USER MOD reduce.3.24.130724 H: found=0, std=0, add=715, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 718 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 374 TYR OH : rot 180:sc= -0.277 USER MOD Set 1.2: A 384 GLN : amide:sc= -0.534 K(o=-0.81,f=-0.1) USER MOD Set 2.1: A 381 ASN : amide:sc= 0.683 K(o=-0.67,f=-4.5) USER MOD Set 2.2: A 391 ASN : amide:sc= -1.36! C(o=-0.67!,f=-4.9!) USER MOD Set 3.1: A 365 THR OG1 : rot 120:sc= 0 USER MOD Set 3.2: A 443 MET CE :methyl 165:sc= -0.564 (180deg=-1.56) USER MOD Single : A 357 TYR OH : rot 180:sc= 0 USER MOD Single : A 361 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 363 MET CE :methyl -162:sc= -0.107 (180deg=-0.551) USER MOD Single : A 366 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 372 TYR OH : rot 180:sc= 0 USER MOD Single : A 373 THR OG1 : rot 180:sc= 0 USER MOD Single : A 375 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 379 TYR OH : rot 180:sc= 0 USER MOD Single : A 386 SER OG : rot 92:sc= 1.24 USER MOD Single : A 394 SER OG : rot 180:sc= -0.017 USER MOD Single : A 395 GLN : amide:sc= 0.705 K(o=0.71,f=-0.6) USER MOD Single : A 398 ASN : amide:sc= 0.674 K(o=0.67,f=0.086) USER MOD Single : A 401 LYS NZ :NH3+ 141:sc= 1.07 (180deg=0.111) USER MOD Single : A 402 TYR OH : rot 180:sc= 0.0724 USER MOD Single : A 404 ASN : amide:sc= -0.892 K(o=-0.89,f=0) USER MOD Single : A 406 GLN : amide:sc= -0.0524 X(o=-0.052,f=-0.12) USER MOD Single : A 407 SER OG : rot 180:sc= 0 USER MOD Single : A 410 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 413 HIS : no HE2:sc= 0.984 K(o=0.98,f=-3.7!) USER MOD Single : A 415 SER OG : rot 142:sc= 1.2 USER MOD Single : A 419 THR OG1 : rot 180:sc= 0 USER MOD Single : A 426 ASN : amide:sc= 0.656 K(o=0.66,f=-0.23) USER MOD Single : A 430 SER OG : rot 180:sc= -0.142 USER MOD Single : A 435 GLN : amide:sc= -0.776 X(o=-0.78,f=-0.6) USER MOD Single : A 436 LYS NZ :NH3+ -178:sc= 0.844 (180deg=0.786) USER MOD Single : A 439 TYR OH : rot -113:sc= 2.15 USER MOD Single : A 442 LYS NZ :NH3+ 158:sc= 0.751 (180deg=0.489) USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 445 SER OG : rot 180:sc= -0.377 USER MOD Single : A 450 SER OG : rot 180:sc= -0.0412 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 357 1.774 -1.375 1.303 1.00 53.22 N ATOM 2 CA TYR A 357 2.752 -0.377 1.715 1.00 4.13 C ATOM 3 C TYR A 357 3.569 0.048 0.523 1.00 12.52 C ATOM 4 O TYR A 357 3.530 -0.605 -0.520 1.00 32.23 O ATOM 5 CB TYR A 357 3.657 -0.916 2.828 1.00 1.45 C ATOM 6 CG TYR A 357 2.909 -1.283 4.085 1.00 32.33 C ATOM 7 CD1 TYR A 357 2.480 -0.301 4.958 1.00 20.11 C ATOM 8 CD2 TYR A 357 2.634 -2.608 4.399 1.00 31.35 C ATOM 9 CE1 TYR A 357 1.797 -0.617 6.107 1.00 71.15 C ATOM 10 CE2 TYR A 357 1.947 -2.936 5.551 1.00 2.45 C ATOM 11 CZ TYR A 357 1.531 -1.934 6.401 1.00 64.15 C ATOM 12 OH TYR A 357 0.842 -2.252 7.558 1.00 32.53 O ATOM 0 HA TYR A 357 2.223 0.488 2.114 1.00 4.13 H new ATOM 0 HB2 TYR A 357 4.188 -1.794 2.461 1.00 1.45 H new ATOM 0 HB3 TYR A 357 4.410 -0.166 3.069 1.00 1.45 H new ATOM 0 HD1 TYR A 357 2.686 0.735 4.732 1.00 20.11 H new ATOM 0 HD2 TYR A 357 2.962 -3.392 3.733 1.00 31.35 H new ATOM 0 HE1 TYR A 357 1.470 0.165 6.776 1.00 71.15 H new ATOM 0 HE2 TYR A 357 1.737 -3.969 5.784 1.00 2.45 H new ATOM 0 HH TYR A 357 0.735 -3.224 7.618 1.00 32.53 H new ATOM 24 N ARG A 358 4.290 1.129 0.661 1.00 31.43 N ATOM 25 CA ARG A 358 5.085 1.671 -0.412 1.00 71.30 C ATOM 26 C ARG A 358 6.219 2.452 0.226 1.00 10.32 C ATOM 27 O ARG A 358 6.094 2.862 1.392 1.00 13.22 O ATOM 28 CB ARG A 358 4.187 2.591 -1.255 1.00 10.31 C ATOM 29 CG ARG A 358 4.776 3.093 -2.562 1.00 42.45 C ATOM 30 CD ARG A 358 3.734 3.909 -3.308 1.00 34.34 C ATOM 31 NE ARG A 358 4.171 4.339 -4.643 1.00 42.25 N ATOM 32 CZ ARG A 358 3.352 4.871 -5.561 1.00 12.43 C ATOM 33 NH1 ARG A 358 2.070 5.031 -5.285 1.00 40.30 N ATOM 34 NH2 ARG A 358 3.812 5.230 -6.741 1.00 24.00 N ATOM 0 H ARG A 358 4.343 1.664 1.528 1.00 31.43 H new ATOM 0 HA ARG A 358 5.494 0.896 -1.060 1.00 71.30 H new ATOM 0 HB2 ARG A 358 3.264 2.056 -1.479 1.00 10.31 H new ATOM 0 HB3 ARG A 358 3.916 3.455 -0.648 1.00 10.31 H new ATOM 0 HG2 ARG A 358 5.658 3.703 -2.365 1.00 42.45 H new ATOM 0 HG3 ARG A 358 5.100 2.251 -3.174 1.00 42.45 H new ATOM 0 HD2 ARG A 358 2.823 3.318 -3.405 1.00 34.34 H new ATOM 0 HD3 ARG A 358 3.481 4.789 -2.716 1.00 34.34 H new ATOM 0 HE ARG A 358 5.155 4.226 -4.886 1.00 42.25 H new ATOM 0 HH11 ARG A 358 1.705 4.750 -4.375 1.00 40.30 H new ATOM 0 HH12 ARG A 358 1.445 5.436 -5.982 1.00 40.30 H new ATOM 0 HH21 ARG A 358 4.800 5.104 -6.963 1.00 24.00 H new ATOM 0 HH22 ARG A 358 3.181 5.634 -7.433 1.00 24.00 H new ATOM 48 N ALA A 359 7.319 2.621 -0.488 1.00 15.00 N ATOM 49 CA ALA A 359 8.451 3.372 0.028 1.00 51.31 C ATOM 50 C ALA A 359 8.059 4.813 0.295 1.00 64.33 C ATOM 51 O ALA A 359 7.194 5.371 -0.395 1.00 70.34 O ATOM 52 CB ALA A 359 9.622 3.317 -0.941 1.00 42.40 C ATOM 0 H ALA A 359 7.452 2.248 -1.428 1.00 15.00 H new ATOM 0 HA ALA A 359 8.759 2.915 0.968 1.00 51.31 H new ATOM 0 HB1 ALA A 359 10.458 3.886 -0.534 1.00 42.40 H new ATOM 0 HB2 ALA A 359 9.925 2.280 -1.087 1.00 42.40 H new ATOM 0 HB3 ALA A 359 9.323 3.745 -1.898 1.00 42.40 H new ATOM 58 N ILE A 360 8.681 5.412 1.281 1.00 2.24 N ATOM 59 CA ILE A 360 8.387 6.778 1.616 1.00 14.21 C ATOM 60 C ILE A 360 9.162 7.679 0.672 1.00 10.23 C ATOM 61 O ILE A 360 10.404 7.686 0.664 1.00 14.21 O ATOM 62 CB ILE A 360 8.750 7.096 3.096 1.00 12.22 C ATOM 63 CG1 ILE A 360 7.978 6.165 4.061 1.00 32.13 C ATOM 64 CG2 ILE A 360 8.480 8.563 3.428 1.00 62.12 C ATOM 65 CD1 ILE A 360 6.460 6.257 3.953 1.00 43.44 C ATOM 0 H ILE A 360 9.394 4.973 1.864 1.00 2.24 H new ATOM 0 HA ILE A 360 7.316 6.950 1.508 1.00 14.21 H new ATOM 0 HB ILE A 360 9.817 6.915 3.225 1.00 12.22 H new ATOM 0 HG12 ILE A 360 8.281 5.135 3.871 1.00 32.13 H new ATOM 0 HG13 ILE A 360 8.271 6.400 5.084 1.00 32.13 H new ATOM 0 HG21 ILE A 360 8.743 8.755 4.468 1.00 62.12 H new ATOM 0 HG22 ILE A 360 9.081 9.200 2.778 1.00 62.12 H new ATOM 0 HG23 ILE A 360 7.423 8.782 3.275 1.00 62.12 H new ATOM 0 HD11 ILE A 360 6.002 5.571 4.665 1.00 43.44 H new ATOM 0 HD12 ILE A 360 6.141 7.275 4.174 1.00 43.44 H new ATOM 0 HD13 ILE A 360 6.150 5.991 2.942 1.00 43.44 H new ATOM 77 N LYS A 361 8.436 8.423 -0.115 1.00 31.33 N ATOM 78 CA LYS A 361 9.015 9.231 -1.150 1.00 32.03 C ATOM 79 C LYS A 361 9.408 10.592 -0.613 1.00 13.53 C ATOM 80 O LYS A 361 8.570 11.328 -0.091 1.00 34.53 O ATOM 81 CB LYS A 361 8.016 9.387 -2.302 1.00 10.30 C ATOM 82 CG LYS A 361 7.489 8.055 -2.838 1.00 51.02 C ATOM 83 CD LYS A 361 6.550 8.231 -4.028 1.00 14.42 C ATOM 84 CE LYS A 361 7.257 8.855 -5.229 1.00 1.24 C ATOM 85 NZ LYS A 361 6.362 8.964 -6.398 1.00 71.14 N ATOM 0 H LYS A 361 7.420 8.486 -0.055 1.00 31.33 H new ATOM 0 HA LYS A 361 9.915 8.737 -1.516 1.00 32.03 H new ATOM 0 HB2 LYS A 361 7.175 9.992 -1.963 1.00 10.30 H new ATOM 0 HB3 LYS A 361 8.494 9.933 -3.115 1.00 10.30 H new ATOM 0 HG2 LYS A 361 8.330 7.428 -3.134 1.00 51.02 H new ATOM 0 HG3 LYS A 361 6.964 7.529 -2.041 1.00 51.02 H new ATOM 0 HD2 LYS A 361 6.140 7.262 -4.312 1.00 14.42 H new ATOM 0 HD3 LYS A 361 5.709 8.860 -3.736 1.00 14.42 H new ATOM 0 HE2 LYS A 361 7.625 9.845 -4.960 1.00 1.24 H new ATOM 0 HE3 LYS A 361 8.126 8.252 -5.492 1.00 1.24 H new ATOM 0 HZ1 LYS A 361 6.879 9.392 -7.192 1.00 71.14 H new ATOM 0 HZ2 LYS A 361 6.031 8.017 -6.671 1.00 71.14 H new ATOM 0 HZ3 LYS A 361 5.545 9.560 -6.155 1.00 71.14 H new ATOM 99 N GLY A 362 10.675 10.922 -0.732 1.00 43.11 N ATOM 100 CA GLY A 362 11.143 12.215 -0.290 1.00 30.13 C ATOM 101 C GLY A 362 11.382 13.143 -1.458 1.00 3.23 C ATOM 102 O GLY A 362 12.505 13.552 -1.705 1.00 21.15 O ATOM 0 H GLY A 362 11.394 10.317 -1.128 1.00 43.11 H new ATOM 0 HA2 GLY A 362 10.410 12.658 0.385 1.00 30.13 H new ATOM 0 HA3 GLY A 362 12.066 12.095 0.277 1.00 30.13 H new ATOM 106 N MET A 363 10.311 13.479 -2.163 1.00 21.11 N ATOM 107 CA MET A 363 10.350 14.333 -3.385 1.00 30.30 C ATOM 108 C MET A 363 10.340 15.812 -3.024 1.00 11.44 C ATOM 109 O MET A 363 9.810 16.640 -3.762 1.00 24.13 O ATOM 110 CB MET A 363 9.124 14.003 -4.273 1.00 71.04 C ATOM 111 CG MET A 363 7.766 14.179 -3.594 1.00 33.14 C ATOM 112 SD MET A 363 6.381 13.718 -4.666 1.00 11.33 S ATOM 113 CE MET A 363 6.567 14.900 -6.004 1.00 72.21 C ATOM 0 H MET A 363 9.370 13.172 -1.916 1.00 21.11 H new ATOM 0 HA MET A 363 11.273 14.125 -3.926 1.00 30.30 H new ATOM 0 HB2 MET A 363 9.155 14.638 -5.159 1.00 71.04 H new ATOM 0 HB3 MET A 363 9.210 12.972 -4.616 1.00 71.04 H new ATOM 0 HG2 MET A 363 7.736 13.573 -2.689 1.00 33.14 H new ATOM 0 HG3 MET A 363 7.651 15.218 -3.286 1.00 33.14 H new ATOM 0 HE1 MET A 363 5.635 14.963 -6.566 1.00 72.21 H new ATOM 0 HE2 MET A 363 6.810 15.880 -5.593 1.00 72.21 H new ATOM 0 HE3 MET A 363 7.369 14.576 -6.667 1.00 72.21 H new ATOM 123 N GLU A 364 11.012 16.139 -1.962 1.00 13.33 N ATOM 124 CA GLU A 364 10.933 17.458 -1.386 1.00 23.33 C ATOM 125 C GLU A 364 11.824 18.500 -2.073 1.00 60.54 C ATOM 126 O GLU A 364 11.578 19.702 -1.930 1.00 55.32 O ATOM 127 CB GLU A 364 11.256 17.392 0.108 1.00 13.42 C ATOM 128 CG GLU A 364 10.399 16.390 0.873 1.00 42.45 C ATOM 129 CD GLU A 364 8.917 16.653 0.737 1.00 31.24 C ATOM 130 OE1 GLU A 364 8.321 16.233 -0.270 1.00 12.21 O ATOM 131 OE2 GLU A 364 8.320 17.266 1.640 1.00 63.21 O ATOM 0 H GLU A 364 11.634 15.501 -1.465 1.00 13.33 H new ATOM 0 HA GLU A 364 9.908 17.795 -1.542 1.00 23.33 H new ATOM 0 HB2 GLU A 364 12.306 17.129 0.233 1.00 13.42 H new ATOM 0 HB3 GLU A 364 11.121 18.381 0.545 1.00 13.42 H new ATOM 0 HG2 GLU A 364 10.618 15.384 0.514 1.00 42.45 H new ATOM 0 HG3 GLU A 364 10.672 16.418 1.928 1.00 42.45 H new ATOM 138 N THR A 365 12.849 18.085 -2.801 1.00 14.43 N ATOM 139 CA THR A 365 13.735 19.077 -3.374 1.00 70.14 C ATOM 140 C THR A 365 13.810 18.951 -4.900 1.00 62.42 C ATOM 141 O THR A 365 13.918 17.842 -5.435 1.00 41.14 O ATOM 142 CB THR A 365 15.144 18.967 -2.761 1.00 62.35 C ATOM 143 OG1 THR A 365 15.018 18.807 -1.345 1.00 41.33 O ATOM 144 CG2 THR A 365 15.894 20.254 -2.996 1.00 32.32 C ATOM 0 H THR A 365 13.080 17.112 -3.001 1.00 14.43 H new ATOM 0 HA THR A 365 13.323 20.058 -3.138 1.00 70.14 H new ATOM 0 HB THR A 365 15.668 18.125 -3.213 1.00 62.35 H new ATOM 0 HG1 THR A 365 15.426 17.958 -1.074 1.00 41.33 H new ATOM 0 HG21 THR A 365 16.891 20.178 -2.563 1.00 32.32 H new ATOM 0 HG22 THR A 365 15.977 20.437 -4.067 1.00 32.32 H new ATOM 0 HG23 THR A 365 15.357 21.079 -2.528 1.00 32.32 H new ATOM 152 N LYS A 366 13.735 20.082 -5.591 1.00 12.03 N ATOM 153 CA LYS A 366 13.849 20.114 -7.022 1.00 10.50 C ATOM 154 C LYS A 366 14.572 21.380 -7.413 1.00 15.12 C ATOM 155 O LYS A 366 14.440 22.402 -6.733 1.00 10.35 O ATOM 156 CB LYS A 366 12.479 20.009 -7.722 1.00 41.31 C ATOM 157 CG LYS A 366 11.490 21.115 -7.393 1.00 64.40 C ATOM 158 CD LYS A 366 10.196 20.922 -8.160 1.00 55.04 C ATOM 159 CE LYS A 366 9.196 22.018 -7.852 1.00 11.24 C ATOM 160 NZ LYS A 366 7.937 21.841 -8.613 1.00 43.22 N ATOM 0 H LYS A 366 13.593 20.997 -5.163 1.00 12.03 H new ATOM 0 HA LYS A 366 14.417 19.244 -7.352 1.00 10.50 H new ATOM 0 HB2 LYS A 366 12.641 19.999 -8.800 1.00 41.31 H new ATOM 0 HB3 LYS A 366 12.028 19.052 -7.459 1.00 41.31 H new ATOM 0 HG2 LYS A 366 11.286 21.121 -6.322 1.00 64.40 H new ATOM 0 HG3 LYS A 366 11.924 22.084 -7.640 1.00 64.40 H new ATOM 0 HD2 LYS A 366 10.405 20.909 -9.230 1.00 55.04 H new ATOM 0 HD3 LYS A 366 9.764 19.953 -7.908 1.00 55.04 H new ATOM 0 HE2 LYS A 366 8.978 22.022 -6.784 1.00 11.24 H new ATOM 0 HE3 LYS A 366 9.633 22.987 -8.092 1.00 11.24 H new ATOM 0 HZ1 LYS A 366 7.277 22.609 -8.376 1.00 43.22 H new ATOM 0 HZ2 LYS A 366 8.142 21.862 -9.632 1.00 43.22 H new ATOM 0 HZ3 LYS A 366 7.507 20.927 -8.365 1.00 43.22 H new ATOM 174 N ARG A 367 15.349 21.322 -8.441 1.00 14.42 N ATOM 175 CA ARG A 367 16.103 22.456 -8.865 1.00 22.20 C ATOM 176 C ARG A 367 16.252 22.359 -10.366 1.00 4.35 C ATOM 177 O ARG A 367 16.584 21.293 -10.876 1.00 43.20 O ATOM 178 CB ARG A 367 17.478 22.353 -8.233 1.00 64.44 C ATOM 179 CG ARG A 367 18.315 23.593 -8.293 1.00 42.02 C ATOM 180 CD ARG A 367 17.837 24.627 -7.297 1.00 32.03 C ATOM 181 NE ARG A 367 18.686 25.834 -7.340 1.00 24.54 N ATOM 182 CZ ARG A 367 18.605 26.882 -6.507 1.00 62.41 C ATOM 183 NH1 ARG A 367 17.621 26.965 -5.615 1.00 41.32 N ATOM 184 NH2 ARG A 367 19.497 27.862 -6.596 1.00 64.44 N ATOM 0 H ARG A 367 15.481 20.487 -9.012 1.00 14.42 H new ATOM 0 HA ARG A 367 15.622 23.392 -8.583 1.00 22.20 H new ATOM 0 HB2 ARG A 367 17.357 22.069 -7.188 1.00 64.44 H new ATOM 0 HB3 ARG A 367 18.023 21.545 -8.722 1.00 64.44 H new ATOM 0 HG2 ARG A 367 19.356 23.342 -8.089 1.00 42.02 H new ATOM 0 HG3 ARG A 367 18.279 24.010 -9.299 1.00 42.02 H new ATOM 0 HD2 ARG A 367 16.804 24.897 -7.515 1.00 32.03 H new ATOM 0 HD3 ARG A 367 17.851 24.204 -6.293 1.00 32.03 H new ATOM 0 HE ARG A 367 19.398 25.875 -8.069 1.00 24.54 H new ATOM 0 HH11 ARG A 367 16.919 26.227 -5.560 1.00 41.32 H new ATOM 0 HH12 ARG A 367 17.569 27.766 -4.986 1.00 41.32 H new ATOM 0 HH21 ARG A 367 20.238 27.815 -7.295 1.00 64.44 H new ATOM 0 HH22 ARG A 367 19.441 28.662 -5.965 1.00 64.44 H new ATOM 198 N GLU A 368 16.019 23.420 -11.077 1.00 33.20 N ATOM 199 CA GLU A 368 16.161 23.354 -12.487 1.00 13.53 C ATOM 200 C GLU A 368 17.554 23.764 -12.863 1.00 3.04 C ATOM 201 O GLU A 368 17.966 24.919 -12.684 1.00 65.14 O ATOM 202 CB GLU A 368 15.068 24.120 -13.242 1.00 13.05 C ATOM 203 CG GLU A 368 14.977 25.615 -12.990 1.00 13.50 C ATOM 204 CD GLU A 368 13.859 26.242 -13.788 1.00 74.43 C ATOM 205 OE1 GLU A 368 14.020 26.423 -15.018 1.00 14.53 O ATOM 206 OE2 GLU A 368 12.783 26.532 -13.203 1.00 71.44 O ATOM 0 H GLU A 368 15.734 24.326 -10.705 1.00 33.20 H new ATOM 0 HA GLU A 368 16.015 22.321 -12.803 1.00 13.53 H new ATOM 0 HB2 GLU A 368 15.221 23.965 -14.310 1.00 13.05 H new ATOM 0 HB3 GLU A 368 14.106 23.674 -12.990 1.00 13.05 H new ATOM 0 HG2 GLU A 368 14.814 25.797 -11.928 1.00 13.50 H new ATOM 0 HG3 GLU A 368 15.923 26.088 -13.253 1.00 13.50 H new ATOM 213 N ILE A 369 18.299 22.806 -13.324 1.00 2.31 N ATOM 214 CA ILE A 369 19.686 23.003 -13.608 1.00 22.12 C ATOM 215 C ILE A 369 19.960 22.776 -15.091 1.00 12.24 C ATOM 216 O ILE A 369 19.656 21.718 -15.632 1.00 72.14 O ATOM 217 CB ILE A 369 20.503 22.024 -12.732 1.00 64.03 C ATOM 218 CG1 ILE A 369 20.099 22.245 -11.266 1.00 33.34 C ATOM 219 CG2 ILE A 369 21.997 22.256 -12.914 1.00 40.15 C ATOM 220 CD1 ILE A 369 20.556 21.194 -10.300 1.00 40.54 C ATOM 0 H ILE A 369 17.960 21.863 -13.514 1.00 2.31 H new ATOM 0 HA ILE A 369 19.978 24.027 -13.377 1.00 22.12 H new ATOM 0 HB ILE A 369 20.293 20.996 -13.029 1.00 64.03 H new ATOM 0 HG12 ILE A 369 20.494 23.208 -10.941 1.00 33.34 H new ATOM 0 HG13 ILE A 369 19.012 22.312 -11.214 1.00 33.34 H new ATOM 0 HG21 ILE A 369 22.553 21.557 -12.289 1.00 40.15 H new ATOM 0 HG22 ILE A 369 22.265 22.100 -13.959 1.00 40.15 H new ATOM 0 HG23 ILE A 369 22.245 23.277 -12.625 1.00 40.15 H new ATOM 0 HD11 ILE A 369 20.216 21.450 -9.296 1.00 40.54 H new ATOM 0 HD12 ILE A 369 20.140 20.229 -10.589 1.00 40.54 H new ATOM 0 HD13 ILE A 369 21.645 21.138 -10.311 1.00 40.54 H new ATOM 232 N GLY A 370 20.504 23.793 -15.736 1.00 24.02 N ATOM 233 CA GLY A 370 20.835 23.733 -17.155 1.00 41.32 C ATOM 234 C GLY A 370 19.627 23.517 -18.053 1.00 44.33 C ATOM 235 O GLY A 370 19.743 22.943 -19.125 1.00 51.13 O ATOM 0 H GLY A 370 20.730 24.684 -15.294 1.00 24.02 H new ATOM 0 HA2 GLY A 370 21.331 24.660 -17.443 1.00 41.32 H new ATOM 0 HA3 GLY A 370 21.549 22.926 -17.319 1.00 41.32 H new ATOM 239 N GLY A 371 18.470 23.969 -17.609 1.00 21.12 N ATOM 240 CA GLY A 371 17.263 23.836 -18.414 1.00 61.53 C ATOM 241 C GLY A 371 16.500 22.553 -18.145 1.00 35.24 C ATOM 242 O GLY A 371 15.398 22.352 -18.662 1.00 3.25 O ATOM 0 H GLY A 371 18.337 24.427 -16.707 1.00 21.12 H new ATOM 0 HA2 GLY A 371 16.610 24.687 -18.220 1.00 61.53 H new ATOM 0 HA3 GLY A 371 17.532 23.876 -19.469 1.00 61.53 H new ATOM 246 N TYR A 372 17.081 21.681 -17.365 1.00 45.33 N ATOM 247 CA TYR A 372 16.442 20.448 -16.992 1.00 12.12 C ATOM 248 C TYR A 372 16.230 20.353 -15.493 1.00 50.14 C ATOM 249 O TYR A 372 17.129 20.627 -14.700 1.00 14.54 O ATOM 250 CB TYR A 372 17.104 19.200 -17.638 1.00 0.01 C ATOM 251 CG TYR A 372 18.623 19.222 -17.720 1.00 61.14 C ATOM 252 CD1 TYR A 372 19.260 19.762 -18.833 1.00 20.11 C ATOM 253 CD2 TYR A 372 19.409 18.712 -16.717 1.00 3.22 C ATOM 254 CE1 TYR A 372 20.639 19.792 -18.929 1.00 54.34 C ATOM 255 CE2 TYR A 372 20.792 18.739 -16.808 1.00 0.40 C ATOM 256 CZ TYR A 372 21.398 19.278 -17.911 1.00 74.11 C ATOM 257 OH TYR A 372 22.787 19.305 -17.992 1.00 42.51 O ATOM 0 H TYR A 372 18.013 21.806 -16.970 1.00 45.33 H new ATOM 0 HA TYR A 372 15.440 20.460 -17.421 1.00 12.12 H new ATOM 0 HB2 TYR A 372 16.803 18.319 -17.072 1.00 0.01 H new ATOM 0 HB3 TYR A 372 16.707 19.083 -18.646 1.00 0.01 H new ATOM 0 HD1 TYR A 372 18.665 20.166 -19.639 1.00 20.11 H new ATOM 0 HD2 TYR A 372 18.942 18.283 -15.843 1.00 3.22 H new ATOM 0 HE1 TYR A 372 21.114 20.218 -19.800 1.00 54.34 H new ATOM 0 HE2 TYR A 372 21.393 18.334 -16.007 1.00 0.40 H new ATOM 0 HH TYR A 372 23.170 18.901 -17.185 1.00 42.51 H new ATOM 267 N THR A 373 15.036 19.984 -15.115 1.00 31.10 N ATOM 268 CA THR A 373 14.632 20.017 -13.735 1.00 31.04 C ATOM 269 C THR A 373 15.043 18.776 -12.993 1.00 23.54 C ATOM 270 O THR A 373 14.548 17.685 -13.264 1.00 42.10 O ATOM 271 CB THR A 373 13.106 20.239 -13.588 1.00 71.04 C ATOM 272 OG1 THR A 373 12.734 21.450 -14.259 1.00 65.01 O ATOM 273 CG2 THR A 373 12.710 20.353 -12.115 1.00 53.54 C ATOM 0 H THR A 373 14.315 19.652 -15.755 1.00 31.10 H new ATOM 0 HA THR A 373 15.150 20.866 -13.289 1.00 31.04 H new ATOM 0 HB THR A 373 12.592 19.385 -14.029 1.00 71.04 H new ATOM 0 HG1 THR A 373 11.768 21.591 -14.168 1.00 65.01 H new ATOM 0 HG21 THR A 373 11.634 20.509 -12.039 1.00 53.54 H new ATOM 0 HG22 THR A 373 12.982 19.436 -11.593 1.00 53.54 H new ATOM 0 HG23 THR A 373 13.232 21.196 -11.662 1.00 53.54 H new ATOM 281 N TYR A 374 15.924 18.955 -12.068 1.00 44.12 N ATOM 282 CA TYR A 374 16.366 17.905 -11.231 1.00 54.53 C ATOM 283 C TYR A 374 15.448 17.782 -10.072 1.00 60.41 C ATOM 284 O TYR A 374 15.202 18.751 -9.370 1.00 33.22 O ATOM 285 CB TYR A 374 17.784 18.154 -10.745 1.00 65.35 C ATOM 286 CG TYR A 374 18.846 17.819 -11.737 1.00 13.43 C ATOM 287 CD1 TYR A 374 19.254 18.727 -12.684 1.00 74.42 C ATOM 288 CD2 TYR A 374 19.453 16.576 -11.713 1.00 32.31 C ATOM 289 CE1 TYR A 374 20.239 18.407 -13.581 1.00 61.42 C ATOM 290 CE2 TYR A 374 20.436 16.249 -12.607 1.00 22.44 C ATOM 291 CZ TYR A 374 20.828 17.161 -13.537 1.00 73.34 C ATOM 292 OH TYR A 374 21.807 16.829 -14.433 1.00 73.11 O ATOM 0 H TYR A 374 16.362 19.855 -11.873 1.00 44.12 H new ATOM 0 HA TYR A 374 16.364 16.978 -11.804 1.00 54.53 H new ATOM 0 HB2 TYR A 374 17.881 19.204 -10.469 1.00 65.35 H new ATOM 0 HB3 TYR A 374 17.952 17.570 -9.840 1.00 65.35 H new ATOM 0 HD1 TYR A 374 18.793 19.703 -12.722 1.00 74.42 H new ATOM 0 HD2 TYR A 374 19.145 15.850 -10.975 1.00 32.31 H new ATOM 0 HE1 TYR A 374 20.553 19.129 -14.320 1.00 61.42 H new ATOM 0 HE2 TYR A 374 20.898 15.273 -12.574 1.00 22.44 H new ATOM 0 HH TYR A 374 22.113 15.914 -14.259 1.00 73.11 H new ATOM 302 N LYS A 375 14.929 16.621 -9.879 1.00 44.14 N ATOM 303 CA LYS A 375 14.048 16.376 -8.778 1.00 5.32 C ATOM 304 C LYS A 375 14.647 15.279 -7.972 1.00 71.24 C ATOM 305 O LYS A 375 14.936 14.211 -8.512 1.00 61.22 O ATOM 306 CB LYS A 375 12.670 15.928 -9.281 1.00 4.42 C ATOM 307 CG LYS A 375 11.624 15.769 -8.173 1.00 43.15 C ATOM 308 CD LYS A 375 10.313 15.159 -8.682 1.00 11.52 C ATOM 309 CE LYS A 375 9.778 15.899 -9.888 1.00 1.13 C ATOM 310 NZ LYS A 375 8.429 15.440 -10.284 1.00 63.32 N ATOM 0 H LYS A 375 15.099 15.811 -10.475 1.00 44.14 H new ATOM 0 HA LYS A 375 13.921 17.285 -8.190 1.00 5.32 H new ATOM 0 HB2 LYS A 375 12.306 16.654 -10.008 1.00 4.42 H new ATOM 0 HB3 LYS A 375 12.777 14.978 -9.805 1.00 4.42 H new ATOM 0 HG2 LYS A 375 12.031 15.138 -7.382 1.00 43.15 H new ATOM 0 HG3 LYS A 375 11.419 16.743 -7.730 1.00 43.15 H new ATOM 0 HD2 LYS A 375 10.476 14.113 -8.941 1.00 11.52 H new ATOM 0 HD3 LYS A 375 9.570 15.178 -7.885 1.00 11.52 H new ATOM 0 HE2 LYS A 375 9.745 16.966 -9.670 1.00 1.13 H new ATOM 0 HE3 LYS A 375 10.463 15.766 -10.725 1.00 1.13 H new ATOM 0 HZ1 LYS A 375 8.109 15.978 -11.114 1.00 63.32 H new ATOM 0 HZ2 LYS A 375 8.462 14.428 -10.519 1.00 63.32 H new ATOM 0 HZ3 LYS A 375 7.766 15.591 -9.497 1.00 63.32 H new ATOM 324 N VAL A 376 14.842 15.514 -6.715 1.00 43.45 N ATOM 325 CA VAL A 376 15.405 14.514 -5.879 1.00 13.35 C ATOM 326 C VAL A 376 14.350 13.921 -5.011 1.00 2.14 C ATOM 327 O VAL A 376 13.868 14.555 -4.064 1.00 40.21 O ATOM 328 CB VAL A 376 16.601 15.024 -5.031 1.00 63.21 C ATOM 329 CG1 VAL A 376 17.152 13.907 -4.145 1.00 23.23 C ATOM 330 CG2 VAL A 376 17.699 15.557 -5.941 1.00 64.22 C ATOM 0 H VAL A 376 14.618 16.392 -6.247 1.00 43.45 H new ATOM 0 HA VAL A 376 15.811 13.744 -6.535 1.00 13.35 H new ATOM 0 HB VAL A 376 16.247 15.831 -4.389 1.00 63.21 H new ATOM 0 HG11 VAL A 376 17.989 14.287 -3.560 1.00 23.23 H new ATOM 0 HG12 VAL A 376 16.369 13.556 -3.473 1.00 23.23 H new ATOM 0 HG13 VAL A 376 17.491 13.081 -4.770 1.00 23.23 H new ATOM 0 HG21 VAL A 376 18.533 15.912 -5.336 1.00 64.22 H new ATOM 0 HG22 VAL A 376 18.043 14.761 -6.601 1.00 64.22 H new ATOM 0 HG23 VAL A 376 17.308 16.380 -6.539 1.00 64.22 H new ATOM 340 N VAL A 377 13.943 12.731 -5.364 1.00 65.13 N ATOM 341 CA VAL A 377 13.005 12.025 -4.591 1.00 62.42 C ATOM 342 C VAL A 377 13.768 10.997 -3.806 1.00 4.32 C ATOM 343 O VAL A 377 14.151 9.943 -4.339 1.00 40.21 O ATOM 344 CB VAL A 377 11.919 11.332 -5.447 1.00 4.24 C ATOM 345 CG1 VAL A 377 10.814 10.780 -4.559 1.00 54.34 C ATOM 346 CG2 VAL A 377 11.354 12.271 -6.501 1.00 31.10 C ATOM 0 H VAL A 377 14.263 12.239 -6.198 1.00 65.13 H new ATOM 0 HA VAL A 377 12.478 12.727 -3.945 1.00 62.42 H new ATOM 0 HB VAL A 377 12.388 10.500 -5.973 1.00 4.24 H new ATOM 0 HG11 VAL A 377 10.058 10.296 -5.177 1.00 54.34 H new ATOM 0 HG12 VAL A 377 11.235 10.053 -3.864 1.00 54.34 H new ATOM 0 HG13 VAL A 377 10.356 11.595 -3.998 1.00 54.34 H new ATOM 0 HG21 VAL A 377 10.594 11.750 -7.083 1.00 31.10 H new ATOM 0 HG22 VAL A 377 10.907 13.138 -6.014 1.00 31.10 H new ATOM 0 HG23 VAL A 377 12.155 12.600 -7.163 1.00 31.10 H new ATOM 356 N PHE A 378 14.066 11.340 -2.578 1.00 73.40 N ATOM 357 CA PHE A 378 14.795 10.474 -1.694 1.00 53.44 C ATOM 358 C PHE A 378 14.182 9.110 -1.579 1.00 51.42 C ATOM 359 O PHE A 378 12.971 8.976 -1.347 1.00 40.41 O ATOM 360 CB PHE A 378 15.001 11.102 -0.318 1.00 30.00 C ATOM 361 CG PHE A 378 16.083 12.115 -0.282 1.00 4.14 C ATOM 362 CD1 PHE A 378 17.381 11.698 -0.102 1.00 23.02 C ATOM 363 CD2 PHE A 378 15.824 13.465 -0.419 1.00 15.40 C ATOM 364 CE1 PHE A 378 18.409 12.587 -0.057 1.00 25.13 C ATOM 365 CE2 PHE A 378 16.857 14.380 -0.374 1.00 0.10 C ATOM 366 CZ PHE A 378 18.157 13.940 -0.192 1.00 13.43 C ATOM 0 H PHE A 378 13.806 12.235 -2.163 1.00 73.40 H new ATOM 0 HA PHE A 378 15.776 10.342 -2.149 1.00 53.44 H new ATOM 0 HB2 PHE A 378 14.069 11.567 0.003 1.00 30.00 H new ATOM 0 HB3 PHE A 378 15.228 10.315 0.401 1.00 30.00 H new ATOM 0 HD1 PHE A 378 17.588 10.644 0.006 1.00 23.02 H new ATOM 0 HD2 PHE A 378 14.809 13.806 -0.562 1.00 15.40 H new ATOM 0 HE1 PHE A 378 19.421 12.237 0.084 1.00 25.13 H new ATOM 0 HE2 PHE A 378 16.652 15.435 -0.480 1.00 0.10 H new ATOM 0 HZ PHE A 378 18.970 14.650 -0.156 1.00 13.43 H new ATOM 376 N TYR A 379 15.040 8.099 -1.804 1.00 62.23 N ATOM 377 CA TYR A 379 14.709 6.675 -1.685 1.00 3.22 C ATOM 378 C TYR A 379 13.898 6.181 -2.847 1.00 23.25 C ATOM 379 O TYR A 379 13.493 5.030 -2.888 1.00 75.32 O ATOM 380 CB TYR A 379 14.066 6.341 -0.334 1.00 32.42 C ATOM 381 CG TYR A 379 15.026 6.568 0.825 1.00 15.30 C ATOM 382 CD1 TYR A 379 15.269 7.842 1.294 1.00 61.25 C ATOM 383 CD2 TYR A 379 15.709 5.515 1.414 1.00 3.43 C ATOM 384 CE1 TYR A 379 16.156 8.085 2.311 1.00 5.23 C ATOM 385 CE2 TYR A 379 16.602 5.739 2.446 1.00 72.41 C ATOM 386 CZ TYR A 379 16.822 7.029 2.890 1.00 62.21 C ATOM 387 OH TYR A 379 17.717 7.262 3.919 1.00 32.15 O ATOM 0 H TYR A 379 16.009 8.259 -2.081 1.00 62.23 H new ATOM 0 HA TYR A 379 15.653 6.130 -1.718 1.00 3.22 H new ATOM 0 HB2 TYR A 379 13.177 6.955 -0.194 1.00 32.42 H new ATOM 0 HB3 TYR A 379 13.738 5.301 -0.335 1.00 32.42 H new ATOM 0 HD1 TYR A 379 14.745 8.674 0.847 1.00 61.25 H new ATOM 0 HD2 TYR A 379 15.542 4.508 1.063 1.00 3.43 H new ATOM 0 HE1 TYR A 379 16.330 9.094 2.654 1.00 5.23 H new ATOM 0 HE2 TYR A 379 17.124 4.911 2.902 1.00 72.41 H new ATOM 0 HH TYR A 379 18.101 6.411 4.218 1.00 32.15 H new ATOM 397 N GLU A 380 13.704 7.042 -3.801 1.00 11.31 N ATOM 398 CA GLU A 380 13.001 6.715 -4.996 1.00 33.43 C ATOM 399 C GLU A 380 13.875 6.821 -6.204 1.00 71.11 C ATOM 400 O GLU A 380 14.250 5.794 -6.793 1.00 53.00 O ATOM 401 CB GLU A 380 11.781 7.587 -5.150 1.00 74.11 C ATOM 402 CG GLU A 380 10.642 7.195 -4.263 1.00 24.55 C ATOM 403 CD GLU A 380 10.009 5.910 -4.729 1.00 75.23 C ATOM 404 OE1 GLU A 380 10.529 4.827 -4.441 1.00 3.13 O ATOM 405 OE2 GLU A 380 9.004 5.974 -5.435 1.00 34.31 O ATOM 0 H GLU A 380 14.037 8.006 -3.766 1.00 11.31 H new ATOM 0 HA GLU A 380 12.683 5.676 -4.912 1.00 33.43 H new ATOM 0 HB2 GLU A 380 12.055 8.620 -4.938 1.00 74.11 H new ATOM 0 HB3 GLU A 380 11.450 7.552 -6.188 1.00 74.11 H new ATOM 0 HG2 GLU A 380 10.998 7.078 -3.239 1.00 24.55 H new ATOM 0 HG3 GLU A 380 9.895 7.989 -4.253 1.00 24.55 H new ATOM 412 N ASN A 381 14.210 8.051 -6.574 1.00 2.02 N ATOM 413 CA ASN A 381 14.965 8.344 -7.785 1.00 3.44 C ATOM 414 C ASN A 381 15.164 9.839 -7.989 1.00 43.13 C ATOM 415 O ASN A 381 14.634 10.657 -7.236 1.00 10.24 O ATOM 416 CB ASN A 381 14.307 7.707 -9.032 1.00 33.53 C ATOM 417 CG ASN A 381 12.802 7.890 -9.118 1.00 13.20 C ATOM 418 OD1 ASN A 381 12.244 8.863 -8.630 1.00 1.04 O ATOM 419 ND2 ASN A 381 12.140 6.927 -9.726 1.00 65.25 N ATOM 0 H ASN A 381 13.962 8.881 -6.036 1.00 2.02 H new ATOM 0 HA ASN A 381 15.950 7.896 -7.653 1.00 3.44 H new ATOM 0 HB2 ASN A 381 14.763 8.134 -9.925 1.00 33.53 H new ATOM 0 HB3 ASN A 381 14.531 6.640 -9.039 1.00 33.53 H new ATOM 0 HD21 ASN A 381 11.124 6.976 -9.803 1.00 65.25 H new ATOM 0 HD22 ASN A 381 12.643 6.132 -10.120 1.00 65.25 H new ATOM 426 N VAL A 382 15.951 10.182 -8.998 1.00 73.02 N ATOM 427 CA VAL A 382 16.236 11.567 -9.342 1.00 61.31 C ATOM 428 C VAL A 382 15.981 11.755 -10.831 1.00 65.45 C ATOM 429 O VAL A 382 16.377 10.908 -11.647 1.00 64.03 O ATOM 430 CB VAL A 382 17.713 11.973 -9.003 1.00 73.12 C ATOM 431 CG1 VAL A 382 17.979 13.435 -9.353 1.00 31.24 C ATOM 432 CG2 VAL A 382 18.013 11.739 -7.535 1.00 11.42 C ATOM 0 H VAL A 382 16.412 9.504 -9.604 1.00 73.02 H new ATOM 0 HA VAL A 382 15.584 12.209 -8.749 1.00 61.31 H new ATOM 0 HB VAL A 382 18.369 11.345 -9.606 1.00 73.12 H new ATOM 0 HG11 VAL A 382 19.011 13.686 -9.107 1.00 31.24 H new ATOM 0 HG12 VAL A 382 17.812 13.590 -10.419 1.00 31.24 H new ATOM 0 HG13 VAL A 382 17.304 14.074 -8.784 1.00 31.24 H new ATOM 0 HG21 VAL A 382 19.043 12.028 -7.324 1.00 11.42 H new ATOM 0 HG22 VAL A 382 17.336 12.337 -6.925 1.00 11.42 H new ATOM 0 HG23 VAL A 382 17.876 10.684 -7.299 1.00 11.42 H new ATOM 442 N PHE A 383 15.323 12.832 -11.181 1.00 3.11 N ATOM 443 CA PHE A 383 14.955 13.094 -12.565 1.00 63.23 C ATOM 444 C PHE A 383 15.603 14.367 -13.061 1.00 50.55 C ATOM 445 O PHE A 383 16.086 15.166 -12.270 1.00 5.43 O ATOM 446 CB PHE A 383 13.441 13.307 -12.680 1.00 11.34 C ATOM 447 CG PHE A 383 12.588 12.213 -12.126 1.00 35.22 C ATOM 448 CD1 PHE A 383 12.186 11.166 -12.922 1.00 32.53 C ATOM 449 CD2 PHE A 383 12.175 12.247 -10.801 1.00 0.35 C ATOM 450 CE1 PHE A 383 11.384 10.165 -12.413 1.00 64.21 C ATOM 451 CE2 PHE A 383 11.381 11.256 -10.284 1.00 14.31 C ATOM 452 CZ PHE A 383 10.980 10.208 -11.095 1.00 71.10 C ATOM 0 H PHE A 383 15.025 13.553 -10.524 1.00 3.11 H new ATOM 0 HA PHE A 383 15.283 12.236 -13.152 1.00 63.23 H new ATOM 0 HB2 PHE A 383 13.184 14.236 -12.171 1.00 11.34 H new ATOM 0 HB3 PHE A 383 13.190 13.440 -13.732 1.00 11.34 H new ATOM 0 HD1 PHE A 383 12.501 11.127 -13.954 1.00 32.53 H new ATOM 0 HD2 PHE A 383 12.484 13.066 -10.168 1.00 0.35 H new ATOM 0 HE1 PHE A 383 11.073 9.348 -13.047 1.00 64.21 H new ATOM 0 HE2 PHE A 383 11.070 11.293 -9.250 1.00 14.31 H new ATOM 0 HZ PHE A 383 10.352 9.425 -10.696 1.00 71.10 H new ATOM 462 N GLN A 384 15.612 14.521 -14.371 1.00 11.01 N ATOM 463 CA GLN A 384 15.963 15.747 -15.049 1.00 34.13 C ATOM 464 C GLN A 384 14.929 16.025 -16.141 1.00 32.32 C ATOM 465 O GLN A 384 14.981 15.452 -17.243 1.00 61.22 O ATOM 466 CB GLN A 384 17.391 15.751 -15.611 1.00 32.01 C ATOM 467 CG GLN A 384 17.754 14.525 -16.428 1.00 15.21 C ATOM 468 CD GLN A 384 19.115 14.605 -17.127 1.00 60.43 C ATOM 469 OE1 GLN A 384 19.299 14.022 -18.188 1.00 41.41 O ATOM 470 NE2 GLN A 384 20.068 15.306 -16.546 1.00 10.21 N ATOM 0 H GLN A 384 15.366 13.767 -15.012 1.00 11.01 H new ATOM 0 HA GLN A 384 15.949 16.549 -14.311 1.00 34.13 H new ATOM 0 HB2 GLN A 384 17.520 16.637 -16.233 1.00 32.01 H new ATOM 0 HB3 GLN A 384 18.093 15.839 -14.782 1.00 32.01 H new ATOM 0 HG2 GLN A 384 17.747 13.653 -15.774 1.00 15.21 H new ATOM 0 HG3 GLN A 384 16.982 14.365 -17.181 1.00 15.21 H new ATOM 0 HE21 GLN A 384 19.885 15.781 -15.662 1.00 10.21 H new ATOM 0 HE22 GLN A 384 20.988 15.374 -16.980 1.00 10.21 H new ATOM 479 N ASP A 385 13.953 16.856 -15.788 1.00 4.15 N ATOM 480 CA ASP A 385 12.812 17.245 -16.651 1.00 64.53 C ATOM 481 C ASP A 385 11.864 16.084 -16.842 1.00 54.33 C ATOM 482 O ASP A 385 10.803 16.035 -16.248 1.00 62.51 O ATOM 483 CB ASP A 385 13.253 17.786 -18.026 1.00 72.10 C ATOM 484 CG ASP A 385 12.074 18.235 -18.881 1.00 34.24 C ATOM 485 OD1 ASP A 385 11.606 19.383 -18.723 1.00 2.13 O ATOM 486 OD2 ASP A 385 11.594 17.433 -19.721 1.00 54.12 O ATOM 0 H ASP A 385 13.921 17.297 -14.869 1.00 4.15 H new ATOM 0 HA ASP A 385 12.301 18.056 -16.131 1.00 64.53 H new ATOM 0 HB2 ASP A 385 13.934 18.625 -17.882 1.00 72.10 H new ATOM 0 HB3 ASP A 385 13.809 17.013 -18.556 1.00 72.10 H new ATOM 491 N SER A 386 12.269 15.160 -17.659 1.00 65.34 N ATOM 492 CA SER A 386 11.498 13.986 -17.950 1.00 55.03 C ATOM 493 C SER A 386 12.409 12.765 -17.946 1.00 15.42 C ATOM 494 O SER A 386 11.951 11.621 -17.851 1.00 72.10 O ATOM 495 CB SER A 386 10.847 14.141 -19.318 1.00 43.35 C ATOM 496 OG SER A 386 10.007 15.300 -19.370 1.00 51.32 O ATOM 0 H SER A 386 13.161 15.200 -18.152 1.00 65.34 H new ATOM 0 HA SER A 386 10.724 13.856 -17.193 1.00 55.03 H new ATOM 0 HB2 SER A 386 11.619 14.215 -20.084 1.00 43.35 H new ATOM 0 HB3 SER A 386 10.258 13.252 -19.545 1.00 43.35 H new ATOM 0 HG SER A 386 10.524 16.064 -19.700 1.00 51.32 H new ATOM 502 N ILE A 387 13.703 13.011 -18.026 1.00 65.41 N ATOM 503 CA ILE A 387 14.660 11.944 -18.077 1.00 3.43 C ATOM 504 C ILE A 387 15.044 11.500 -16.680 1.00 32.43 C ATOM 505 O ILE A 387 15.556 12.268 -15.881 1.00 61.14 O ATOM 506 CB ILE A 387 15.912 12.318 -18.930 1.00 43.34 C ATOM 507 CG1 ILE A 387 15.511 12.527 -20.405 1.00 43.32 C ATOM 508 CG2 ILE A 387 17.024 11.275 -18.813 1.00 21.42 C ATOM 509 CD1 ILE A 387 14.897 11.306 -21.073 1.00 5.21 C ATOM 0 H ILE A 387 14.108 13.947 -18.057 1.00 65.41 H new ATOM 0 HA ILE A 387 14.186 11.101 -18.579 1.00 3.43 H new ATOM 0 HB ILE A 387 16.310 13.252 -18.534 1.00 43.34 H new ATOM 0 HG12 ILE A 387 14.800 13.352 -20.461 1.00 43.32 H new ATOM 0 HG13 ILE A 387 16.394 12.828 -20.969 1.00 43.32 H new ATOM 0 HG21 ILE A 387 17.874 11.579 -19.424 1.00 21.42 H new ATOM 0 HG22 ILE A 387 17.337 11.192 -17.772 1.00 21.42 H new ATOM 0 HG23 ILE A 387 16.655 10.310 -19.159 1.00 21.42 H new ATOM 0 HD11 ILE A 387 14.646 11.544 -22.107 1.00 5.21 H new ATOM 0 HD12 ILE A 387 15.611 10.483 -21.053 1.00 5.21 H new ATOM 0 HD13 ILE A 387 13.993 11.015 -20.538 1.00 5.21 H new ATOM 521 N LEU A 388 14.741 10.275 -16.399 1.00 35.15 N ATOM 522 CA LEU A 388 15.047 9.657 -15.145 1.00 45.42 C ATOM 523 C LEU A 388 16.511 9.237 -15.117 1.00 33.31 C ATOM 524 O LEU A 388 16.939 8.428 -15.936 1.00 31.22 O ATOM 525 CB LEU A 388 14.107 8.455 -14.963 1.00 40.30 C ATOM 526 CG LEU A 388 14.342 7.535 -13.774 1.00 63.13 C ATOM 527 CD1 LEU A 388 14.306 8.304 -12.483 1.00 32.21 C ATOM 528 CD2 LEU A 388 13.285 6.447 -13.763 1.00 21.32 C ATOM 0 H LEU A 388 14.260 9.657 -17.052 1.00 35.15 H new ATOM 0 HA LEU A 388 14.896 10.355 -14.321 1.00 45.42 H new ATOM 0 HB2 LEU A 388 13.088 8.836 -14.893 1.00 40.30 H new ATOM 0 HB3 LEU A 388 14.160 7.850 -15.868 1.00 40.30 H new ATOM 0 HG LEU A 388 15.330 7.085 -13.870 1.00 63.13 H new ATOM 0 HD11 LEU A 388 14.477 7.623 -11.649 1.00 32.21 H new ATOM 0 HD12 LEU A 388 15.083 9.068 -12.493 1.00 32.21 H new ATOM 0 HD13 LEU A 388 13.332 8.779 -12.370 1.00 32.21 H new ATOM 0 HD21 LEU A 388 13.451 5.787 -12.912 1.00 21.32 H new ATOM 0 HD22 LEU A 388 12.297 6.900 -13.683 1.00 21.32 H new ATOM 0 HD23 LEU A 388 13.346 5.871 -14.686 1.00 21.32 H new ATOM 540 N LEU A 389 17.272 9.816 -14.195 1.00 4.41 N ATOM 541 CA LEU A 389 18.689 9.508 -14.053 1.00 21.01 C ATOM 542 C LEU A 389 18.874 8.064 -13.655 1.00 74.24 C ATOM 543 O LEU A 389 19.351 7.274 -14.423 1.00 44.32 O ATOM 544 CB LEU A 389 19.336 10.419 -13.015 1.00 25.45 C ATOM 545 CG LEU A 389 19.272 11.912 -13.309 1.00 2.11 C ATOM 546 CD1 LEU A 389 19.940 12.691 -12.206 1.00 54.30 C ATOM 547 CD2 LEU A 389 19.925 12.225 -14.642 1.00 41.32 C ATOM 0 H LEU A 389 16.927 10.507 -13.529 1.00 4.41 H new ATOM 0 HA LEU A 389 19.173 9.676 -15.015 1.00 21.01 H new ATOM 0 HB2 LEU A 389 18.859 10.237 -12.052 1.00 25.45 H new ATOM 0 HB3 LEU A 389 20.383 10.133 -12.911 1.00 25.45 H new ATOM 0 HG LEU A 389 18.224 12.206 -13.362 1.00 2.11 H new ATOM 0 HD11 LEU A 389 19.887 13.757 -12.429 1.00 54.30 H new ATOM 0 HD12 LEU A 389 19.433 12.492 -11.262 1.00 54.30 H new ATOM 0 HD13 LEU A 389 20.984 12.388 -12.128 1.00 54.30 H new ATOM 0 HD21 LEU A 389 19.868 13.297 -14.832 1.00 41.32 H new ATOM 0 HD22 LEU A 389 20.970 11.916 -14.617 1.00 41.32 H new ATOM 0 HD23 LEU A 389 19.407 11.688 -15.436 1.00 41.32 H new ATOM 559 N GLY A 390 18.450 7.728 -12.471 1.00 4.44 N ATOM 560 CA GLY A 390 18.594 6.388 -11.986 1.00 2.44 C ATOM 561 C GLY A 390 17.514 6.070 -11.012 1.00 32.31 C ATOM 562 O GLY A 390 16.691 6.927 -10.726 1.00 3.20 O ATOM 0 H GLY A 390 17.998 8.370 -11.820 1.00 4.44 H new ATOM 0 HA2 GLY A 390 18.559 5.687 -12.820 1.00 2.44 H new ATOM 0 HA3 GLY A 390 19.568 6.269 -11.511 1.00 2.44 H new ATOM 566 N ASN A 391 17.533 4.876 -10.459 1.00 71.11 N ATOM 567 CA ASN A 391 16.487 4.434 -9.519 1.00 23.34 C ATOM 568 C ASN A 391 17.066 3.838 -8.318 1.00 13.32 C ATOM 569 O ASN A 391 18.160 3.286 -8.364 1.00 2.10 O ATOM 570 CB ASN A 391 15.480 3.461 -10.113 1.00 70.13 C ATOM 571 CG ASN A 391 14.611 4.089 -11.130 1.00 1.11 C ATOM 572 OD1 ASN A 391 13.569 4.663 -10.807 1.00 5.41 O ATOM 573 ND2 ASN A 391 14.985 3.981 -12.351 1.00 2.10 N ATOM 0 H ASN A 391 18.258 4.181 -10.636 1.00 71.11 H new ATOM 0 HA ASN A 391 15.946 5.346 -9.268 1.00 23.34 H new ATOM 0 HB2 ASN A 391 16.013 2.623 -10.563 1.00 70.13 H new ATOM 0 HB3 ASN A 391 14.861 3.053 -9.314 1.00 70.13 H new ATOM 0 HD21 ASN A 391 14.413 4.378 -13.097 1.00 2.10 H new ATOM 0 HD22 ASN A 391 15.855 3.498 -12.577 1.00 2.10 H new ATOM 580 N PHE A 392 16.331 3.937 -7.246 1.00 62.03 N ATOM 581 CA PHE A 392 16.791 3.473 -5.932 1.00 30.33 C ATOM 582 C PHE A 392 17.290 2.047 -5.973 1.00 70.32 C ATOM 583 O PHE A 392 16.534 1.105 -6.268 1.00 33.22 O ATOM 584 CB PHE A 392 15.699 3.621 -4.869 1.00 71.11 C ATOM 585 CG PHE A 392 16.107 3.130 -3.498 1.00 21.10 C ATOM 586 CD1 PHE A 392 16.972 3.872 -2.706 1.00 42.41 C ATOM 587 CD2 PHE A 392 15.634 1.921 -3.010 1.00 53.33 C ATOM 588 CE1 PHE A 392 17.352 3.417 -1.456 1.00 40.21 C ATOM 589 CE2 PHE A 392 16.012 1.463 -1.765 1.00 14.31 C ATOM 590 CZ PHE A 392 16.872 2.212 -0.987 1.00 40.14 C ATOM 0 H PHE A 392 15.394 4.339 -7.240 1.00 62.03 H new ATOM 0 HA PHE A 392 17.630 4.112 -5.657 1.00 30.33 H new ATOM 0 HB2 PHE A 392 15.415 4.671 -4.798 1.00 71.11 H new ATOM 0 HB3 PHE A 392 14.814 3.072 -5.192 1.00 71.11 H new ATOM 0 HD1 PHE A 392 17.353 4.815 -3.070 1.00 42.41 H new ATOM 0 HD2 PHE A 392 14.961 1.330 -3.613 1.00 53.33 H new ATOM 0 HE1 PHE A 392 18.024 4.005 -0.848 1.00 40.21 H new ATOM 0 HE2 PHE A 392 15.635 0.519 -1.399 1.00 14.31 H new ATOM 0 HZ PHE A 392 17.169 1.855 -0.012 1.00 40.14 H new ATOM 600 N ALA A 393 18.559 1.904 -5.705 1.00 24.34 N ATOM 601 CA ALA A 393 19.187 0.627 -5.658 1.00 52.53 C ATOM 602 C ALA A 393 19.670 0.341 -4.259 1.00 14.23 C ATOM 603 O ALA A 393 19.349 -0.691 -3.680 1.00 44.41 O ATOM 604 CB ALA A 393 20.346 0.575 -6.638 1.00 72.42 C ATOM 0 H ALA A 393 19.187 2.684 -5.512 1.00 24.34 H new ATOM 0 HA ALA A 393 18.460 -0.134 -5.941 1.00 52.53 H new ATOM 0 HB1 ALA A 393 20.818 -0.407 -6.592 1.00 72.42 H new ATOM 0 HB2 ALA A 393 19.977 0.753 -7.648 1.00 72.42 H new ATOM 0 HB3 ALA A 393 21.077 1.341 -6.378 1.00 72.42 H new ATOM 610 N SER A 394 20.427 1.264 -3.703 1.00 75.43 N ATOM 611 CA SER A 394 21.017 1.055 -2.408 1.00 32.43 C ATOM 612 C SER A 394 21.153 2.366 -1.643 1.00 64.54 C ATOM 613 O SER A 394 21.210 3.457 -2.241 1.00 15.22 O ATOM 614 CB SER A 394 22.415 0.440 -2.585 1.00 34.22 C ATOM 615 OG SER A 394 22.369 -0.772 -3.333 1.00 33.25 O ATOM 0 H SER A 394 20.645 2.164 -4.131 1.00 75.43 H new ATOM 0 HA SER A 394 20.368 0.387 -1.842 1.00 32.43 H new ATOM 0 HB2 SER A 394 23.065 1.154 -3.090 1.00 34.22 H new ATOM 0 HB3 SER A 394 22.854 0.247 -1.606 1.00 34.22 H new ATOM 0 HG SER A 394 23.275 -1.133 -3.427 1.00 33.25 H new ATOM 621 N GLN A 395 21.185 2.252 -0.341 1.00 2.13 N ATOM 622 CA GLN A 395 21.475 3.352 0.534 1.00 25.24 C ATOM 623 C GLN A 395 22.871 3.025 1.064 1.00 71.42 C ATOM 624 O GLN A 395 23.074 1.959 1.683 1.00 44.33 O ATOM 625 CB GLN A 395 20.440 3.370 1.691 1.00 20.50 C ATOM 626 CG GLN A 395 20.342 4.673 2.513 1.00 34.22 C ATOM 627 CD GLN A 395 21.637 5.133 3.136 1.00 40.25 C ATOM 628 OE1 GLN A 395 22.381 5.890 2.538 1.00 15.32 O ATOM 629 NE2 GLN A 395 21.913 4.687 4.325 1.00 21.42 N ATOM 0 H GLN A 395 21.007 1.375 0.148 1.00 2.13 H new ATOM 0 HA GLN A 395 21.430 4.327 0.049 1.00 25.24 H new ATOM 0 HB2 GLN A 395 19.457 3.158 1.271 1.00 20.50 H new ATOM 0 HB3 GLN A 395 20.678 2.554 2.373 1.00 20.50 H new ATOM 0 HG2 GLN A 395 19.966 5.466 1.866 1.00 34.22 H new ATOM 0 HG3 GLN A 395 19.606 4.531 3.304 1.00 34.22 H new ATOM 0 HE21 GLN A 395 21.266 4.054 4.795 1.00 21.42 H new ATOM 0 HE22 GLN A 395 22.777 4.970 4.788 1.00 21.42 H new ATOM 638 N GLU A 396 23.817 3.877 0.810 1.00 13.12 N ATOM 639 CA GLU A 396 25.188 3.589 1.137 1.00 2.44 C ATOM 640 C GLU A 396 25.779 4.734 1.935 1.00 4.02 C ATOM 641 O GLU A 396 26.011 5.827 1.404 1.00 2.35 O ATOM 642 CB GLU A 396 25.956 3.336 -0.163 1.00 1.15 C ATOM 643 CG GLU A 396 27.393 2.898 -0.001 1.00 21.54 C ATOM 644 CD GLU A 396 28.024 2.582 -1.330 1.00 61.24 C ATOM 645 OE1 GLU A 396 27.863 1.447 -1.822 1.00 62.22 O ATOM 646 OE2 GLU A 396 28.682 3.463 -1.919 1.00 1.04 O ATOM 0 H GLU A 396 23.667 4.786 0.373 1.00 13.12 H new ATOM 0 HA GLU A 396 25.257 2.696 1.758 1.00 2.44 H new ATOM 0 HB2 GLU A 396 25.426 2.574 -0.734 1.00 1.15 H new ATOM 0 HB3 GLU A 396 25.939 4.250 -0.757 1.00 1.15 H new ATOM 0 HG2 GLU A 396 27.961 3.685 0.495 1.00 21.54 H new ATOM 0 HG3 GLU A 396 27.437 2.019 0.642 1.00 21.54 H new ATOM 653 N GLY A 397 26.010 4.493 3.203 1.00 2.33 N ATOM 654 CA GLY A 397 26.469 5.534 4.071 1.00 65.43 C ATOM 655 C GLY A 397 25.319 6.440 4.395 1.00 71.11 C ATOM 656 O GLY A 397 24.298 5.983 4.916 1.00 1.55 O ATOM 0 H GLY A 397 25.886 3.585 3.650 1.00 2.33 H new ATOM 0 HA2 GLY A 397 26.882 5.108 4.985 1.00 65.43 H new ATOM 0 HA3 GLY A 397 27.270 6.098 3.592 1.00 65.43 H new ATOM 660 N ASN A 398 25.479 7.703 4.134 1.00 51.12 N ATOM 661 CA ASN A 398 24.386 8.658 4.255 1.00 13.32 C ATOM 662 C ASN A 398 23.987 9.090 2.824 1.00 4.52 C ATOM 663 O ASN A 398 23.261 10.054 2.612 1.00 63.34 O ATOM 664 CB ASN A 398 24.857 9.863 5.092 1.00 42.51 C ATOM 665 CG ASN A 398 23.731 10.770 5.585 1.00 10.30 C ATOM 666 OD1 ASN A 398 23.163 10.536 6.659 1.00 1.32 O ATOM 667 ND2 ASN A 398 23.427 11.811 4.864 1.00 11.04 N ATOM 0 H ASN A 398 26.363 8.113 3.831 1.00 51.12 H new ATOM 0 HA ASN A 398 23.524 8.220 4.757 1.00 13.32 H new ATOM 0 HB2 ASN A 398 25.414 9.495 5.954 1.00 42.51 H new ATOM 0 HB3 ASN A 398 25.549 10.456 4.494 1.00 42.51 H new ATOM 0 HD21 ASN A 398 22.705 12.458 5.181 1.00 11.04 H new ATOM 0 HD22 ASN A 398 23.911 11.980 3.982 1.00 11.04 H new ATOM 674 N VAL A 399 24.479 8.339 1.851 1.00 12.15 N ATOM 675 CA VAL A 399 24.346 8.680 0.448 1.00 31.43 C ATOM 676 C VAL A 399 23.451 7.671 -0.303 1.00 61.04 C ATOM 677 O VAL A 399 23.605 6.456 -0.169 1.00 74.43 O ATOM 678 CB VAL A 399 25.759 8.758 -0.209 1.00 31.23 C ATOM 679 CG1 VAL A 399 25.678 9.079 -1.678 1.00 14.41 C ATOM 680 CG2 VAL A 399 26.624 9.791 0.502 1.00 54.02 C ATOM 0 H VAL A 399 24.985 7.469 2.017 1.00 12.15 H new ATOM 0 HA VAL A 399 23.861 9.654 0.378 1.00 31.43 H new ATOM 0 HB VAL A 399 26.217 7.774 -0.106 1.00 31.23 H new ATOM 0 HG11 VAL A 399 26.683 9.124 -2.097 1.00 14.41 H new ATOM 0 HG12 VAL A 399 25.107 8.304 -2.189 1.00 14.41 H new ATOM 0 HG13 VAL A 399 25.185 10.042 -1.813 1.00 14.41 H new ATOM 0 HG21 VAL A 399 27.605 9.831 0.030 1.00 54.02 H new ATOM 0 HG22 VAL A 399 26.150 10.770 0.436 1.00 54.02 H new ATOM 0 HG23 VAL A 399 26.737 9.512 1.550 1.00 54.02 H new ATOM 690 N LEU A 400 22.546 8.190 -1.099 1.00 3.24 N ATOM 691 CA LEU A 400 21.603 7.381 -1.864 1.00 51.14 C ATOM 692 C LEU A 400 22.087 7.155 -3.291 1.00 72.12 C ATOM 693 O LEU A 400 22.480 8.105 -3.988 1.00 24.33 O ATOM 694 CB LEU A 400 20.204 8.042 -1.889 1.00 53.12 C ATOM 695 CG LEU A 400 19.303 7.934 -0.650 1.00 54.43 C ATOM 696 CD1 LEU A 400 19.008 6.493 -0.320 1.00 13.50 C ATOM 697 CD2 LEU A 400 19.889 8.672 0.551 1.00 51.12 C ATOM 0 H LEU A 400 22.436 9.194 -1.241 1.00 3.24 H new ATOM 0 HA LEU A 400 21.533 6.414 -1.367 1.00 51.14 H new ATOM 0 HB2 LEU A 400 20.345 9.102 -2.101 1.00 53.12 H new ATOM 0 HB3 LEU A 400 19.656 7.619 -2.731 1.00 53.12 H new ATOM 0 HG LEU A 400 18.360 8.424 -0.892 1.00 54.43 H new ATOM 0 HD11 LEU A 400 18.368 6.445 0.561 1.00 13.50 H new ATOM 0 HD12 LEU A 400 18.501 6.023 -1.163 1.00 13.50 H new ATOM 0 HD13 LEU A 400 19.942 5.967 -0.120 1.00 13.50 H new ATOM 0 HD21 LEU A 400 19.218 8.569 1.404 1.00 51.12 H new ATOM 0 HD22 LEU A 400 20.861 8.247 0.800 1.00 51.12 H new ATOM 0 HD23 LEU A 400 20.006 9.728 0.307 1.00 51.12 H new ATOM 709 N LYS A 401 22.048 5.904 -3.717 1.00 10.20 N ATOM 710 CA LYS A 401 22.455 5.517 -5.052 1.00 14.11 C ATOM 711 C LYS A 401 21.266 5.073 -5.909 1.00 43.33 C ATOM 712 O LYS A 401 20.506 4.152 -5.542 1.00 20.51 O ATOM 713 CB LYS A 401 23.572 4.442 -5.008 1.00 12.03 C ATOM 714 CG LYS A 401 23.856 3.758 -6.348 1.00 55.31 C ATOM 715 CD LYS A 401 24.085 4.750 -7.482 1.00 31.20 C ATOM 716 CE LYS A 401 24.162 4.027 -8.808 1.00 74.50 C ATOM 717 NZ LYS A 401 25.457 3.360 -9.029 1.00 64.40 N ATOM 0 H LYS A 401 21.730 5.125 -3.140 1.00 10.20 H new ATOM 0 HA LYS A 401 22.871 6.401 -5.534 1.00 14.11 H new ATOM 0 HB2 LYS A 401 24.491 4.907 -4.651 1.00 12.03 H new ATOM 0 HB3 LYS A 401 23.296 3.681 -4.278 1.00 12.03 H new ATOM 0 HG2 LYS A 401 24.734 3.121 -6.246 1.00 55.31 H new ATOM 0 HG3 LYS A 401 23.019 3.108 -6.603 1.00 55.31 H new ATOM 0 HD2 LYS A 401 23.275 5.479 -7.505 1.00 31.20 H new ATOM 0 HD3 LYS A 401 25.008 5.304 -7.308 1.00 31.20 H new ATOM 0 HE2 LYS A 401 23.365 3.285 -8.857 1.00 74.50 H new ATOM 0 HE3 LYS A 401 23.985 4.739 -9.614 1.00 74.50 H new ATOM 0 HZ1 LYS A 401 25.300 2.442 -9.492 1.00 64.40 H new ATOM 0 HZ2 LYS A 401 26.056 3.956 -9.636 1.00 64.40 H new ATOM 0 HZ3 LYS A 401 25.931 3.210 -8.115 1.00 64.40 H new ATOM 731 N TYR A 402 21.116 5.736 -7.049 1.00 61.32 N ATOM 732 CA TYR A 402 20.078 5.466 -7.971 1.00 22.44 C ATOM 733 C TYR A 402 20.702 5.025 -9.313 1.00 22.55 C ATOM 734 O TYR A 402 21.489 5.748 -9.876 1.00 43.42 O ATOM 735 CB TYR A 402 19.250 6.744 -8.171 1.00 24.23 C ATOM 736 CG TYR A 402 18.725 7.355 -6.881 1.00 33.01 C ATOM 737 CD1 TYR A 402 17.640 6.808 -6.222 1.00 21.44 C ATOM 738 CD2 TYR A 402 19.321 8.481 -6.332 1.00 73.21 C ATOM 739 CE1 TYR A 402 17.158 7.359 -5.052 1.00 15.42 C ATOM 740 CE2 TYR A 402 18.845 9.039 -5.161 1.00 24.41 C ATOM 741 CZ TYR A 402 17.761 8.473 -4.527 1.00 22.54 C ATOM 742 OH TYR A 402 17.281 9.029 -3.357 1.00 43.12 O ATOM 0 H TYR A 402 21.739 6.489 -7.343 1.00 61.32 H new ATOM 0 HA TYR A 402 19.433 4.671 -7.597 1.00 22.44 H new ATOM 0 HB2 TYR A 402 19.863 7.483 -8.687 1.00 24.23 H new ATOM 0 HB3 TYR A 402 18.406 6.518 -8.823 1.00 24.23 H new ATOM 0 HD1 TYR A 402 17.160 5.931 -6.631 1.00 21.44 H new ATOM 0 HD2 TYR A 402 20.170 8.928 -6.827 1.00 73.21 H new ATOM 0 HE1 TYR A 402 16.310 6.915 -4.552 1.00 15.42 H new ATOM 0 HE2 TYR A 402 19.321 9.915 -4.745 1.00 24.41 H new ATOM 0 HH TYR A 402 17.821 9.812 -3.121 1.00 43.12 H new ATOM 752 N GLU A 403 20.365 3.846 -9.795 1.00 32.34 N ATOM 753 CA GLU A 403 20.873 3.342 -11.090 1.00 15.04 C ATOM 754 C GLU A 403 19.758 2.719 -11.904 1.00 14.21 C ATOM 755 O GLU A 403 18.644 2.577 -11.404 1.00 32.10 O ATOM 756 CB GLU A 403 22.011 2.331 -10.901 1.00 12.41 C ATOM 757 CG GLU A 403 21.673 1.172 -9.981 1.00 64.33 C ATOM 758 CD GLU A 403 22.800 0.182 -9.859 1.00 55.23 C ATOM 759 OE1 GLU A 403 23.818 0.503 -9.222 1.00 13.33 O ATOM 760 OE2 GLU A 403 22.691 -0.926 -10.419 1.00 14.03 O ATOM 0 H GLU A 403 19.736 3.201 -9.317 1.00 32.34 H new ATOM 0 HA GLU A 403 21.270 4.200 -11.632 1.00 15.04 H new ATOM 0 HB2 GLU A 403 22.294 1.935 -11.876 1.00 12.41 H new ATOM 0 HB3 GLU A 403 22.882 2.852 -10.504 1.00 12.41 H new ATOM 0 HG2 GLU A 403 21.425 1.558 -8.992 1.00 64.33 H new ATOM 0 HG3 GLU A 403 20.786 0.662 -10.356 1.00 64.33 H new ATOM 767 N ASN A 404 20.070 2.355 -13.148 1.00 55.22 N ATOM 768 CA ASN A 404 19.124 1.713 -14.088 1.00 42.34 C ATOM 769 C ASN A 404 18.082 2.691 -14.585 1.00 72.15 C ATOM 770 O ASN A 404 16.917 2.328 -14.779 1.00 53.14 O ATOM 771 CB ASN A 404 18.428 0.466 -13.476 1.00 73.11 C ATOM 772 CG ASN A 404 19.372 -0.655 -13.083 1.00 73.30 C ATOM 773 OD1 ASN A 404 19.090 -1.405 -12.153 1.00 15.51 O ATOM 774 ND2 ASN A 404 20.467 -0.794 -13.781 1.00 5.25 N ATOM 0 H ASN A 404 20.999 2.496 -13.546 1.00 55.22 H new ATOM 0 HA ASN A 404 19.725 1.378 -14.934 1.00 42.34 H new ATOM 0 HB2 ASN A 404 17.866 0.776 -12.595 1.00 73.11 H new ATOM 0 HB3 ASN A 404 17.706 0.080 -14.195 1.00 73.11 H new ATOM 0 HD21 ASN A 404 21.121 -1.545 -13.560 1.00 5.25 H new ATOM 0 HD22 ASN A 404 20.668 -0.152 -14.547 1.00 5.25 H new ATOM 781 N GLY A 405 18.495 3.910 -14.850 1.00 3.31 N ATOM 782 CA GLY A 405 17.562 4.894 -15.325 1.00 51.13 C ATOM 783 C GLY A 405 17.485 4.905 -16.828 1.00 71.31 C ATOM 784 O GLY A 405 17.724 3.878 -17.482 1.00 52.01 O ATOM 0 H GLY A 405 19.456 4.236 -14.745 1.00 3.31 H new ATOM 0 HA2 GLY A 405 16.575 4.690 -14.911 1.00 51.13 H new ATOM 0 HA3 GLY A 405 17.859 5.880 -14.968 1.00 51.13 H new ATOM 788 N GLN A 406 17.183 6.054 -17.371 1.00 20.12 N ATOM 789 CA GLN A 406 17.062 6.253 -18.800 1.00 20.44 C ATOM 790 C GLN A 406 18.391 6.057 -19.483 1.00 32.12 C ATOM 791 O GLN A 406 19.457 6.316 -18.879 1.00 71.22 O ATOM 792 CB GLN A 406 16.513 7.643 -19.108 1.00 33.21 C ATOM 793 CG GLN A 406 15.088 7.868 -18.643 1.00 70.22 C ATOM 794 CD GLN A 406 14.081 6.995 -19.357 1.00 71.42 C ATOM 795 OE1 GLN A 406 13.782 5.883 -18.931 1.00 75.21 O ATOM 796 NE2 GLN A 406 13.541 7.503 -20.436 1.00 43.51 N ATOM 0 H GLN A 406 17.010 6.898 -16.826 1.00 20.12 H new ATOM 0 HA GLN A 406 16.363 5.510 -19.183 1.00 20.44 H new ATOM 0 HB2 GLN A 406 17.157 8.387 -18.640 1.00 33.21 H new ATOM 0 HB3 GLN A 406 16.562 7.810 -20.184 1.00 33.21 H new ATOM 0 HG2 GLN A 406 15.028 7.677 -17.571 1.00 70.22 H new ATOM 0 HG3 GLN A 406 14.824 8.915 -18.796 1.00 70.22 H new ATOM 0 HE21 GLN A 406 13.818 8.431 -20.756 1.00 43.51 H new ATOM 0 HE22 GLN A 406 12.844 6.971 -20.956 1.00 43.51 H new ATOM 805 N SER A 407 18.340 5.555 -20.700 1.00 73.34 N ATOM 806 CA SER A 407 19.509 5.343 -21.511 1.00 14.32 C ATOM 807 C SER A 407 20.349 6.626 -21.570 1.00 65.33 C ATOM 808 O SER A 407 19.820 7.730 -21.720 1.00 10.44 O ATOM 809 CB SER A 407 19.081 4.913 -22.914 1.00 4.45 C ATOM 810 OG SER A 407 18.271 3.739 -22.854 1.00 22.54 O ATOM 0 H SER A 407 17.469 5.281 -21.155 1.00 73.34 H new ATOM 0 HA SER A 407 20.121 4.556 -21.071 1.00 14.32 H new ATOM 0 HB2 SER A 407 18.527 5.720 -23.394 1.00 4.45 H new ATOM 0 HB3 SER A 407 19.962 4.723 -23.527 1.00 4.45 H new ATOM 0 HG SER A 407 18.005 3.479 -23.760 1.00 22.54 H new ATOM 816 N CYS A 408 21.633 6.466 -21.425 1.00 70.54 N ATOM 817 CA CYS A 408 22.556 7.578 -21.396 1.00 32.41 C ATOM 818 C CYS A 408 22.848 8.025 -22.799 1.00 34.21 C ATOM 819 O CYS A 408 23.027 9.203 -23.075 1.00 42.35 O ATOM 820 CB CYS A 408 23.840 7.129 -20.718 1.00 73.21 C ATOM 821 SG CYS A 408 25.145 8.386 -20.634 1.00 11.35 S ATOM 0 H CYS A 408 22.079 5.554 -21.322 1.00 70.54 H new ATOM 0 HA CYS A 408 22.121 8.411 -20.844 1.00 32.41 H new ATOM 0 HB2 CYS A 408 23.603 6.805 -19.705 1.00 73.21 H new ATOM 0 HB3 CYS A 408 24.228 6.259 -21.249 1.00 73.21 H new ATOM 826 N ALA A 409 22.864 7.067 -23.664 1.00 23.24 N ATOM 827 CA ALA A 409 23.141 7.216 -25.043 1.00 1.53 C ATOM 828 C ALA A 409 22.796 5.893 -25.619 1.00 12.33 C ATOM 829 O ALA A 409 22.122 5.096 -24.933 1.00 55.54 O ATOM 830 CB ALA A 409 24.620 7.529 -25.254 1.00 53.12 C ATOM 0 H ALA A 409 22.671 6.100 -23.404 1.00 23.24 H new ATOM 0 HA ALA A 409 22.584 8.032 -25.505 1.00 1.53 H new ATOM 0 HB1 ALA A 409 24.820 7.641 -26.320 1.00 53.12 H new ATOM 0 HB2 ALA A 409 24.873 8.455 -24.738 1.00 53.12 H new ATOM 0 HB3 ALA A 409 25.225 6.714 -24.855 1.00 53.12 H new ATOM 836 N ASN A 410 23.214 5.611 -26.811 1.00 72.42 N ATOM 837 CA ASN A 410 22.951 4.314 -27.372 1.00 42.33 C ATOM 838 C ASN A 410 23.901 3.282 -26.763 1.00 32.21 C ATOM 839 O ASN A 410 24.978 3.006 -27.304 1.00 44.10 O ATOM 840 CB ASN A 410 23.044 4.327 -28.896 1.00 1.44 C ATOM 841 CG ASN A 410 22.736 2.976 -29.529 1.00 3.22 C ATOM 842 OD1 ASN A 410 21.945 2.185 -28.998 1.00 44.24 O ATOM 843 ND2 ASN A 410 23.348 2.702 -30.652 1.00 54.54 N ATOM 0 H ASN A 410 23.734 6.249 -27.414 1.00 72.42 H new ATOM 0 HA ASN A 410 21.927 4.035 -27.124 1.00 42.33 H new ATOM 0 HB2 ASN A 410 22.351 5.071 -29.289 1.00 1.44 H new ATOM 0 HB3 ASN A 410 24.047 4.638 -29.189 1.00 1.44 H new ATOM 0 HD21 ASN A 410 23.180 1.811 -31.120 1.00 54.54 H new ATOM 0 HD22 ASN A 410 23.993 3.379 -31.060 1.00 54.54 H new ATOM 850 N GLY A 411 23.538 2.797 -25.596 1.00 12.21 N ATOM 851 CA GLY A 411 24.319 1.807 -24.924 1.00 64.40 C ATOM 852 C GLY A 411 23.934 1.684 -23.458 1.00 72.22 C ATOM 853 O GLY A 411 22.935 1.031 -23.137 1.00 43.24 O ATOM 0 H GLY A 411 22.696 3.082 -25.096 1.00 12.21 H new ATOM 0 HA2 GLY A 411 24.187 0.844 -25.417 1.00 64.40 H new ATOM 0 HA3 GLY A 411 25.376 2.063 -25.002 1.00 64.40 H new ATOM 857 N PRO A 412 24.692 2.300 -22.528 1.00 44.21 N ATOM 858 CA PRO A 412 24.396 2.216 -21.111 1.00 65.42 C ATOM 859 C PRO A 412 23.304 3.179 -20.651 1.00 63.32 C ATOM 860 O PRO A 412 22.734 3.948 -21.439 1.00 1.53 O ATOM 861 CB PRO A 412 25.716 2.559 -20.426 1.00 74.44 C ATOM 862 CG PRO A 412 26.702 2.820 -21.526 1.00 25.20 C ATOM 863 CD PRO A 412 25.897 3.092 -22.766 1.00 11.44 C ATOM 0 HA PRO A 412 24.012 1.226 -20.865 1.00 65.42 H new ATOM 0 HB2 PRO A 412 25.606 3.434 -19.786 1.00 74.44 H new ATOM 0 HB3 PRO A 412 26.050 1.739 -19.791 1.00 74.44 H new ATOM 0 HG2 PRO A 412 27.338 3.671 -21.282 1.00 25.20 H new ATOM 0 HG3 PRO A 412 27.358 1.962 -21.670 1.00 25.20 H new ATOM 0 HD2 PRO A 412 25.672 4.152 -22.881 1.00 11.44 H new ATOM 0 HD3 PRO A 412 26.420 2.777 -23.669 1.00 11.44 H new ATOM 871 N HIS A 413 23.039 3.145 -19.370 1.00 51.20 N ATOM 872 CA HIS A 413 21.992 3.927 -18.751 1.00 52.32 C ATOM 873 C HIS A 413 22.592 4.897 -17.783 1.00 23.22 C ATOM 874 O HIS A 413 23.770 4.785 -17.438 1.00 40.32 O ATOM 875 CB HIS A 413 20.998 3.007 -18.028 1.00 41.24 C ATOM 876 CG HIS A 413 20.286 2.058 -18.940 1.00 11.21 C ATOM 877 ND1 HIS A 413 18.938 2.105 -19.168 1.00 14.42 N ATOM 878 CD2 HIS A 413 20.752 1.013 -19.674 1.00 0.44 C ATOM 879 CE1 HIS A 413 18.602 1.145 -19.990 1.00 12.04 C ATOM 880 NE2 HIS A 413 19.677 0.467 -20.315 1.00 14.12 N ATOM 0 H HIS A 413 23.555 2.561 -18.711 1.00 51.20 H new ATOM 0 HA HIS A 413 21.457 4.478 -19.524 1.00 52.32 H new ATOM 0 HB2 HIS A 413 21.531 2.436 -17.268 1.00 41.24 H new ATOM 0 HB3 HIS A 413 20.261 3.619 -17.508 1.00 41.24 H new ATOM 0 HD1 HIS A 413 18.295 2.783 -18.760 1.00 14.42 H new ATOM 0 HD2 HIS A 413 21.777 0.678 -19.738 1.00 0.44 H new ATOM 0 HE1 HIS A 413 17.602 0.943 -20.344 1.00 12.04 H new ATOM 889 N ARG A 414 21.815 5.852 -17.379 1.00 33.34 N ATOM 890 CA ARG A 414 22.249 6.835 -16.421 1.00 75.02 C ATOM 891 C ARG A 414 22.062 6.342 -14.992 1.00 4.14 C ATOM 892 O ARG A 414 21.379 5.326 -14.740 1.00 4.14 O ATOM 893 CB ARG A 414 21.501 8.158 -16.635 1.00 33.43 C ATOM 894 CG ARG A 414 21.889 8.908 -17.897 1.00 0.04 C ATOM 895 CD ARG A 414 21.022 10.143 -18.092 1.00 72.31 C ATOM 896 NE ARG A 414 21.542 11.037 -19.142 1.00 41.22 N ATOM 897 CZ ARG A 414 20.992 11.230 -20.348 1.00 72.14 C ATOM 898 NH1 ARG A 414 19.993 10.459 -20.765 1.00 4.40 N ATOM 899 NH2 ARG A 414 21.474 12.164 -21.152 1.00 53.41 N ATOM 0 H ARG A 414 20.856 5.978 -17.702 1.00 33.34 H new ATOM 0 HA ARG A 414 23.315 7.004 -16.577 1.00 75.02 H new ATOM 0 HB2 ARG A 414 20.431 7.954 -16.664 1.00 33.43 H new ATOM 0 HB3 ARG A 414 21.679 8.804 -15.775 1.00 33.43 H new ATOM 0 HG2 ARG A 414 22.937 9.202 -17.841 1.00 0.04 H new ATOM 0 HG3 ARG A 414 21.788 8.250 -18.760 1.00 0.04 H new ATOM 0 HD2 ARG A 414 20.009 9.835 -18.351 1.00 72.31 H new ATOM 0 HD3 ARG A 414 20.958 10.691 -17.152 1.00 72.31 H new ATOM 0 HE ARG A 414 22.396 11.554 -18.932 1.00 41.22 H new ATOM 0 HH11 ARG A 414 19.639 9.714 -20.165 1.00 4.40 H new ATOM 0 HH12 ARG A 414 19.580 10.613 -21.685 1.00 4.40 H new ATOM 0 HH21 ARG A 414 22.264 12.736 -20.853 1.00 53.41 H new ATOM 0 HH22 ARG A 414 21.056 12.312 -22.071 1.00 53.41 H new ATOM 913 N SER A 415 22.677 7.041 -14.083 1.00 60.15 N ATOM 914 CA SER A 415 22.571 6.788 -12.683 1.00 12.24 C ATOM 915 C SER A 415 22.827 8.078 -11.924 1.00 75.02 C ATOM 916 O SER A 415 23.374 9.035 -12.479 1.00 0.32 O ATOM 917 CB SER A 415 23.529 5.656 -12.276 1.00 54.42 C ATOM 918 OG SER A 415 24.848 5.893 -12.711 1.00 25.04 O ATOM 0 H SER A 415 23.285 7.828 -14.308 1.00 60.15 H new ATOM 0 HA SER A 415 21.566 6.450 -12.431 1.00 12.24 H new ATOM 0 HB2 SER A 415 23.520 5.547 -11.192 1.00 54.42 H new ATOM 0 HB3 SER A 415 23.174 4.714 -12.694 1.00 54.42 H new ATOM 0 HG SER A 415 25.478 5.586 -12.026 1.00 25.04 H new ATOM 924 N ALA A 416 22.423 8.120 -10.693 1.00 10.13 N ATOM 925 CA ALA A 416 22.542 9.298 -9.891 1.00 64.53 C ATOM 926 C ALA A 416 22.959 8.924 -8.497 1.00 22.12 C ATOM 927 O ALA A 416 22.491 7.923 -7.947 1.00 70.04 O ATOM 928 CB ALA A 416 21.215 10.033 -9.853 1.00 14.23 C ATOM 0 H ALA A 416 21.996 7.329 -10.211 1.00 10.13 H new ATOM 0 HA ALA A 416 23.298 9.952 -10.327 1.00 64.53 H new ATOM 0 HB1 ALA A 416 21.313 10.929 -9.240 1.00 14.23 H new ATOM 0 HB2 ALA A 416 20.926 10.315 -10.865 1.00 14.23 H new ATOM 0 HB3 ALA A 416 20.451 9.383 -9.426 1.00 14.23 H new ATOM 934 N ILE A 417 23.829 9.692 -7.941 1.00 61.45 N ATOM 935 CA ILE A 417 24.285 9.481 -6.603 1.00 23.24 C ATOM 936 C ILE A 417 24.057 10.794 -5.824 1.00 74.24 C ATOM 937 O ILE A 417 24.572 11.847 -6.201 1.00 10.44 O ATOM 938 CB ILE A 417 25.801 9.042 -6.609 1.00 51.51 C ATOM 939 CG1 ILE A 417 26.312 8.654 -5.228 1.00 24.24 C ATOM 940 CG2 ILE A 417 26.702 10.063 -7.251 1.00 31.12 C ATOM 941 CD1 ILE A 417 25.680 7.399 -4.683 1.00 3.24 C ATOM 0 H ILE A 417 24.252 10.496 -8.405 1.00 61.45 H new ATOM 0 HA ILE A 417 23.733 8.676 -6.117 1.00 23.24 H new ATOM 0 HB ILE A 417 25.835 8.145 -7.228 1.00 51.51 H new ATOM 0 HG12 ILE A 417 27.392 8.516 -5.275 1.00 24.24 H new ATOM 0 HG13 ILE A 417 26.125 9.475 -4.536 1.00 24.24 H new ATOM 0 HG21 ILE A 417 27.732 9.706 -7.226 1.00 31.12 H new ATOM 0 HG22 ILE A 417 26.397 10.218 -8.286 1.00 31.12 H new ATOM 0 HG23 ILE A 417 26.631 11.005 -6.707 1.00 31.12 H new ATOM 0 HD11 ILE A 417 26.091 7.183 -3.697 1.00 3.24 H new ATOM 0 HD12 ILE A 417 24.602 7.539 -4.604 1.00 3.24 H new ATOM 0 HD13 ILE A 417 25.889 6.566 -5.354 1.00 3.24 H new ATOM 953 N VAL A 418 23.248 10.761 -4.789 1.00 61.34 N ATOM 954 CA VAL A 418 22.965 11.994 -4.077 1.00 60.04 C ATOM 955 C VAL A 418 23.835 12.128 -2.827 1.00 30.35 C ATOM 956 O VAL A 418 23.686 11.388 -1.854 1.00 32.32 O ATOM 957 CB VAL A 418 21.434 12.189 -3.744 1.00 72.33 C ATOM 958 CG1 VAL A 418 20.904 11.127 -2.835 1.00 63.45 C ATOM 959 CG2 VAL A 418 21.159 13.578 -3.196 1.00 44.14 C ATOM 0 H VAL A 418 22.786 9.926 -4.428 1.00 61.34 H new ATOM 0 HA VAL A 418 23.226 12.803 -4.759 1.00 60.04 H new ATOM 0 HB VAL A 418 20.895 12.088 -4.686 1.00 72.33 H new ATOM 0 HG11 VAL A 418 19.847 11.310 -2.639 1.00 63.45 H new ATOM 0 HG12 VAL A 418 21.022 10.152 -3.307 1.00 63.45 H new ATOM 0 HG13 VAL A 418 21.456 11.144 -1.895 1.00 63.45 H new ATOM 0 HG21 VAL A 418 20.096 13.679 -2.977 1.00 44.14 H new ATOM 0 HG22 VAL A 418 21.733 13.729 -2.282 1.00 44.14 H new ATOM 0 HG23 VAL A 418 21.450 14.325 -3.935 1.00 44.14 H new ATOM 969 N THR A 419 24.736 13.058 -2.868 1.00 22.32 N ATOM 970 CA THR A 419 25.613 13.302 -1.779 1.00 74.33 C ATOM 971 C THR A 419 25.079 14.478 -0.979 1.00 43.34 C ATOM 972 O THR A 419 24.994 15.604 -1.481 1.00 2.00 O ATOM 973 CB THR A 419 27.021 13.616 -2.299 1.00 52.42 C ATOM 974 OG1 THR A 419 27.430 12.556 -3.186 1.00 42.22 O ATOM 975 CG2 THR A 419 28.011 13.707 -1.146 1.00 13.54 C ATOM 0 H THR A 419 24.881 13.673 -3.669 1.00 22.32 H new ATOM 0 HA THR A 419 25.669 12.418 -1.144 1.00 74.33 H new ATOM 0 HB THR A 419 27.004 14.572 -2.822 1.00 52.42 H new ATOM 0 HG1 THR A 419 28.329 12.744 -3.528 1.00 42.22 H new ATOM 0 HG21 THR A 419 29.004 13.930 -1.536 1.00 13.54 H new ATOM 0 HG22 THR A 419 27.703 14.499 -0.463 1.00 13.54 H new ATOM 0 HG23 THR A 419 28.036 12.757 -0.612 1.00 13.54 H new ATOM 983 N VAL A 420 24.696 14.215 0.237 1.00 32.34 N ATOM 984 CA VAL A 420 24.142 15.231 1.077 1.00 51.14 C ATOM 985 C VAL A 420 25.150 15.572 2.163 1.00 21.54 C ATOM 986 O VAL A 420 25.655 14.677 2.849 1.00 73.13 O ATOM 987 CB VAL A 420 22.809 14.761 1.714 1.00 31.21 C ATOM 988 CG1 VAL A 420 22.151 15.888 2.477 1.00 61.33 C ATOM 989 CG2 VAL A 420 21.860 14.213 0.656 1.00 51.54 C ATOM 0 H VAL A 420 24.759 13.294 0.671 1.00 32.34 H new ATOM 0 HA VAL A 420 23.929 16.114 0.475 1.00 51.14 H new ATOM 0 HB VAL A 420 23.040 13.958 2.414 1.00 31.21 H new ATOM 0 HG11 VAL A 420 21.218 15.535 2.915 1.00 61.33 H new ATOM 0 HG12 VAL A 420 22.817 16.229 3.269 1.00 61.33 H new ATOM 0 HG13 VAL A 420 21.943 16.715 1.798 1.00 61.33 H new ATOM 0 HG21 VAL A 420 20.933 13.891 1.130 1.00 51.54 H new ATOM 0 HG22 VAL A 420 21.642 14.991 -0.075 1.00 51.54 H new ATOM 0 HG23 VAL A 420 22.325 13.364 0.155 1.00 51.54 H new ATOM 999 N GLU A 421 25.444 16.849 2.317 1.00 65.11 N ATOM 1000 CA GLU A 421 26.450 17.294 3.286 1.00 14.53 C ATOM 1001 C GLU A 421 25.822 17.958 4.500 1.00 73.55 C ATOM 1002 O GLU A 421 26.524 18.605 5.279 1.00 11.13 O ATOM 1003 CB GLU A 421 27.411 18.289 2.642 1.00 24.10 C ATOM 1004 CG GLU A 421 26.735 19.539 2.101 1.00 33.24 C ATOM 1005 CD GLU A 421 27.719 20.602 1.704 1.00 20.14 C ATOM 1006 OE1 GLU A 421 28.391 20.455 0.669 1.00 4.25 O ATOM 1007 OE2 GLU A 421 27.853 21.601 2.445 1.00 70.35 O ATOM 0 H GLU A 421 25.005 17.603 1.788 1.00 65.11 H new ATOM 0 HA GLU A 421 26.984 16.401 3.609 1.00 14.53 H new ATOM 0 HB2 GLU A 421 28.160 18.583 3.377 1.00 24.10 H new ATOM 0 HB3 GLU A 421 27.940 17.793 1.828 1.00 24.10 H new ATOM 0 HG2 GLU A 421 26.125 19.273 1.238 1.00 33.24 H new ATOM 0 HG3 GLU A 421 26.060 19.939 2.857 1.00 33.24 H new ATOM 1014 N CYS A 422 24.519 17.778 4.673 1.00 15.44 N ATOM 1015 CA CYS A 422 23.788 18.392 5.785 1.00 60.31 C ATOM 1016 C CYS A 422 23.692 19.919 5.668 1.00 10.45 C ATOM 1017 O CYS A 422 24.631 20.605 5.267 1.00 42.44 O ATOM 1018 CB CYS A 422 24.374 17.954 7.145 1.00 43.35 C ATOM 1019 SG CYS A 422 23.816 18.917 8.596 1.00 12.11 S ATOM 0 H CYS A 422 23.940 17.209 4.056 1.00 15.44 H new ATOM 0 HA CYS A 422 22.763 18.025 5.728 1.00 60.31 H new ATOM 0 HB2 CYS A 422 24.121 16.906 7.308 1.00 43.35 H new ATOM 0 HB3 CYS A 422 25.461 18.015 7.088 1.00 43.35 H new ATOM 1024 N GLY A 423 22.542 20.423 5.983 1.00 52.04 N ATOM 1025 CA GLY A 423 22.296 21.825 5.948 1.00 42.21 C ATOM 1026 C GLY A 423 21.160 22.144 6.856 1.00 53.40 C ATOM 1027 O GLY A 423 20.736 21.284 7.634 1.00 50.44 O ATOM 0 H GLY A 423 21.740 19.865 6.275 1.00 52.04 H new ATOM 0 HA2 GLY A 423 23.188 22.371 6.256 1.00 42.21 H new ATOM 0 HA3 GLY A 423 22.064 22.141 4.931 1.00 42.21 H new ATOM 1031 N VAL A 424 20.655 23.332 6.770 1.00 24.21 N ATOM 1032 CA VAL A 424 19.529 23.740 7.589 1.00 23.44 C ATOM 1033 C VAL A 424 18.250 23.605 6.768 1.00 74.14 C ATOM 1034 O VAL A 424 17.152 23.474 7.299 1.00 42.33 O ATOM 1035 CB VAL A 424 19.708 25.199 8.097 1.00 44.31 C ATOM 1036 CG1 VAL A 424 18.565 25.616 9.013 1.00 5.41 C ATOM 1037 CG2 VAL A 424 21.039 25.343 8.816 1.00 21.14 C ATOM 0 H VAL A 424 21.000 24.054 6.137 1.00 24.21 H new ATOM 0 HA VAL A 424 19.469 23.097 8.467 1.00 23.44 H new ATOM 0 HB VAL A 424 19.696 25.859 7.230 1.00 44.31 H new ATOM 0 HG11 VAL A 424 18.723 26.641 9.349 1.00 5.41 H new ATOM 0 HG12 VAL A 424 17.622 25.554 8.470 1.00 5.41 H new ATOM 0 HG13 VAL A 424 18.530 24.952 9.877 1.00 5.41 H new ATOM 0 HG21 VAL A 424 21.154 26.368 9.167 1.00 21.14 H new ATOM 0 HG22 VAL A 424 21.068 24.662 9.667 1.00 21.14 H new ATOM 0 HG23 VAL A 424 21.851 25.102 8.130 1.00 21.14 H new ATOM 1047 N GLU A 425 18.417 23.592 5.470 1.00 32.33 N ATOM 1048 CA GLU A 425 17.333 23.437 4.542 1.00 64.42 C ATOM 1049 C GLU A 425 17.810 22.598 3.387 1.00 22.41 C ATOM 1050 O GLU A 425 18.994 22.621 3.051 1.00 42.42 O ATOM 1051 CB GLU A 425 16.856 24.808 4.057 1.00 3.10 C ATOM 1052 CG GLU A 425 15.733 24.781 3.030 1.00 21.04 C ATOM 1053 CD GLU A 425 15.304 26.165 2.637 1.00 12.30 C ATOM 1054 OE1 GLU A 425 14.466 26.759 3.346 1.00 3.21 O ATOM 1055 OE2 GLU A 425 15.808 26.695 1.642 1.00 22.14 O ATOM 0 H GLU A 425 19.329 23.691 5.023 1.00 32.33 H new ATOM 0 HA GLU A 425 16.491 22.943 5.027 1.00 64.42 H new ATOM 0 HB2 GLU A 425 16.523 25.384 4.920 1.00 3.10 H new ATOM 0 HB3 GLU A 425 17.706 25.339 3.628 1.00 3.10 H new ATOM 0 HG2 GLU A 425 16.063 24.238 2.145 1.00 21.04 H new ATOM 0 HG3 GLU A 425 14.880 24.238 3.438 1.00 21.04 H new ATOM 1062 N ASN A 426 16.920 21.829 2.818 1.00 21.50 N ATOM 1063 CA ASN A 426 17.254 21.022 1.678 1.00 40.42 C ATOM 1064 C ASN A 426 17.206 21.814 0.395 1.00 11.12 C ATOM 1065 O ASN A 426 16.186 22.425 0.060 1.00 22.12 O ATOM 1066 CB ASN A 426 16.432 19.715 1.597 1.00 10.51 C ATOM 1067 CG ASN A 426 14.911 19.855 1.728 1.00 1.34 C ATOM 1068 OD1 ASN A 426 14.259 18.937 2.197 1.00 15.11 O ATOM 1069 ND2 ASN A 426 14.347 20.974 1.348 1.00 63.43 N ATOM 0 H ASN A 426 15.952 21.745 3.129 1.00 21.50 H new ATOM 0 HA ASN A 426 18.288 20.708 1.820 1.00 40.42 H new ATOM 0 HB2 ASN A 426 16.650 19.234 0.644 1.00 10.51 H new ATOM 0 HB3 ASN A 426 16.782 19.043 2.381 1.00 10.51 H new ATOM 0 HD21 ASN A 426 13.338 21.094 1.441 1.00 63.43 H new ATOM 0 HD22 ASN A 426 14.916 21.726 0.959 1.00 63.43 H new ATOM 1076 N GLU A 427 18.304 21.823 -0.300 1.00 43.32 N ATOM 1077 CA GLU A 427 18.418 22.536 -1.533 1.00 53.23 C ATOM 1078 C GLU A 427 19.482 21.862 -2.375 1.00 53.25 C ATOM 1079 O GLU A 427 20.505 21.388 -1.839 1.00 12.01 O ATOM 1080 CB GLU A 427 18.781 24.009 -1.255 1.00 32.40 C ATOM 1081 CG GLU A 427 18.803 24.910 -2.482 1.00 45.04 C ATOM 1082 CD GLU A 427 19.115 26.344 -2.134 1.00 15.54 C ATOM 1083 OE1 GLU A 427 18.218 27.063 -1.659 1.00 40.23 O ATOM 1084 OE2 GLU A 427 20.254 26.786 -2.327 1.00 63.23 O ATOM 0 H GLU A 427 19.153 21.330 -0.023 1.00 43.32 H new ATOM 0 HA GLU A 427 17.470 22.524 -2.071 1.00 53.23 H new ATOM 0 HB2 GLU A 427 18.067 24.414 -0.538 1.00 32.40 H new ATOM 0 HB3 GLU A 427 19.762 24.042 -0.781 1.00 32.40 H new ATOM 0 HG2 GLU A 427 19.546 24.540 -3.188 1.00 45.04 H new ATOM 0 HG3 GLU A 427 17.836 24.862 -2.983 1.00 45.04 H new ATOM 1091 N ILE A 428 19.225 21.751 -3.653 1.00 33.14 N ATOM 1092 CA ILE A 428 20.178 21.176 -4.570 1.00 54.45 C ATOM 1093 C ILE A 428 21.179 22.240 -4.959 1.00 72.35 C ATOM 1094 O ILE A 428 20.821 23.261 -5.555 1.00 22.25 O ATOM 1095 CB ILE A 428 19.484 20.628 -5.833 1.00 44.24 C ATOM 1096 CG1 ILE A 428 18.375 19.653 -5.431 1.00 60.43 C ATOM 1097 CG2 ILE A 428 20.501 19.939 -6.747 1.00 20.01 C ATOM 1098 CD1 ILE A 428 17.554 19.124 -6.584 1.00 73.22 C ATOM 0 H ILE A 428 18.353 22.055 -4.087 1.00 33.14 H new ATOM 0 HA ILE A 428 20.679 20.342 -4.078 1.00 54.45 H new ATOM 0 HB ILE A 428 19.042 21.458 -6.383 1.00 44.24 H new ATOM 0 HG12 ILE A 428 18.823 18.810 -4.905 1.00 60.43 H new ATOM 0 HG13 ILE A 428 17.709 20.151 -4.726 1.00 60.43 H new ATOM 0 HG21 ILE A 428 19.994 19.558 -7.634 1.00 20.01 H new ATOM 0 HG22 ILE A 428 21.266 20.656 -7.046 1.00 20.01 H new ATOM 0 HG23 ILE A 428 20.968 19.112 -6.213 1.00 20.01 H new ATOM 0 HD11 ILE A 428 16.793 18.441 -6.206 1.00 73.22 H new ATOM 0 HD12 ILE A 428 17.072 19.955 -7.099 1.00 73.22 H new ATOM 0 HD13 ILE A 428 18.204 18.593 -7.280 1.00 73.22 H new ATOM 1110 N VAL A 429 22.418 22.005 -4.614 1.00 62.40 N ATOM 1111 CA VAL A 429 23.465 22.953 -4.877 1.00 50.24 C ATOM 1112 C VAL A 429 23.895 22.855 -6.329 1.00 64.11 C ATOM 1113 O VAL A 429 23.753 23.804 -7.097 1.00 15.01 O ATOM 1114 CB VAL A 429 24.684 22.711 -3.947 1.00 45.11 C ATOM 1115 CG1 VAL A 429 25.782 23.749 -4.179 1.00 32.14 C ATOM 1116 CG2 VAL A 429 24.248 22.693 -2.487 1.00 43.53 C ATOM 0 H VAL A 429 22.727 21.154 -4.145 1.00 62.40 H new ATOM 0 HA VAL A 429 23.079 23.953 -4.679 1.00 50.24 H new ATOM 0 HB VAL A 429 25.103 21.735 -4.193 1.00 45.11 H new ATOM 0 HG11 VAL A 429 26.619 23.548 -3.511 1.00 32.14 H new ATOM 0 HG12 VAL A 429 26.122 23.694 -5.213 1.00 32.14 H new ATOM 0 HG13 VAL A 429 25.389 24.746 -3.979 1.00 32.14 H new ATOM 0 HG21 VAL A 429 25.116 22.522 -1.850 1.00 43.53 H new ATOM 0 HG22 VAL A 429 23.793 23.650 -2.231 1.00 43.53 H new ATOM 0 HG23 VAL A 429 23.523 21.894 -2.334 1.00 43.53 H new ATOM 1126 N SER A 430 24.407 21.700 -6.707 1.00 2.23 N ATOM 1127 CA SER A 430 24.870 21.466 -8.059 1.00 51.33 C ATOM 1128 C SER A 430 24.852 19.977 -8.366 1.00 43.41 C ATOM 1129 O SER A 430 24.718 19.147 -7.454 1.00 13.11 O ATOM 1130 CB SER A 430 26.288 22.029 -8.243 1.00 10.23 C ATOM 1131 OG SER A 430 26.315 23.429 -8.007 1.00 74.25 O ATOM 0 H SER A 430 24.513 20.898 -6.085 1.00 2.23 H new ATOM 0 HA SER A 430 24.201 21.977 -8.752 1.00 51.33 H new ATOM 0 HB2 SER A 430 26.973 21.528 -7.559 1.00 10.23 H new ATOM 0 HB3 SER A 430 26.637 21.820 -9.254 1.00 10.23 H new ATOM 0 HG SER A 430 27.228 23.764 -8.129 1.00 74.25 H new ATOM 1137 N VAL A 431 24.976 19.649 -9.635 1.00 3.43 N ATOM 1138 CA VAL A 431 25.006 18.276 -10.108 1.00 64.25 C ATOM 1139 C VAL A 431 26.094 18.170 -11.167 1.00 73.41 C ATOM 1140 O VAL A 431 26.160 19.010 -12.070 1.00 2.44 O ATOM 1141 CB VAL A 431 23.645 17.833 -10.737 1.00 1.00 C ATOM 1142 CG1 VAL A 431 23.712 16.384 -11.207 1.00 3.40 C ATOM 1143 CG2 VAL A 431 22.492 18.016 -9.758 1.00 22.23 C ATOM 0 H VAL A 431 25.060 20.339 -10.381 1.00 3.43 H new ATOM 0 HA VAL A 431 25.200 17.623 -9.257 1.00 64.25 H new ATOM 0 HB VAL A 431 23.460 18.473 -11.600 1.00 1.00 H new ATOM 0 HG11 VAL A 431 22.754 16.098 -11.641 1.00 3.40 H new ATOM 0 HG12 VAL A 431 24.496 16.281 -11.957 1.00 3.40 H new ATOM 0 HG13 VAL A 431 23.934 15.736 -10.359 1.00 3.40 H new ATOM 0 HG21 VAL A 431 21.561 17.698 -10.228 1.00 22.23 H new ATOM 0 HG22 VAL A 431 22.672 17.414 -8.867 1.00 22.23 H new ATOM 0 HG23 VAL A 431 22.416 19.066 -9.477 1.00 22.23 H new ATOM 1153 N LEU A 432 26.938 17.176 -11.060 1.00 31.21 N ATOM 1154 CA LEU A 432 28.033 17.020 -12.001 1.00 3.23 C ATOM 1155 C LEU A 432 28.088 15.608 -12.573 1.00 54.12 C ATOM 1156 O LEU A 432 28.049 14.624 -11.832 1.00 43.35 O ATOM 1157 CB LEU A 432 29.372 17.349 -11.317 1.00 2.52 C ATOM 1158 CG LEU A 432 30.639 17.197 -12.178 1.00 22.34 C ATOM 1159 CD1 LEU A 432 30.642 18.177 -13.340 1.00 12.03 C ATOM 1160 CD2 LEU A 432 31.889 17.355 -11.331 1.00 14.42 C ATOM 0 H LEU A 432 26.894 16.460 -10.334 1.00 31.21 H new ATOM 0 HA LEU A 432 27.859 17.714 -12.823 1.00 3.23 H new ATOM 0 HB2 LEU A 432 29.327 18.376 -10.955 1.00 2.52 H new ATOM 0 HB3 LEU A 432 29.475 16.707 -10.442 1.00 2.52 H new ATOM 0 HG LEU A 432 30.636 16.191 -12.597 1.00 22.34 H new ATOM 0 HD11 LEU A 432 31.550 18.042 -13.927 1.00 12.03 H new ATOM 0 HD12 LEU A 432 29.772 17.996 -13.971 1.00 12.03 H new ATOM 0 HD13 LEU A 432 30.606 19.197 -12.956 1.00 12.03 H new ATOM 0 HD21 LEU A 432 32.772 17.244 -11.961 1.00 14.42 H new ATOM 0 HD22 LEU A 432 31.894 18.343 -10.871 1.00 14.42 H new ATOM 0 HD23 LEU A 432 31.900 16.592 -10.553 1.00 14.42 H new ATOM 1172 N GLU A 433 28.170 15.509 -13.878 1.00 22.13 N ATOM 1173 CA GLU A 433 28.365 14.235 -14.528 1.00 71.12 C ATOM 1174 C GLU A 433 29.859 13.988 -14.612 1.00 15.51 C ATOM 1175 O GLU A 433 30.523 14.433 -15.549 1.00 64.05 O ATOM 1176 CB GLU A 433 27.758 14.216 -15.939 1.00 61.21 C ATOM 1177 CG GLU A 433 27.912 12.880 -16.666 1.00 50.31 C ATOM 1178 CD GLU A 433 27.460 12.946 -18.102 1.00 53.21 C ATOM 1179 OE1 GLU A 433 26.262 12.894 -18.367 1.00 30.02 O ATOM 1180 OE2 GLU A 433 28.331 13.056 -18.997 1.00 34.11 O ATOM 0 H GLU A 433 28.104 16.303 -14.515 1.00 22.13 H new ATOM 0 HA GLU A 433 27.865 13.457 -13.952 1.00 71.12 H new ATOM 0 HB2 GLU A 433 26.698 14.460 -15.870 1.00 61.21 H new ATOM 0 HB3 GLU A 433 28.227 14.998 -16.535 1.00 61.21 H new ATOM 0 HG2 GLU A 433 28.956 12.570 -16.632 1.00 50.31 H new ATOM 0 HG3 GLU A 433 27.336 12.117 -16.142 1.00 50.31 H new ATOM 1187 N ALA A 434 30.395 13.366 -13.604 1.00 22.00 N ATOM 1188 CA ALA A 434 31.818 13.093 -13.571 1.00 64.22 C ATOM 1189 C ALA A 434 32.078 11.626 -13.788 1.00 33.44 C ATOM 1190 O ALA A 434 33.065 11.239 -14.393 1.00 64.44 O ATOM 1191 CB ALA A 434 32.417 13.551 -12.254 1.00 24.44 C ATOM 0 H ALA A 434 29.877 13.035 -12.790 1.00 22.00 H new ATOM 0 HA ALA A 434 32.295 13.650 -14.377 1.00 64.22 H new ATOM 0 HB1 ALA A 434 33.486 13.338 -12.247 1.00 24.44 H new ATOM 0 HB2 ALA A 434 32.260 14.623 -12.136 1.00 24.44 H new ATOM 0 HB3 ALA A 434 31.936 13.021 -11.432 1.00 24.44 H new ATOM 1197 N GLN A 435 31.178 10.813 -13.313 1.00 32.52 N ATOM 1198 CA GLN A 435 31.323 9.392 -13.427 1.00 32.34 C ATOM 1199 C GLN A 435 30.476 8.893 -14.582 1.00 31.34 C ATOM 1200 O GLN A 435 29.647 9.646 -15.094 1.00 24.31 O ATOM 1201 CB GLN A 435 30.960 8.730 -12.099 1.00 31.45 C ATOM 1202 CG GLN A 435 31.854 9.205 -10.956 1.00 25.33 C ATOM 1203 CD GLN A 435 31.530 8.599 -9.597 1.00 52.13 C ATOM 1204 OE1 GLN A 435 31.736 9.238 -8.556 1.00 21.01 O ATOM 1205 NE2 GLN A 435 31.058 7.388 -9.580 1.00 62.04 N ATOM 0 H GLN A 435 30.327 11.116 -12.838 1.00 32.52 H new ATOM 0 HA GLN A 435 32.358 9.127 -13.643 1.00 32.34 H new ATOM 0 HB2 GLN A 435 29.919 8.947 -11.859 1.00 31.45 H new ATOM 0 HB3 GLN A 435 31.045 7.648 -12.199 1.00 31.45 H new ATOM 0 HG2 GLN A 435 32.890 8.973 -11.204 1.00 25.33 H new ATOM 0 HG3 GLN A 435 31.779 10.290 -10.882 1.00 25.33 H new ATOM 0 HE21 GLN A 435 30.900 6.890 -10.456 1.00 62.04 H new ATOM 0 HE22 GLN A 435 30.846 6.936 -8.691 1.00 62.04 H new ATOM 1214 N LYS A 436 30.704 7.652 -14.995 1.00 21.05 N ATOM 1215 CA LYS A 436 30.027 7.002 -16.151 1.00 73.21 C ATOM 1216 C LYS A 436 28.497 7.188 -16.226 1.00 53.14 C ATOM 1217 O LYS A 436 27.738 6.382 -15.727 1.00 12.31 O ATOM 1218 CB LYS A 436 30.468 5.512 -16.297 1.00 23.54 C ATOM 1219 CG LYS A 436 30.550 4.670 -14.974 1.00 35.44 C ATOM 1220 CD LYS A 436 29.214 4.493 -14.239 1.00 31.25 C ATOM 1221 CE LYS A 436 29.375 3.682 -12.963 1.00 23.11 C ATOM 1222 NZ LYS A 436 28.092 3.497 -12.224 1.00 5.34 N ATOM 0 H LYS A 436 31.378 7.040 -14.535 1.00 21.05 H new ATOM 0 HA LYS A 436 30.378 7.550 -17.025 1.00 73.21 H new ATOM 0 HB2 LYS A 436 29.773 5.016 -16.974 1.00 23.54 H new ATOM 0 HB3 LYS A 436 31.447 5.492 -16.775 1.00 23.54 H new ATOM 0 HG2 LYS A 436 30.951 3.685 -15.211 1.00 35.44 H new ATOM 0 HG3 LYS A 436 31.259 5.149 -14.299 1.00 35.44 H new ATOM 0 HD2 LYS A 436 28.799 5.472 -13.998 1.00 31.25 H new ATOM 0 HD3 LYS A 436 28.500 3.998 -14.897 1.00 31.25 H new ATOM 0 HE2 LYS A 436 29.790 2.705 -13.210 1.00 23.11 H new ATOM 0 HE3 LYS A 436 30.095 4.178 -12.312 1.00 23.11 H new ATOM 0 HZ1 LYS A 436 28.270 2.967 -11.347 1.00 5.34 H new ATOM 0 HZ2 LYS A 436 27.689 4.427 -11.991 1.00 5.34 H new ATOM 0 HZ3 LYS A 436 27.422 2.968 -12.818 1.00 5.34 H new ATOM 1236 N CYS A 437 28.065 8.293 -16.846 1.00 71.13 N ATOM 1237 CA CYS A 437 26.640 8.653 -16.948 1.00 1.52 C ATOM 1238 C CYS A 437 26.021 8.724 -15.561 1.00 33.34 C ATOM 1239 O CYS A 437 24.804 8.639 -15.400 1.00 41.10 O ATOM 1240 CB CYS A 437 25.897 7.636 -17.815 1.00 13.20 C ATOM 1241 SG CYS A 437 26.562 7.497 -19.508 1.00 74.41 S ATOM 0 H CYS A 437 28.691 8.964 -17.292 1.00 71.13 H new ATOM 0 HA CYS A 437 26.556 9.633 -17.419 1.00 1.52 H new ATOM 0 HB2 CYS A 437 25.943 6.659 -17.334 1.00 13.20 H new ATOM 0 HB3 CYS A 437 24.845 7.916 -17.869 1.00 13.20 H new ATOM 1246 N GLU A 438 26.866 8.917 -14.569 1.00 42.15 N ATOM 1247 CA GLU A 438 26.453 8.927 -13.228 1.00 4.14 C ATOM 1248 C GLU A 438 26.599 10.321 -12.705 1.00 34.25 C ATOM 1249 O GLU A 438 27.700 10.909 -12.709 1.00 61.25 O ATOM 1250 CB GLU A 438 27.244 7.878 -12.441 1.00 2.32 C ATOM 1251 CG GLU A 438 26.797 7.661 -11.011 1.00 30.23 C ATOM 1252 CD GLU A 438 27.318 6.347 -10.473 1.00 51.23 C ATOM 1253 OE1 GLU A 438 26.660 5.294 -10.722 1.00 52.24 O ATOM 1254 OE2 GLU A 438 28.359 6.321 -9.840 1.00 24.32 O ATOM 0 H GLU A 438 27.866 9.071 -14.699 1.00 42.15 H new ATOM 0 HA GLU A 438 25.404 8.650 -13.122 1.00 4.14 H new ATOM 0 HB2 GLU A 438 27.181 6.928 -12.971 1.00 2.32 H new ATOM 0 HB3 GLU A 438 28.294 8.170 -12.435 1.00 2.32 H new ATOM 0 HG2 GLU A 438 27.153 8.480 -10.387 1.00 30.23 H new ATOM 0 HG3 GLU A 438 25.708 7.672 -10.961 1.00 30.23 H new ATOM 1261 N TYR A 439 25.499 10.850 -12.293 1.00 53.14 N ATOM 1262 CA TYR A 439 25.393 12.209 -11.907 1.00 12.24 C ATOM 1263 C TYR A 439 25.567 12.356 -10.429 1.00 54.12 C ATOM 1264 O TYR A 439 24.881 11.701 -9.638 1.00 65.11 O ATOM 1265 CB TYR A 439 24.037 12.773 -12.389 1.00 51.34 C ATOM 1266 CG TYR A 439 23.904 12.738 -13.890 1.00 54.34 C ATOM 1267 CD1 TYR A 439 23.466 11.590 -14.531 1.00 14.33 C ATOM 1268 CD2 TYR A 439 24.243 13.831 -14.670 1.00 33.43 C ATOM 1269 CE1 TYR A 439 23.366 11.531 -15.894 1.00 3.54 C ATOM 1270 CE2 TYR A 439 24.148 13.774 -16.045 1.00 43.42 C ATOM 1271 CZ TYR A 439 23.708 12.615 -16.649 1.00 41.25 C ATOM 1272 OH TYR A 439 23.622 12.542 -18.024 1.00 45.04 O ATOM 0 H TYR A 439 24.624 10.331 -12.214 1.00 53.14 H new ATOM 0 HA TYR A 439 26.190 12.785 -12.376 1.00 12.24 H new ATOM 0 HB2 TYR A 439 23.227 12.198 -11.941 1.00 51.34 H new ATOM 0 HB3 TYR A 439 23.929 13.800 -12.041 1.00 51.34 H new ATOM 0 HD1 TYR A 439 23.198 10.725 -13.943 1.00 14.33 H new ATOM 0 HD2 TYR A 439 24.586 14.739 -14.196 1.00 33.43 H new ATOM 0 HE1 TYR A 439 23.017 10.628 -16.372 1.00 3.54 H new ATOM 0 HE2 TYR A 439 24.416 14.631 -16.644 1.00 43.42 H new ATOM 0 HH TYR A 439 24.521 12.585 -18.411 1.00 45.04 H new ATOM 1282 N LEU A 440 26.510 13.181 -10.064 1.00 13.21 N ATOM 1283 CA LEU A 440 26.805 13.460 -8.691 1.00 44.23 C ATOM 1284 C LEU A 440 25.913 14.607 -8.259 1.00 75.41 C ATOM 1285 O LEU A 440 26.123 15.745 -8.694 1.00 61.10 O ATOM 1286 CB LEU A 440 28.271 13.925 -8.540 1.00 71.53 C ATOM 1287 CG LEU A 440 29.379 13.055 -9.157 1.00 34.32 C ATOM 1288 CD1 LEU A 440 30.735 13.694 -8.924 1.00 71.22 C ATOM 1289 CD2 LEU A 440 29.365 11.655 -8.592 1.00 51.40 C ATOM 0 H LEU A 440 27.102 13.684 -10.724 1.00 13.21 H new ATOM 0 HA LEU A 440 26.645 12.563 -8.092 1.00 44.23 H new ATOM 0 HB2 LEU A 440 28.350 14.922 -8.974 1.00 71.53 H new ATOM 0 HB3 LEU A 440 28.480 14.024 -7.475 1.00 71.53 H new ATOM 0 HG LEU A 440 29.190 12.986 -10.228 1.00 34.32 H new ATOM 0 HD11 LEU A 440 31.512 13.070 -9.365 1.00 71.22 H new ATOM 0 HD12 LEU A 440 30.756 14.681 -9.386 1.00 71.22 H new ATOM 0 HD13 LEU A 440 30.912 13.791 -7.853 1.00 71.22 H new ATOM 0 HD21 LEU A 440 30.161 11.069 -9.051 1.00 51.40 H new ATOM 0 HD22 LEU A 440 29.520 11.696 -7.514 1.00 51.40 H new ATOM 0 HD23 LEU A 440 28.403 11.187 -8.802 1.00 51.40 H new ATOM 1301 N ILE A 441 24.904 14.332 -7.484 1.00 74.44 N ATOM 1302 CA ILE A 441 24.062 15.378 -6.993 1.00 63.20 C ATOM 1303 C ILE A 441 24.584 15.819 -5.653 1.00 15.32 C ATOM 1304 O ILE A 441 24.814 14.995 -4.771 1.00 45.04 O ATOM 1305 CB ILE A 441 22.558 14.973 -6.839 1.00 54.22 C ATOM 1306 CG1 ILE A 441 21.912 14.571 -8.152 1.00 30.20 C ATOM 1307 CG2 ILE A 441 21.759 16.097 -6.238 1.00 42.14 C ATOM 1308 CD1 ILE A 441 22.331 13.246 -8.697 1.00 61.44 C ATOM 0 H ILE A 441 24.646 13.393 -7.180 1.00 74.44 H new ATOM 0 HA ILE A 441 24.091 16.177 -7.733 1.00 63.20 H new ATOM 0 HB ILE A 441 22.553 14.106 -6.179 1.00 54.22 H new ATOM 0 HG12 ILE A 441 20.830 14.563 -8.017 1.00 30.20 H new ATOM 0 HG13 ILE A 441 22.135 15.337 -8.895 1.00 30.20 H new ATOM 0 HG21 ILE A 441 20.717 15.792 -6.141 1.00 42.14 H new ATOM 0 HG22 ILE A 441 22.159 16.342 -5.254 1.00 42.14 H new ATOM 0 HG23 ILE A 441 21.822 16.973 -6.883 1.00 42.14 H new ATOM 0 HD11 ILE A 441 21.810 13.058 -9.636 1.00 61.44 H new ATOM 0 HD12 ILE A 441 23.407 13.249 -8.873 1.00 61.44 H new ATOM 0 HD13 ILE A 441 22.082 12.463 -7.981 1.00 61.44 H new ATOM 1320 N LYS A 442 24.770 17.086 -5.499 1.00 64.20 N ATOM 1321 CA LYS A 442 25.293 17.601 -4.269 1.00 62.53 C ATOM 1322 C LYS A 442 24.183 18.396 -3.583 1.00 45.42 C ATOM 1323 O LYS A 442 23.662 19.372 -4.148 1.00 24.50 O ATOM 1324 CB LYS A 442 26.516 18.498 -4.541 1.00 74.24 C ATOM 1325 CG LYS A 442 27.624 18.389 -3.465 1.00 53.23 C ATOM 1326 CD LYS A 442 27.140 18.755 -2.065 1.00 34.04 C ATOM 1327 CE LYS A 442 26.839 20.236 -1.928 1.00 20.34 C ATOM 1328 NZ LYS A 442 28.066 21.056 -1.974 1.00 63.22 N ATOM 0 H LYS A 442 24.569 17.790 -6.209 1.00 64.20 H new ATOM 0 HA LYS A 442 25.620 16.785 -3.625 1.00 62.53 H new ATOM 0 HB2 LYS A 442 26.938 18.236 -5.511 1.00 74.24 H new ATOM 0 HB3 LYS A 442 26.187 19.535 -4.606 1.00 74.24 H new ATOM 0 HG2 LYS A 442 28.012 17.370 -3.454 1.00 53.23 H new ATOM 0 HG3 LYS A 442 28.453 19.042 -3.738 1.00 53.23 H new ATOM 0 HD2 LYS A 442 26.243 18.181 -1.832 1.00 34.04 H new ATOM 0 HD3 LYS A 442 27.898 18.472 -1.335 1.00 34.04 H new ATOM 0 HE2 LYS A 442 26.166 20.545 -2.728 1.00 20.34 H new ATOM 0 HE3 LYS A 442 26.318 20.415 -0.987 1.00 20.34 H new ATOM 0 HZ1 LYS A 442 27.823 22.029 -2.250 1.00 63.22 H new ATOM 0 HZ2 LYS A 442 28.514 21.064 -1.035 1.00 63.22 H new ATOM 0 HZ3 LYS A 442 28.726 20.654 -2.669 1.00 63.22 H new ATOM 1342 N MET A 443 23.826 17.992 -2.388 1.00 53.44 N ATOM 1343 CA MET A 443 22.755 18.611 -1.655 1.00 14.04 C ATOM 1344 C MET A 443 23.118 18.726 -0.222 1.00 62.51 C ATOM 1345 O MET A 443 24.162 18.247 0.220 1.00 5.52 O ATOM 1346 CB MET A 443 21.466 17.777 -1.717 1.00 54.12 C ATOM 1347 CG MET A 443 20.827 17.645 -3.068 1.00 71.13 C ATOM 1348 SD MET A 443 19.330 16.649 -3.017 1.00 42.53 S ATOM 1349 CE MET A 443 18.326 17.582 -1.864 1.00 12.40 C ATOM 0 H MET A 443 24.275 17.219 -1.896 1.00 53.44 H new ATOM 0 HA MET A 443 22.591 19.588 -2.109 1.00 14.04 H new ATOM 0 HB2 MET A 443 21.687 16.777 -1.343 1.00 54.12 H new ATOM 0 HB3 MET A 443 20.739 18.219 -1.036 1.00 54.12 H new ATOM 0 HG2 MET A 443 20.589 18.636 -3.454 1.00 71.13 H new ATOM 0 HG3 MET A 443 21.537 17.195 -3.762 1.00 71.13 H new ATOM 0 HE1 MET A 443 17.290 17.249 -1.931 1.00 12.40 H new ATOM 0 HE2 MET A 443 18.694 17.423 -0.850 1.00 12.40 H new ATOM 0 HE3 MET A 443 18.382 18.643 -2.108 1.00 12.40 H new ATOM 1359 N LYS A 444 22.257 19.341 0.494 1.00 74.11 N ATOM 1360 CA LYS A 444 22.348 19.453 1.892 1.00 11.04 C ATOM 1361 C LYS A 444 20.952 19.514 2.427 1.00 5.31 C ATOM 1362 O LYS A 444 20.081 20.076 1.782 1.00 52.51 O ATOM 1363 CB LYS A 444 23.200 20.644 2.292 1.00 70.24 C ATOM 1364 CG LYS A 444 22.782 21.967 1.737 1.00 44.50 C ATOM 1365 CD LYS A 444 23.856 22.956 2.041 1.00 30.14 C ATOM 1366 CE LYS A 444 23.455 24.359 1.645 1.00 23.11 C ATOM 1367 NZ LYS A 444 24.501 25.347 1.972 1.00 21.33 N ATOM 0 H LYS A 444 21.434 19.799 0.102 1.00 74.11 H new ATOM 0 HA LYS A 444 22.853 18.590 2.325 1.00 11.04 H new ATOM 0 HB2 LYS A 444 23.203 20.714 3.380 1.00 70.24 H new ATOM 0 HB3 LYS A 444 24.227 20.451 1.982 1.00 70.24 H new ATOM 0 HG2 LYS A 444 22.624 21.896 0.661 1.00 44.50 H new ATOM 0 HG3 LYS A 444 21.837 22.284 2.178 1.00 44.50 H new ATOM 0 HD2 LYS A 444 24.083 22.930 3.107 1.00 30.14 H new ATOM 0 HD3 LYS A 444 24.768 22.676 1.514 1.00 30.14 H new ATOM 0 HE2 LYS A 444 23.250 24.389 0.575 1.00 23.11 H new ATOM 0 HE3 LYS A 444 22.530 24.629 2.154 1.00 23.11 H new ATOM 0 HZ1 LYS A 444 24.185 26.295 1.684 1.00 21.33 H new ATOM 0 HZ2 LYS A 444 24.679 25.338 2.997 1.00 21.33 H new ATOM 0 HZ3 LYS A 444 25.377 25.105 1.466 1.00 21.33 H new ATOM 1381 N SER A 445 20.721 18.879 3.543 1.00 10.12 N ATOM 1382 CA SER A 445 19.403 18.792 4.100 1.00 4.42 C ATOM 1383 C SER A 445 19.503 18.570 5.591 1.00 22.31 C ATOM 1384 O SER A 445 20.412 17.864 6.049 1.00 41.05 O ATOM 1385 CB SER A 445 18.648 17.613 3.446 1.00 23.21 C ATOM 1386 OG SER A 445 17.349 17.453 3.994 1.00 22.35 O ATOM 0 H SER A 445 21.442 18.408 4.090 1.00 10.12 H new ATOM 0 HA SER A 445 18.861 19.718 3.909 1.00 4.42 H new ATOM 0 HB2 SER A 445 18.572 17.781 2.372 1.00 23.21 H new ATOM 0 HB3 SER A 445 19.217 16.694 3.585 1.00 23.21 H new ATOM 0 HG SER A 445 16.900 16.700 3.556 1.00 22.35 H new ATOM 1392 N PRO A 446 18.607 19.179 6.378 1.00 55.20 N ATOM 1393 CA PRO A 446 18.575 18.982 7.824 1.00 35.32 C ATOM 1394 C PRO A 446 18.118 17.575 8.182 1.00 52.42 C ATOM 1395 O PRO A 446 18.561 17.010 9.161 1.00 21.55 O ATOM 1396 CB PRO A 446 17.527 20.003 8.295 1.00 71.24 C ATOM 1397 CG PRO A 446 16.660 20.223 7.111 1.00 60.02 C ATOM 1398 CD PRO A 446 17.573 20.143 5.934 1.00 54.32 C ATOM 0 HA PRO A 446 19.556 19.110 8.283 1.00 35.32 H new ATOM 0 HB2 PRO A 446 16.954 19.622 9.140 1.00 71.24 H new ATOM 0 HB3 PRO A 446 17.996 20.931 8.621 1.00 71.24 H new ATOM 0 HG2 PRO A 446 15.876 19.468 7.052 1.00 60.02 H new ATOM 0 HG3 PRO A 446 16.166 21.193 7.160 1.00 60.02 H new ATOM 0 HD2 PRO A 446 17.052 19.794 5.042 1.00 54.32 H new ATOM 0 HD3 PRO A 446 18.004 21.114 5.691 1.00 54.32 H new ATOM 1406 N ALA A 447 17.286 16.999 7.327 1.00 23.24 N ATOM 1407 CA ALA A 447 16.692 15.697 7.579 1.00 32.25 C ATOM 1408 C ALA A 447 17.630 14.553 7.203 1.00 74.12 C ATOM 1409 O ALA A 447 17.395 13.397 7.543 1.00 42.31 O ATOM 1410 CB ALA A 447 15.372 15.579 6.840 1.00 61.02 C ATOM 0 H ALA A 447 17.005 17.421 6.442 1.00 23.24 H new ATOM 0 HA ALA A 447 16.511 15.616 8.651 1.00 32.25 H new ATOM 0 HB1 ALA A 447 14.933 14.600 7.034 1.00 61.02 H new ATOM 0 HB2 ALA A 447 14.691 16.357 7.185 1.00 61.02 H new ATOM 0 HB3 ALA A 447 15.543 15.695 5.770 1.00 61.02 H new ATOM 1416 N ALA A 448 18.692 14.876 6.513 1.00 32.14 N ATOM 1417 CA ALA A 448 19.637 13.877 6.078 1.00 61.24 C ATOM 1418 C ALA A 448 20.911 14.044 6.847 1.00 11.14 C ATOM 1419 O ALA A 448 21.859 13.305 6.678 1.00 64.25 O ATOM 1420 CB ALA A 448 19.888 14.002 4.596 1.00 12.21 C ATOM 0 H ALA A 448 18.927 15.830 6.238 1.00 32.14 H new ATOM 0 HA ALA A 448 19.231 12.883 6.266 1.00 61.24 H new ATOM 0 HB1 ALA A 448 20.603 13.241 4.283 1.00 12.21 H new ATOM 0 HB2 ALA A 448 18.952 13.864 4.055 1.00 12.21 H new ATOM 0 HB3 ALA A 448 20.291 14.991 4.377 1.00 12.21 H new ATOM 1426 N CYS A 449 20.912 15.044 7.692 1.00 51.34 N ATOM 1427 CA CYS A 449 22.064 15.403 8.469 1.00 73.31 C ATOM 1428 C CYS A 449 22.337 14.355 9.542 1.00 73.15 C ATOM 1429 O CYS A 449 23.485 14.101 9.913 1.00 0.20 O ATOM 1430 CB CYS A 449 21.819 16.766 9.099 1.00 31.15 C ATOM 1431 SG CYS A 449 23.245 17.511 9.928 1.00 72.40 S ATOM 0 H CYS A 449 20.100 15.638 7.859 1.00 51.34 H new ATOM 0 HA CYS A 449 22.942 15.450 7.824 1.00 73.31 H new ATOM 0 HB2 CYS A 449 21.475 17.449 8.322 1.00 31.15 H new ATOM 0 HB3 CYS A 449 21.009 16.672 9.822 1.00 31.15 H new ATOM 1436 N SER A 450 21.293 13.759 10.044 1.00 33.12 N ATOM 1437 CA SER A 450 21.410 12.746 11.039 1.00 63.21 C ATOM 1438 C SER A 450 20.287 11.741 10.855 1.00 65.43 C ATOM 1439 O SER A 450 20.525 10.670 10.248 1.00 36.51 O ATOM 1440 CB SER A 450 21.392 13.370 12.439 1.00 15.32 C ATOM 1441 OG SER A 450 22.465 14.312 12.575 1.00 11.43 O ATOM 1442 OXT SER A 450 19.164 12.036 11.254 1.00 36.51 O ATOM 0 H SER A 450 20.333 13.968 9.769 1.00 33.12 H new ATOM 0 HA SER A 450 22.362 12.225 10.932 1.00 63.21 H new ATOM 0 HB2 SER A 450 20.438 13.867 12.611 1.00 15.32 H new ATOM 0 HB3 SER A 450 21.485 12.590 13.194 1.00 15.32 H new ATOM 0 HG SER A 450 22.443 14.706 13.472 1.00 11.43 H new TER 1448 SER A 450