2 GLU A 102 4.893 -6.476 10.594 1.00 73.10 H new ATOM 0 HB3 GLU A 102 4.894 -4.787 11.062 1.00 73.10 H new ATOM 0 HG2 GLU A 102 3.543 -5.281 13.033 1.00 20.54 H new ATOM 0 HG3 GLU A 102 3.366 -6.953 12.538 1.00 20.54 H new ATOM 1607 N THR A 103 3.080 -5.815 7.955 1.00 42.23 N ATOM 1608 CA THR A 103 3.200 -5.535 6.569 1.00 3.34 C ATOM 1609 C THR A 103 2.146 -6.383 5.831 1.00 52.42 C ATOM 1610 O THR A 103 2.016 -7.579 6.108 1.00 0.20 O ATOM 1611 CB THR A 103 4.591 -5.983 6.065 1.00 42.42 C ATOM 1612 OG1 THR A 103 5.619 -5.492 6.939 1.00 4.05 O ATOM 1613 CG2 THR A 103 4.838 -5.458 4.667 1.00 71.24 C ATOM 0 H THR A 103 2.809 -6.780 8.142 1.00 42.23 H new ATOM 0 HA THR A 103 3.065 -4.468 6.392 1.00 3.34 H new ATOM 0 HB THR A 103 4.614 -7.073 6.053 1.00 42.42 H new ATOM 0 HG1 THR A 103 6.073 -4.734 6.516 1.00 4.05 H new ATOM 0 HG21 THR A 103 5.821 -5.781 4.325 1.00 71.24 H new ATOM 0 HG22 THR A 103 4.074 -5.845 3.993 1.00 71.24 H new ATOM 0 HG23 THR A 103 4.797 -4.369 4.675 1.00 71.24 H new ATOM 1621 N PHE A 104 1.385 -5.783 4.944 1.00 5.31 N ATOM 1622 CA PHE A 104 0.468 -6.550 4.127 1.00 34.53 C ATOM 1623 C PHE A 104 0.836 -6.351 2.699 1.00 61.05 C ATOM 1624 O PHE A 104 1.624 -5.446 2.378 1.00 62.41 O ATOM 1625 CB PHE A 104 -1.021 -6.179 4.343 1.00 63.43 C ATOM 1626 CG PHE A 104 -1.450 -4.795 3.901 1.00 34.23 C ATOM 1627 CD1 PHE A 104 -1.263 -3.704 4.713 1.00 20.42 C ATOM 1628 CD2 PHE A 104 -2.068 -4.608 2.672 1.00 51.42 C ATOM 1629 CE1 PHE A 104 -1.677 -2.447 4.324 1.00 44.34 C ATOM 1630 CE2 PHE A 104 -2.479 -3.353 2.275 1.00 20.22 C ATOM 1631 CZ PHE A 104 -2.285 -2.273 3.101 1.00 21.21 C ATOM 0 H PHE A 104 1.381 -4.778 4.770 1.00 5.31 H new ATOM 0 HA PHE A 104 0.561 -7.595 4.423 1.00 34.53 H new ATOM 0 HB2 PHE A 104 -1.633 -6.910 3.815 1.00 63.43 H new ATOM 0 HB3 PHE A 104 -1.246 -6.282 5.404 1.00 63.43 H new ATOM 0 HD1 PHE A 104 -0.784 -3.832 5.672 1.00 20.42 H new ATOM 0 HD2 PHE A 104 -2.229 -5.454 2.020 1.00 51.42 H new ATOM 0 HE1 PHE A 104 -1.524 -1.601 4.978 1.00 44.34 H new ATOM 0 HE2 PHE A 104 -2.954 -3.219 1.314 1.00 20.22 H new ATOM 0 HZ PHE A 104 -2.608 -1.290 2.792 1.00 21.21 H new ATOM 1641 N SER A 105 0.303 -7.148 1.842 1.00 25.31 N ATOM 1642 CA SER A 105 0.578 -6.971 0.469 1.00 72.55 C ATOM 1643 C SER A 105 -0.686 -6.987 -0.375 1.00 60.41 C ATOM 1644 O SER A 105 -1.790 -7.247 0.134 1.00 71.44 O ATOM 1645 CB SER A 105 1.703 -7.910 -0.034 1.00 51.42 C ATOM 1646 OG SER A 105 1.468 -9.282 0.258 1.00 53.33 O ATOM 0 H SER A 105 -0.321 -7.922 2.069 1.00 25.31 H new ATOM 0 HA SER A 105 0.984 -5.967 0.343 1.00 72.55 H new ATOM 0 HB2 SER A 105 1.812 -7.789 -1.112 1.00 51.42 H new ATOM 0 HB3 SER A 105 2.648 -7.607 0.418 1.00 51.42 H new ATOM 0 HG SER A 105 0.568 -9.387 0.632 1.00 53.33 H new ATOM 1652 N TYR A 106 -0.510 -6.702 -1.640 1.00 53.21 N ATOM 1653 CA TYR A 106 -1.577 -6.545 -2.614 1.00 23.42 C ATOM 1654 C TYR A 106 -2.545 -7.763 -2.624 1.00 12.31 C ATOM 1655 O TYR A 106 -3.764 -7.571 -2.522 1.00 32.01 O ATOM 1656 CB TYR A 106 -0.930 -6.315 -3.988 1.00 14.30 C ATOM 1657 CG TYR A 106 -1.828 -5.807 -5.086 1.00 13.05 C ATOM 1658 CD1 TYR A 106 -2.675 -6.640 -5.771 1.00 13.23 C ATOM 1659 CD2 TYR A 106 -1.784 -4.482 -5.450 1.00 22.25 C ATOM 1660 CE1 TYR A 106 -3.467 -6.166 -6.796 1.00 51.21 C ATOM 1661 CE2 TYR A 106 -2.554 -3.986 -6.466 1.00 33.35 C ATOM 1662 CZ TYR A 106 -3.403 -4.840 -7.143 1.00 12.24 C ATOM 1663 OH TYR A 106 -4.166 -4.376 -8.169 1.00 64.40 O ATOM 0 H TYR A 106 0.417 -6.566 -2.043 1.00 53.21 H new ATOM 0 HA TYR A 106 -2.194 -5.687 -2.347 1.00 23.42 H new ATOM 0 HB2 TYR A 106 -0.111 -5.606 -3.863 1.00 14.30 H new ATOM 0 HB3 TYR A 106 -0.489 -7.256 -4.318 1.00 14.30 H new ATOM 0 HD1 TYR A 106 -2.723 -7.685 -5.503 1.00 13.23 H new ATOM 0 HD2 TYR A 106 -1.123 -3.814 -4.919 1.00 22.25 H new ATOM 0 HE1 TYR A 106 -4.133 -6.834 -7.322 1.00 51.21 H new ATOM 0 HE2 TYR A 106 -2.499 -2.942 -6.735 1.00 33.35 H new ATOM 0 HH TYR A 106 -4.693 -5.112 -8.544 1.00 64.40 H new ATOM 1673 N PRO A 107 -2.036 -9.042 -2.729 1.00 33.23 N ATOM 1674 CA PRO A 107 -2.908 -10.213 -2.702 1.00 34.15 C ATOM 1675 C PRO A 107 -3.664 -10.348 -1.376 1.00 2.03 C ATOM 1676 O PRO A 107 -4.780 -10.825 -1.357 1.00 54.12 O ATOM 1677 CB PRO A 107 -1.947 -11.402 -2.892 1.00 31.21 C ATOM 1678 CG PRO A 107 -0.610 -10.878 -2.505 1.00 12.31 C ATOM 1679 CD PRO A 107 -0.611 -9.439 -2.906 1.00 23.24 C ATOM 0 HA PRO A 107 -3.680 -10.152 -3.469 1.00 34.15 H new ATOM 0 HB2 PRO A 107 -2.236 -12.247 -2.268 1.00 31.21 H new ATOM 0 HB3 PRO A 107 -1.951 -11.752 -3.924 1.00 31.21 H new ATOM 0 HG2 PRO A 107 -0.442 -10.986 -1.434 1.00 12.31 H new ATOM 0 HG3 PRO A 107 0.186 -11.425 -3.010 1.00 12.31 H new ATOM 0 HD2 PRO A 107 0.054 -8.845 -2.279 1.00 23.24 H new ATOM 0 HD3 PRO A 107 -0.280 -9.307 -3.936 1.00 23.24 H new ATOM 1687 N ASP A 108 -3.063 -9.878 -0.280 1.00 20.10 N ATOM 1688 CA ASP A 108 -3.657 -10.016 1.061 1.00 42.43 C ATOM 1689 C ASP A 108 -4.829 -9.092 1.246 1.00 64.55 C ATOM 1690 O ASP A 108 -5.810 -9.441 1.916 1.00 34.42 O ATOM 1691 CB ASP A 108 -2.644 -9.773 2.176 1.00 43.32 C ATOM 1692 CG ASP A 108 -1.484 -10.711 2.154 1.00 73.10 C ATOM 1693 OD1 ASP A 108 -1.638 -11.888 2.571 1.00 50.01 O ATOM 1694 OD2 ASP A 108 -0.397 -10.289 1.714 1.00 31.55 O ATOM 0 H ASP A 108 -2.164 -9.397 -0.291 1.00 20.10 H new ATOM 0 HA ASP A 108 -4.000 -11.049 1.128 1.00 42.43 H new ATOM 0 HB2 ASP A 108 -2.273 -8.751 2.100 1.00 43.32 H new ATOM 0 HB3 ASP A 108 -3.150 -9.858 3.138 1.00 43.32 H new ATOM 1699 N PHE A 109 -4.751 -7.920 0.660 1.00 35.32 N ATOM 1700 CA PHE A 109 -5.832 -6.963 0.781 1.00 51.22 C ATOM 1701 C PHE A 109 -7.051 -7.526 0.041 1.00 21.34 C ATOM 1702 O PHE A 109 -8.173 -7.466 0.529 1.00 62.31 O ATOM 1703 CB PHE A 109 -5.412 -5.606 0.206 1.00 42.04 C ATOM 1704 CG PHE A 109 -6.322 -4.446 0.574 1.00 70.33 C ATOM 1705 CD1 PHE A 109 -7.586 -4.312 0.026 1.00 74.01 C ATOM 1706 CD2 PHE A 109 -5.892 -3.488 1.478 1.00 11.42 C ATOM 1707 CE1 PHE A 109 -8.397 -3.249 0.371 1.00 50.34 C ATOM 1708 CE2 PHE A 109 -6.698 -2.424 1.824 1.00 25.21 C ATOM 1709 CZ PHE A 109 -7.953 -2.304 1.271 1.00 22.33 C ATOM 0 H PHE A 109 -3.959 -7.606 0.099 1.00 35.32 H new ATOM 0 HA PHE A 109 -6.083 -6.804 1.830 1.00 51.22 H new ATOM 0 HB2 PHE A 109 -4.402 -5.379 0.548 1.00 42.04 H new ATOM 0 HB3 PHE A 109 -5.370 -5.685 -0.880 1.00 42.04 H new ATOM 0 HD1 PHE A 109 -7.942 -5.048 -0.680 1.00 74.01 H new ATOM 0 HD2 PHE A 109 -4.910 -3.576 1.919 1.00 11.42 H new ATOM 0 HE1 PHE A 109 -9.381 -3.158 -0.065 1.00 50.34 H new ATOM 0 HE2 PHE A 109 -6.345 -1.685 2.528 1.00 25.21 H new ATOM 0 HZ PHE A 109 -8.587 -1.473 1.541 1.00 22.33 H new ATOM 1719 N LEU A 110 -6.808 -8.107 -1.120 1.00 14.51 N ATOM 1720 CA LEU A 110 -7.860 -8.746 -1.883 1.00 31.41 C ATOM 1721 C LEU A 110 -8.349 -9.981 -1.157 1.00 3.03 C ATOM 1722 O LEU A 110 -9.535 -10.212 -1.071 1.00 2.31 O ATOM 1723 CB LEU A 110 -7.367 -9.083 -3.294 1.00 12.32 C ATOM 1724 CG LEU A 110 -7.080 -7.876 -4.185 1.00 22.24 C ATOM 1725 CD1 LEU A 110 -6.446 -8.304 -5.503 1.00 74.32 C ATOM 1726 CD2 LEU A 110 -8.374 -7.103 -4.441 1.00 75.41 C ATOM 0 H LEU A 110 -5.886 -8.148 -1.555 1.00 14.51 H new ATOM 0 HA LEU A 110 -8.699 -8.058 -1.982 1.00 31.41 H new ATOM 0 HB2 LEU A 110 -6.458 -9.679 -3.212 1.00 12.32 H new ATOM 0 HB3 LEU A 110 -8.114 -9.707 -3.784 1.00 12.32 H new ATOM 0 HG LEU A 110 -6.371 -7.228 -3.670 1.00 22.24 H new ATOM 0 HD11 LEU A 110 -6.253 -7.424 -6.117 1.00 74.32 H new ATOM 0 HD12 LEU A 110 -5.507 -8.821 -5.304 1.00 74.32 H new ATOM 0 HD13 LEU A 110 -7.124 -8.974 -6.032 1.00 74.32 H new ATOM 0 HD21 LEU A 110 -8.164 -6.243 -5.077 1.00 75.41 H new ATOM 0 HD22 LEU A 110 -9.095 -7.754 -4.937 1.00 75.41 H new ATOM 0 HD23 LEU A 110 -8.787 -6.761 -3.492 1.00 75.41 H new ATOM 1738 N ARG A 111 -7.406 -10.714 -0.597 1.00 1.01 N ATOM 1739 CA ARG A 111 -7.627 -11.946 0.174 1.00 44.52 C ATOM 1740 C ARG A 111 -8.712 -11.746 1.233 1.00 21.52 C ATOM 1741 O ARG A 111 -9.658 -12.532 1.323 1.00 33.33 O ATOM 1742 CB ARG A 111 -6.297 -12.292 0.842 1.00 5.55 C ATOM 1743 CG ARG A 111 -6.250 -13.500 1.738 1.00 25.11 C ATOM 1744 CD ARG A 111 -4.848 -13.619 2.327 1.00 15.34 C ATOM 1745 NE ARG A 111 -4.696 -14.751 3.230 1.00 40.22 N ATOM 1746 CZ ARG A 111 -3.588 -15.006 3.949 1.00 73.33 C ATOM 1747 NH1 ARG A 111 -2.521 -14.188 3.878 1.00 33.54 N ATOM 1748 NH2 ARG A 111 -3.545 -16.079 4.737 1.00 52.22 N ATOM 0 H ARG A 111 -6.419 -10.466 -0.663 1.00 1.01 H new ATOM 0 HA ARG A 111 -7.964 -12.749 -0.481 1.00 44.52 H new ATOM 0 HB2 ARG A 111 -5.554 -12.430 0.056 1.00 5.55 H new ATOM 0 HB3 ARG A 111 -5.983 -11.429 1.429 1.00 5.55 H new ATOM 0 HG2 ARG A 111 -6.988 -13.408 2.535 1.00 25.11 H new ATOM 0 HG3 ARG A 111 -6.500 -14.399 1.174 1.00 25.11 H new ATOM 0 HD2 ARG A 111 -4.127 -13.712 1.515 1.00 15.34 H new ATOM 0 HD3 ARG A 111 -4.608 -12.701 2.863 1.00 15.34 H new ATOM 0 HE ARG A 111 -5.482 -15.394 3.324 1.00 40.22 H new ATOM 0 HH11 ARG A 111 -2.548 -13.366 3.275 1.00 33.54 H new ATOM 0 HH12 ARG A 111 -1.686 -14.390 4.427 1.00 33.54 H new ATOM 0 HH21 ARG A 111 -4.350 -16.703 4.793 1.00 52.22 H new ATOM 0 HH22 ARG A 111 -2.707 -16.277 5.284 1.00 52.22 H new ATOM 1762 N MET A 112 -8.584 -10.701 2.025 1.00 75.21 N ATOM 1763 CA MET A 112 -9.573 -10.431 3.044 1.00 50.02 C ATOM 1764 C MET A 112 -10.878 -9.877 2.454 1.00 12.52 C ATOM 1765 O MET A 112 -11.948 -10.129 2.970 1.00 32.44 O ATOM 1766 CB MET A 112 -9.016 -9.590 4.218 1.00 64.41 C ATOM 1767 CG MET A 112 -8.650 -8.190 3.874 1.00 51.01 C ATOM 1768 SD MET A 112 -10.084 -7.138 3.638 1.00 1.33 S ATOM 1769 CE MET A 112 -9.274 -5.801 2.866 1.00 62.32 C ATOM 0 H MET A 112 -7.814 -10.033 1.983 1.00 75.21 H new ATOM 0 HA MET A 112 -9.833 -11.392 3.487 1.00 50.02 H new ATOM 0 HB2 MET A 112 -9.760 -9.569 5.015 1.00 64.41 H new ATOM 0 HB3 MET A 112 -8.135 -10.092 4.618 1.00 64.41 H new ATOM 0 HG2 MET A 112 -8.027 -7.776 4.667 1.00 51.01 H new ATOM 0 HG3 MET A 112 -8.050 -8.189 2.964 1.00 51.01 H new ATOM 0 HE1 MET A 112 -9.498 -4.880 3.405 1.00 62.32 H new ATOM 0 HE2 MET A 112 -8.198 -5.974 2.874 1.00 62.32 H new ATOM 0 HE3 MET A 112 -9.619 -5.712 1.836 1.00 62.32 H new ATOM 1779 N MET A 113 -10.776 -9.137 1.370 1.00 61.23 N ATOM 1780 CA MET A 113 -11.946 -8.501 0.761 1.00 22.21 C ATOM 1781 C MET A 113 -12.866 -9.516 0.108 1.00 1.23 C ATOM 1782 O MET A 113 -14.075 -9.525 0.350 1.00 0.53 O ATOM 1783 CB MET A 113 -11.524 -7.494 -0.298 1.00 61.12 C ATOM 1784 CG MET A 113 -12.702 -6.780 -0.961 1.00 4.43 C ATOM 1785 SD MET A 113 -12.225 -5.737 -2.355 1.00 15.43 S ATOM 1786 CE MET A 113 -11.084 -4.607 -1.572 1.00 44.42 C ATOM 0 H MET A 113 -9.897 -8.955 0.885 1.00 61.23 H new ATOM 0 HA MET A 113 -12.480 -8.000 1.568 1.00 22.21 H new ATOM 0 HB2 MET A 113 -10.869 -6.752 0.158 1.00 61.12 H new ATOM 0 HB3 MET A 113 -10.941 -8.006 -1.064 1.00 61.12 H new ATOM 0 HG2 MET A 113 -13.420 -7.524 -1.304 1.00 4.43 H new ATOM 0 HG3 MET A 113 -13.210 -6.167 -0.217 1.00 4.43 H new ATOM 0 HE1 MET A 113 -10.747 -3.868 -2.299 1.00 44.42 H new ATOM 0 HE2 MET A 113 -11.583 -4.101 -0.745 1.00 44.42 H new ATOM 0 HE3 MET A 113 -10.225 -5.161 -1.193 1.00 44.42 H new ATOM 1796 N LEU A 114 -12.283 -10.370 -0.710 1.00 52.21 N ATOM 1797 CA LEU A 114 -13.031 -11.307 -1.511 1.00 33.33 C ATOM 1798 C LEU A 114 -13.724 -12.393 -0.693 1.00 52.53 C ATOM 1799 O LEU A 114 -14.654 -13.035 -1.176 1.00 12.01 O ATOM 1800 CB LEU A 114 -12.143 -11.876 -2.649 1.00 0.55 C ATOM 1801 CG LEU A 114 -10.801 -12.535 -2.253 1.00 23.44 C ATOM 1802 CD1 LEU A 114 -10.958 -13.899 -1.590 1.00 60.15 C ATOM 1803 CD2 LEU A 114 -9.832 -12.564 -3.423 1.00 44.25 C ATOM 0 H LEU A 114 -11.273 -10.430 -0.835 1.00 52.21 H new ATOM 0 HA LEU A 114 -13.851 -10.756 -1.972 1.00 33.33 H new ATOM 0 HB2 LEU A 114 -12.730 -12.614 -3.196 1.00 0.55 H new ATOM 0 HB3 LEU A 114 -11.926 -11.064 -3.343 1.00 0.55 H new ATOM 0 HG LEU A 114 -10.367 -11.899 -1.482 1.00 23.44 H new ATOM 0 HD11 LEU A 114 -9.975 -14.298 -1.341 1.00 60.15 H new ATOM 0 HD12 LEU A 114 -11.548 -13.795 -0.680 1.00 60.15 H new ATOM 0 HD13 LEU A 114 -11.463 -14.580 -2.275 1.00 60.15 H new ATOM 0 HD21 LEU A 114 -8.899 -13.033 -3.111 1.00 44.25 H new ATOM 0 HD22 LEU A 114 -10.269 -13.134 -4.243 1.00 44.25 H new ATOM 0 HD23 LEU A 114 -9.632 -11.545 -3.755 1.00 44.25 H new ATOM 1815 N GLY A 115 -13.296 -12.586 0.534 1.00 33.02 N ATOM 1816 CA GLY A 115 -13.897 -13.625 1.336 1.00 55.25 C ATOM 1817 C GLY A 115 -13.440 -13.599 2.766 1.00 32.04 C ATOM 1818 O GLY A 115 -12.716 -14.495 3.201 1.00 14.23 O ATOM 0 H GLY A 115 -12.554 -12.053 0.988 1.00 33.02 H new ATOM 0 HA2 GLY A 115 -14.981 -13.519 1.305 1.00 55.25 H new ATOM 0 HA3 GLY A 115 -13.659 -14.596 0.901 1.00 55.25 H new ATOM 1822 N LYS A 116 -13.860 -12.583 3.493 1.00 23.41 N ATOM 1823 CA LYS A 116 -13.536 -12.427 4.903 1.00 25.33 C ATOM 1824 C LYS A 116 -14.232 -11.172 5.413 1.00 13.53 C ATOM 1825 O LYS A 116 -15.029 -11.226 6.345 1.00 23.31 O ATOM 1826 CB LYS A 116 -12.008 -12.323 5.120 1.00 52.55 C ATOM 1827 CG LYS A 116 -11.563 -12.355 6.569 1.00 23.25 C ATOM 1828 CD LYS A 116 -11.960 -13.666 7.226 1.00 72.40 C ATOM 1829 CE LYS A 116 -11.469 -13.749 8.650 1.00 72.33 C ATOM 1830 NZ LYS A 116 -11.877 -15.008 9.298 1.00 12.42 N ATOM 0 H LYS A 116 -14.442 -11.833 3.121 1.00 23.41 H new ATOM 0 HA LYS A 116 -13.880 -13.302 5.454 1.00 25.33 H new ATOM 0 HB2 LYS A 116 -11.524 -13.143 4.589 1.00 52.55 H new ATOM 0 HB3 LYS A 116 -11.654 -11.397 4.667 1.00 52.55 H new ATOM 0 HG2 LYS A 116 -10.482 -12.228 6.625 1.00 23.25 H new ATOM 0 HG3 LYS A 116 -12.011 -11.521 7.110 1.00 23.25 H new ATOM 0 HD2 LYS A 116 -13.045 -13.767 7.209 1.00 72.40 H new ATOM 0 HD3 LYS A 116 -11.553 -14.498 6.652 1.00 72.40 H new ATOM 0 HE2 LYS A 116 -10.382 -13.668 8.665 1.00 72.33 H new ATOM 0 HE3 LYS A 116 -11.859 -12.905 9.219 1.00 72.33 H new ATOM 0 HZ1 LYS A 116 -11.521 -15.027 10.275 1.00 12.42 H new ATOM 0 HZ2 LYS A 116 -12.915 -15.073 9.307 1.00 12.42 H new ATOM 0 HZ3 LYS A 116 -11.484 -15.813 8.770 1.00 12.42 H new ATOM 1844 N ARG A 117 -13.897 -10.032 4.779 1.00 31.14 N ATOM 1845 CA ARG A 117 -14.492 -8.699 5.048 1.00 63.43 C ATOM 1846 C ARG A 117 -14.286 -8.223 6.486 1.00 2.20 C ATOM 1847 O ARG A 117 -14.867 -7.217 6.909 1.00 71.04 O ATOM 1848 CB ARG A 117 -15.972 -8.692 4.687 1.00 72.43 C ATOM 1849 CG ARG A 117 -16.241 -8.935 3.222 1.00 61.23 C ATOM 1850 CD ARG A 117 -17.718 -8.992 2.955 1.00 11.54 C ATOM 1851 NE ARG A 117 -18.014 -9.231 1.544 1.00 0.13 N ATOM 1852 CZ ARG A 117 -19.224 -9.548 1.074 1.00 30.53 C ATOM 1853 NH1 ARG A 117 -20.258 -9.633 1.903 1.00 20.55 N ATOM 1854 NH2 ARG A 117 -19.397 -9.777 -0.226 1.00 22.31 N ATOM 0 H ARG A 117 -13.188 -10.007 4.046 1.00 31.14 H new ATOM 0 HA ARG A 117 -13.961 -7.990 4.412 1.00 63.43 H new ATOM 0 HB2 ARG A 117 -16.483 -9.456 5.273 1.00 72.43 H new ATOM 0 HB3 ARG A 117 -16.402 -7.732 4.972 1.00 72.43 H new ATOM 0 HG2 ARG A 117 -15.790 -8.141 2.628 1.00 61.23 H new ATOM 0 HG3 ARG A 117 -15.774 -9.870 2.912 1.00 61.23 H new ATOM 0 HD2 ARG A 117 -18.164 -9.783 3.557 1.00 11.54 H new ATOM 0 HD3 ARG A 117 -18.179 -8.055 3.268 1.00 11.54 H new ATOM 0 HE ARG A 117 -17.248 -9.151 0.875 1.00 0.13 H new ATOM 0 HH11 ARG A 117 -20.129 -9.456 2.899 1.00 20.55 H new ATOM 0 HH12 ARG A 117 -21.181 -9.875 1.543 1.00 20.55 H new ATOM 0 HH21 ARG A 117 -18.605 -9.711 -0.865 1.00 22.31 H new ATOM 0 HH22 ARG A 117 -20.322 -10.019 -0.583 1.00 22.31 H new ATOM 1868 N SER A 118 -13.439 -8.911 7.208 1.00 53.22 N ATOM 1869 CA SER A 118 -13.181 -8.614 8.587 1.00 2.22 C ATOM 1870 C SER A 118 -12.276 -7.397 8.748 1.00 71.44 C ATOM 1871 O SER A 118 -12.231 -6.788 9.810 1.00 33.14 O ATOM 1872 CB SER A 118 -12.561 -9.829 9.243 1.00 44.41 C ATOM 1873 OG SER A 118 -13.390 -10.964 9.061 1.00 51.21 O ATOM 0 H SER A 118 -12.905 -9.702 6.847 1.00 53.22 H new ATOM 0 HA SER A 118 -14.126 -8.371 9.072 1.00 2.22 H new ATOM 0 HB2 SER A 118 -11.576 -10.018 8.817 1.00 44.41 H new ATOM 0 HB3 SER A 118 -12.417 -9.642 10.307 1.00 44.41 H new ATOM 0 HG SER A 118 -13.402 -11.495 9.884 1.00 51.21 H new ATOM 1879 N ALA A 119 -11.562 -7.043 7.702 1.00 12.12 N ATOM 1880 CA ALA A 119 -10.667 -5.919 7.772 1.00 11.31 C ATOM 1881 C ALA A 119 -11.387 -4.649 7.419 1.00 21.30 C ATOM 1882 O ALA A 119 -11.668 -4.387 6.257 1.00 62.24 O ATOM 1883 CB ALA A 119 -9.449 -6.130 6.894 1.00 53.20 C ATOM 0 H ALA A 119 -11.586 -7.517 6.799 1.00 12.12 H new ATOM 0 HA ALA A 119 -10.312 -5.830 8.799 1.00 11.31 H new ATOM 0 HB1 ALA A 119 -8.792 -5.263 6.969 1.00 53.20 H new ATOM 0 HB2 ALA A 119 -8.913 -7.021 7.223 1.00 53.20 H new ATOM 0 HB3 ALA A 119 -9.765 -6.258 5.859 1.00 53.20 H new ATOM 1889 N ILE A 120 -11.688 -3.861 8.432 1.00 3.52 N ATOM 1890 CA ILE A 120 -12.402 -2.590 8.264 1.00 72.40 C ATOM 1891 C ILE A 120 -11.645 -1.568 7.407 1.00 11.12 C ATOM 1892 O ILE A 120 -12.219 -0.583 6.969 1.00 61.01 O ATOM 1893 CB ILE A 120 -12.799 -1.970 9.605 1.00 54.15 C ATOM 1894 CG1 ILE A 120 -11.604 -1.978 10.542 1.00 32.40 C ATOM 1895 CG2 ILE A 120 -13.973 -2.728 10.210 1.00 53.25 C ATOM 1896 CD1 ILE A 120 -11.802 -1.218 11.829 1.00 22.33 C ATOM 0 H ILE A 120 -11.448 -4.075 9.400 1.00 3.52 H new ATOM 0 HA ILE A 120 -13.310 -2.849 7.719 1.00 72.40 H new ATOM 0 HB ILE A 120 -13.112 -0.938 9.448 1.00 54.15 H new ATOM 0 HG12 ILE A 120 -11.356 -3.012 10.782 1.00 32.40 H new ATOM 0 HG13 ILE A 120 -10.746 -1.558 10.017 1.00 32.40 H new ATOM 0 HG21 ILE A 120 -14.245 -2.276 11.164 1.00 53.25 H new ATOM 0 HG22 ILE A 120 -14.824 -2.682 9.531 1.00 53.25 H new ATOM 0 HG23 ILE A 120 -13.691 -3.769 10.369 1.00 53.25 H new ATOM 0 HD11 ILE A 120 -10.896 -1.281 12.432 1.00 22.33 H new ATOM 0 HD12 ILE A 120 -12.017 -0.173 11.605 1.00 22.33 H new ATOM 0 HD13 ILE A 120 -12.636 -1.650 12.382 1.00 22.33 H new ATOM 1908 N LEU A 121 -10.364 -1.806 7.167 1.00 63.41 N ATOM 1909 CA LEU A 121 -9.596 -0.973 6.253 1.00 34.04 C ATOM 1910 C LEU A 121 -10.173 -1.024 4.818 1.00 11.24 C ATOM 1911 O LEU A 121 -9.981 -0.111 4.018 1.00 1.32 O ATOM 1912 CB LEU A 121 -8.057 -1.211 6.350 1.00 4.50 C ATOM 1913 CG LEU A 121 -7.525 -2.661 6.296 1.00 64.21 C ATOM 1914 CD1 LEU A 121 -7.837 -3.334 4.985 1.00 74.23 C ATOM 1915 CD2 LEU A 121 -6.026 -2.678 6.551 1.00 73.24 C ATOM 0 H LEU A 121 -9.835 -2.568 7.592 1.00 63.41 H new ATOM 0 HA LEU A 121 -9.713 0.061 6.577 1.00 34.04 H new ATOM 0 HB2 LEU A 121 -7.585 -0.655 5.540 1.00 4.50 H new ATOM 0 HB3 LEU A 121 -7.712 -0.767 7.284 1.00 4.50 H new ATOM 0 HG LEU A 121 -8.034 -3.224 7.078 1.00 64.21 H new ATOM 0 HD11 LEU A 121 -7.443 -4.350 4.995 1.00 74.23 H new ATOM 0 HD12 LEU A 121 -8.917 -3.365 4.840 1.00 74.23 H new ATOM 0 HD13 LEU A 121 -7.377 -2.775 4.170 1.00 74.23 H new ATOM 0 HD21 LEU A 121 -5.662 -3.705 6.511 1.00 73.24 H new ATOM 0 HD22 LEU A 121 -5.521 -2.083 5.790 1.00 73.24 H new ATOM 0 HD23 LEU A 121 -5.820 -2.258 7.536 1.00 73.24 H new ATOM 1927 N LYS A 122 -10.897 -2.112 4.525 1.00 51.22 N ATOM 1928 CA LYS A 122 -11.621 -2.291 3.261 1.00 3.42 C ATOM 1929 C LYS A 122 -12.635 -1.152 3.090 1.00 61.15 C ATOM 1930 O LYS A 122 -12.922 -0.710 1.973 1.00 0.41 O ATOM 1931 CB LYS A 122 -12.317 -3.696 3.290 1.00 3.53 C ATOM 1932 CG LYS A 122 -13.173 -4.120 2.071 1.00 3.53 C ATOM 1933 CD LYS A 122 -14.554 -3.455 2.042 1.00 12.31 C ATOM 1934 CE LYS A 122 -15.373 -3.941 0.857 1.00 21.04 C ATOM 1935 NZ LYS A 122 -16.738 -3.362 0.836 1.00 33.22 N ATOM 0 H LYS A 122 -10.997 -2.900 5.165 1.00 51.22 H new ATOM 0 HA LYS A 122 -10.943 -2.256 2.408 1.00 3.42 H new ATOM 0 HB2 LYS A 122 -11.540 -4.448 3.428 1.00 3.53 H new ATOM 0 HB3 LYS A 122 -12.956 -3.732 4.173 1.00 3.53 H new ATOM 0 HG2 LYS A 122 -12.638 -3.871 1.155 1.00 3.53 H new ATOM 0 HG3 LYS A 122 -13.298 -5.203 2.082 1.00 3.53 H new ATOM 0 HD2 LYS A 122 -15.085 -3.673 2.969 1.00 12.31 H new ATOM 0 HD3 LYS A 122 -14.438 -2.372 1.988 1.00 12.31 H new ATOM 0 HE2 LYS A 122 -14.857 -3.682 -0.068 1.00 21.04 H new ATOM 0 HE3 LYS A 122 -15.443 -5.028 0.889 1.00 21.04 H new ATOM 0 HZ1 LYS A 122 -17.066 -3.281 -0.148 1.00 33.22 H new ATOM 0 HZ2 LYS A 122 -17.385 -3.979 1.366 1.00 33.22 H new ATOM 0 HZ3 LYS A 122 -16.722 -2.419 1.275 1.00 33.22 H new ATOM 1949 N MET A 123 -13.130 -0.648 4.209 1.00 14.40 N ATOM 1950 CA MET A 123 -14.129 0.402 4.202 1.00 32.41 C ATOM 1951 C MET A 123 -13.491 1.731 3.861 1.00 44.54 C ATOM 1952 O MET A 123 -14.151 2.622 3.343 1.00 23.34 O ATOM 1953 CB MET A 123 -14.836 0.503 5.558 1.00 41.31 C ATOM 1954 CG MET A 123 -15.469 -0.795 6.029 1.00 74.53 C ATOM 1955 SD MET A 123 -16.612 -1.501 4.817 1.00 63.42 S ATOM 1956 CE MET A 123 -17.820 -0.181 4.666 1.00 74.54 C ATOM 0 H MET A 123 -12.851 -0.955 5.141 1.00 14.40 H new ATOM 0 HA MET A 123 -14.871 0.151 3.444 1.00 32.41 H new ATOM 0 HB2 MET A 123 -14.117 0.836 6.306 1.00 41.31 H new ATOM 0 HB3 MET A 123 -15.609 1.269 5.496 1.00 41.31 H new ATOM 0 HG2 MET A 123 -14.683 -1.519 6.245 1.00 74.53 H new ATOM 0 HG3 MET A 123 -16.002 -0.616 6.962 1.00 74.53 H new ATOM 0 HE1 MET A 123 -18.700 -0.551 4.140 1.00 74.54 H new ATOM 0 HE2 MET A 123 -18.109 0.163 5.659 1.00 74.54 H new ATOM 0 HE3 MET A 123 -17.385 0.648 4.107 1.00 74.54 H new ATOM 1966 N ILE A 124 -12.198 1.842 4.126 1.00 61.35 N ATOM 1967 CA ILE A 124 -11.447 3.067 3.862 1.00 54.01 C ATOM 1968 C ILE A 124 -11.245 3.207 2.360 1.00 31.13 C ATOM 1969 O ILE A 124 -11.379 4.299 1.798 1.00 52.13 O ATOM 1970 CB ILE A 124 -10.058 3.043 4.566 1.00 40.54 C ATOM 1971 CG1 ILE A 124 -10.212 2.763 6.074 1.00 21.54 C ATOM 1972 CG2 ILE A 124 -9.301 4.356 4.341 1.00 30.50 C ATOM 1973 CD1 ILE A 124 -11.050 3.772 6.826 1.00 13.33 C ATOM 0 H ILE A 124 -11.639 1.090 4.529 1.00 61.35 H new ATOM 0 HA ILE A 124 -12.013 3.912 4.255 1.00 54.01 H new ATOM 0 HB ILE A 124 -9.476 2.235 4.122 1.00 40.54 H new ATOM 0 HG12 ILE A 124 -10.656 1.776 6.202 1.00 21.54 H new ATOM 0 HG13 ILE A 124 -9.220 2.727 6.525 1.00 21.54 H new ATOM 0 HG21 ILE A 124 -8.335 4.310 4.844 1.00 30.50 H new ATOM 0 HG22 ILE A 124 -9.147 4.509 3.273 1.00 30.50 H new ATOM 0 HG23 ILE A 124 -9.882 5.185 4.746 1.00 30.50 H new ATOM 0 HD11 ILE A 124 -11.101 3.491 7.878 1.00 13.33 H new ATOM 0 HD12 ILE A 124 -10.598 4.760 6.736 1.00 13.33 H new ATOM 0 HD13 ILE A 124 -12.056 3.794 6.407 1.00 13.33 H new ATOM 1985 N LEU A 125 -10.953 2.077 1.720 1.00 71.31 N ATOM 1986 CA LEU A 125 -10.765 2.010 0.274 1.00 71.14 C ATOM 1987 C LEU A 125 -12.044 2.413 -0.444 1.00 31.22 C ATOM 1988 O LEU A 125 -12.022 3.156 -1.414 1.00 41.43 O ATOM 1989 CB LEU A 125 -10.392 0.580 -0.142 1.00 62.44 C ATOM 1990 CG LEU A 125 -10.204 0.342 -1.646 1.00 64.51 C ATOM 1991 CD1 LEU A 125 -9.019 1.118 -2.176 1.00 61.33 C ATOM 1992 CD2 LEU A 125 -10.061 -1.131 -1.951 1.00 63.24 C ATOM 0 H LEU A 125 -10.840 1.180 2.192 1.00 71.31 H new ATOM 0 HA LEU A 125 -9.963 2.695 0.001 1.00 71.14 H new ATOM 0 HB2 LEU A 125 -9.468 0.304 0.367 1.00 62.44 H new ATOM 0 HB3 LEU A 125 -11.168 -0.096 0.218 1.00 62.44 H new ATOM 0 HG LEU A 125 -11.098 0.705 -2.153 1.00 64.51 H new ATOM 0 HD11 LEU A 125 -8.910 0.930 -3.244 1.00 61.33 H new ATOM 0 HD12 LEU A 125 -9.178 2.183 -2.009 1.00 61.33 H new ATOM 0 HD13 LEU A 125 -8.115 0.800 -1.657 1.00 61.33 H new ATOM 0 HD21 LEU A 125 -9.929 -1.269 -3.024 1.00 63.24 H new ATOM 0 HD22 LEU A 125 -9.193 -1.529 -1.425 1.00 63.24 H new ATOM 0 HD23 LEU A 125 -10.957 -1.659 -1.625 1.00 63.24 H new ATOM 2004 N MET A 126 -13.155 1.909 0.055 1.00 61.44 N ATOM 2005 CA MET A 126 -14.451 2.181 -0.542 1.00 53.50 C ATOM 2006 C MET A 126 -14.922 3.587 -0.204 1.00 55.13 C ATOM 2007 O MET A 126 -15.715 4.180 -0.938 1.00 31.33 O ATOM 2008 CB MET A 126 -15.473 1.140 -0.100 1.00 11.13 C ATOM 2009 CG MET A 126 -15.119 -0.291 -0.511 1.00 24.33 C ATOM 2010 SD MET A 126 -15.053 -0.547 -2.304 1.00 63.43 S ATOM 2011 CE MET A 126 -16.743 -0.160 -2.772 1.00 13.24 C ATOM 0 H MET A 126 -13.188 1.306 0.877 1.00 61.44 H new ATOM 0 HA MET A 126 -14.348 2.117 -1.625 1.00 53.50 H new ATOM 0 HB2 MET A 126 -15.573 1.182 0.985 1.00 11.13 H new ATOM 0 HB3 MET A 126 -16.445 1.398 -0.520 1.00 11.13 H new ATOM 0 HG2 MET A 126 -14.152 -0.553 -0.081 1.00 24.33 H new ATOM 0 HG3 MET A 126 -15.854 -0.973 -0.084 1.00 24.33 H new ATOM 0 HE1 MET A 126 -16.944 -0.553 -3.769 1.00 13.24 H new ATOM 0 HE2 MET A 126 -17.431 -0.613 -2.058 1.00 13.24 H new ATOM 0 HE3 MET A 126 -16.882 0.921 -2.773 1.00 13.24 H new ATOM 2021 N TYR A 127 -14.432 4.112 0.911 1.00 5.11 N ATOM 2022 CA TYR A 127 -14.715 5.475 1.326 1.00 64.35 C ATOM 2023 C TYR A 127 -14.020 6.459 0.411 1.00 55.40 C ATOM 2024 O TYR A 127 -14.667 7.225 -0.301 1.00 0.13 O ATOM 2025 CB TYR A 127 -14.288 5.701 2.796 1.00 64.23 C ATOM 2026 CG TYR A 127 -14.257 7.153 3.235 1.00 33.04 C ATOM 2027 CD1 TYR A 127 -15.418 7.899 3.376 1.00 0.14 C ATOM 2028 CD2 TYR A 127 -13.043 7.774 3.500 1.00 72.30 C ATOM 2029 CE1 TYR A 127 -15.364 9.224 3.767 1.00 45.21 C ATOM 2030 CE2 TYR A 127 -12.984 9.088 3.890 1.00 2.44 C ATOM 2031 CZ TYR A 127 -14.141 9.812 4.022 1.00 14.24 C ATOM 2032 OH TYR A 127 -14.076 11.136 4.406 1.00 34.42 O ATOM 0 H TYR A 127 -13.826 3.602 1.553 1.00 5.11 H new ATOM 0 HA TYR A 127 -15.790 5.639 1.257 1.00 64.35 H new ATOM 0 HB2 TYR A 127 -14.971 5.154 3.446 1.00 64.23 H new ATOM 0 HB3 TYR A 127 -13.297 5.271 2.942 1.00 64.23 H new ATOM 0 HD1 TYR A 127 -16.375 7.439 3.178 1.00 0.14 H new ATOM 0 HD2 TYR A 127 -12.127 7.211 3.397 1.00 72.30 H new ATOM 0 HE1 TYR A 127 -16.274 9.796 3.872 1.00 45.21 H new ATOM 0 HE2 TYR A 127 -12.029 9.551 4.092 1.00 2.44 H new ATOM 0 HH TYR A 127 -13.140 11.390 4.546 1.00 34.42 H new ATOM 2042 N GLU A 128 -12.719 6.429 0.416 1.00 41.55 N ATOM 2043 CA GLU A 128 -11.964 7.313 -0.391 1.00 15.22 C ATOM 2044 C GLU A 128 -11.440 6.485 -1.551 1.00 25.15 C ATOM 2045 O GLU A 128 -10.341 5.917 -1.504 1.00 3.53 O ATOM 2046 CB GLU A 128 -10.850 7.963 0.459 1.00 21.23 C ATOM 2047 CG GLU A 128 -10.216 9.229 -0.108 1.00 15.11 C ATOM 2048 CD GLU A 128 -9.434 9.028 -1.367 1.00 33.30 C ATOM 2049 OE1 GLU A 128 -8.227 8.716 -1.271 1.00 11.22 O ATOM 2050 OE2 GLU A 128 -9.985 9.189 -2.451 1.00 1.32 O ATOM 0 H GLU A 128 -12.162 5.789 0.982 1.00 41.55 H new ATOM 0 HA GLU A 128 -12.553 8.141 -0.785 1.00 15.22 H new ATOM 0 HB2 GLU A 128 -11.262 8.197 1.441 1.00 21.23 H new ATOM 0 HB3 GLU A 128 -10.062 7.225 0.612 1.00 21.23 H new ATOM 0 HG2 GLU A 128 -11.003 9.959 -0.298 1.00 15.11 H new ATOM 0 HG3 GLU A 128 -9.558 9.659 0.647 1.00 15.11 H new