USER MOD reduce.3.24.130724 H: found=0, std=0, add=715, rem=0, adj=26 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 -107:sc= -0.473 USER MOD Set 1.2: A 384 GLN :FLIP amide:sc= -0.203 F(o=-1.3,f=-0.68) USER MOD Set 2.1: A 381 ASN : amide:sc= -0.581 K(o=-3.3,f=-5.2!) USER MOD Set 2.2: A 391 ASN : amide:sc= -2.71! C(o=-3.3!,f=-6!) USER MOD Set 3.1: A 365 THR OG1 : rot -79:sc= 0.624 USER MOD Set 3.2: A 426 ASN : amide:sc= 0.535 K(o=0.27,f=-4.3!) USER MOD Set 3.3: A 443 MET CE :methyl 168:sc= -0.893 (180deg=-1.79) USER MOD Single : A 357 TYR OH : rot 180:sc= 0 USER MOD Single : A 361 LYS NZ :NH3+ -172:sc= 1.17 (180deg=0.899) USER MOD Single : A 363 MET CE :methyl -120:sc= -0.225 (180deg=-3!) USER MOD Single : A 366 LYS NZ :NH3+ -169:sc= 1.23 (180deg=1.15) USER MOD Single : A 372 TYR OH : rot 180:sc= 0 USER MOD Single : A 373 THR OG1 : rot 180:sc= -0.734 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 -34:sc= 0.427 USER MOD Single : A 394 SER OG : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= -0.414 K(o=-0.41,f=-1.5) USER MOD Single : A 398 ASN : amide:sc= -2.71! C(o=-2.7!,f=-7.4!) USER MOD Single : A 401 LYS NZ :NH3+ -175:sc= 1.23 (180deg=1.03) USER MOD Single : A 402 TYR OH : rot 40:sc= 0.671 USER MOD Single : A 404 ASN : amide:sc= -0.0287 K(o=-0.029,f=-0.99) USER MOD Single : A 406 GLN : amide:sc= -0.0732 X(o=-0.073,f=-0.19) USER MOD Single : A 407 SER OG : rot -88:sc= 0.539 USER MOD Single : A 410 ASN : amide:sc= -0.418 X(o=-0.42,f=0) USER MOD Single : A 413 HIS : no HE2:sc= 1.06 K(o=1.1,f=-4.8!) USER MOD Single : A 415 SER OG : rot 138:sc= 1.19 USER MOD Single : A 419 THR OG1 : rot 180:sc= 0 USER MOD Single : A 430 SER OG : rot 180:sc= -0.0253 USER MOD Single : A 435 GLN :FLIP amide:sc= -0.481 F(o=-2.3,f=-0.48) USER MOD Single : A 436 LYS NZ :NH3+ 163:sc= -0.068 (180deg=-0.352) USER MOD Single : A 439 TYR OH : rot -139:sc= 2.09 USER MOD Single : A 442 LYS NZ :NH3+ 167:sc= 1.15 (180deg=0.884) USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 445 SER OG : rot 180:sc= 0 USER MOD Single : A 450 SER OG : rot 67:sc= 0.457 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 357 0.546 4.956 -2.364 1.00 25.23 N ATOM 2 CA TYR A 357 1.871 4.566 -2.842 1.00 23.04 C ATOM 3 C TYR A 357 2.786 4.338 -1.665 1.00 14.01 C ATOM 4 O TYR A 357 3.132 5.283 -0.955 1.00 21.13 O ATOM 5 CB TYR A 357 2.482 5.665 -3.728 1.00 51.41 C ATOM 6 CG TYR A 357 1.785 5.918 -5.050 1.00 23.53 C ATOM 7 CD1 TYR A 357 0.625 6.673 -5.123 1.00 74.40 C ATOM 8 CD2 TYR A 357 2.317 5.423 -6.232 1.00 73.21 C ATOM 9 CE1 TYR A 357 0.014 6.925 -6.334 1.00 32.01 C ATOM 10 CE2 TYR A 357 1.711 5.667 -7.445 1.00 23.24 C ATOM 11 CZ TYR A 357 0.561 6.418 -7.491 1.00 41.20 C ATOM 12 OH TYR A 357 -0.038 6.673 -8.700 1.00 23.43 O ATOM 0 HA TYR A 357 1.764 3.652 -3.427 1.00 23.04 H new ATOM 0 HB2 TYR A 357 2.493 6.596 -3.162 1.00 51.41 H new ATOM 0 HB3 TYR A 357 3.520 5.404 -3.932 1.00 51.41 H new ATOM 0 HD1 TYR A 357 0.192 7.071 -4.217 1.00 74.40 H new ATOM 0 HD2 TYR A 357 3.223 4.836 -6.201 1.00 73.21 H new ATOM 0 HE1 TYR A 357 -0.889 7.517 -6.374 1.00 32.01 H new ATOM 0 HE2 TYR A 357 2.137 5.270 -8.355 1.00 23.24 H new ATOM 0 HH TYR A 357 0.475 6.244 -9.416 1.00 23.43 H new ATOM 24 N ARG A 358 3.175 3.111 -1.428 1.00 51.22 N ATOM 25 CA ARG A 358 4.087 2.856 -0.346 1.00 14.23 C ATOM 26 C ARG A 358 5.519 2.977 -0.789 1.00 11.20 C ATOM 27 O ARG A 358 6.168 2.005 -1.181 1.00 42.01 O ATOM 28 CB ARG A 358 3.815 1.555 0.408 1.00 52.50 C ATOM 29 CG ARG A 358 2.482 1.550 1.129 1.00 61.33 C ATOM 30 CD ARG A 358 2.318 0.322 1.995 1.00 21.35 C ATOM 31 NE ARG A 358 1.042 0.339 2.723 1.00 50.10 N ATOM 32 CZ ARG A 358 0.822 -0.271 3.898 1.00 55.55 C ATOM 33 NH1 ARG A 358 1.806 -0.936 4.504 1.00 13.12 N ATOM 34 NH2 ARG A 358 -0.381 -0.210 4.465 1.00 42.44 N ATOM 0 H ARG A 358 2.882 2.290 -1.957 1.00 51.22 H new ATOM 0 HA ARG A 358 3.902 3.641 0.387 1.00 14.23 H new ATOM 0 HB2 ARG A 358 3.844 0.722 -0.295 1.00 52.50 H new ATOM 0 HB3 ARG A 358 4.613 1.389 1.132 1.00 52.50 H new ATOM 0 HG2 ARG A 358 2.399 2.444 1.747 1.00 61.33 H new ATOM 0 HG3 ARG A 358 1.674 1.591 0.399 1.00 61.33 H new ATOM 0 HD2 ARG A 358 2.371 -0.572 1.373 1.00 21.35 H new ATOM 0 HD3 ARG A 358 3.142 0.265 2.706 1.00 21.35 H new ATOM 0 HE ARG A 358 0.266 0.852 2.305 1.00 50.10 H new ATOM 0 HH11 ARG A 358 2.730 -0.982 4.075 1.00 13.12 H new ATOM 0 HH12 ARG A 358 1.635 -1.398 5.397 1.00 13.12 H new ATOM 0 HH21 ARG A 358 -1.136 0.300 4.006 1.00 42.44 H new ATOM 0 HH22 ARG A 358 -0.548 -0.674 5.358 1.00 42.44 H new ATOM 48 N ALA A 359 5.965 4.194 -0.800 1.00 53.33 N ATOM 49 CA ALA A 359 7.305 4.556 -1.137 1.00 44.24 C ATOM 50 C ALA A 359 7.656 5.736 -0.281 1.00 31.14 C ATOM 51 O ALA A 359 6.805 6.602 -0.047 1.00 33.02 O ATOM 52 CB ALA A 359 7.411 4.911 -2.616 1.00 23.31 C ATOM 0 H ALA A 359 5.380 4.996 -0.564 1.00 53.33 H new ATOM 0 HA ALA A 359 7.991 3.728 -0.961 1.00 44.24 H new ATOM 0 HB1 ALA A 359 8.440 5.184 -2.852 1.00 23.31 H new ATOM 0 HB2 ALA A 359 7.116 4.052 -3.218 1.00 23.31 H new ATOM 0 HB3 ALA A 359 6.753 5.752 -2.836 1.00 23.31 H new ATOM 58 N ILE A 360 8.855 5.779 0.203 1.00 62.45 N ATOM 59 CA ILE A 360 9.248 6.826 1.100 1.00 34.43 C ATOM 60 C ILE A 360 9.654 8.065 0.315 1.00 11.20 C ATOM 61 O ILE A 360 10.513 8.006 -0.568 1.00 3.41 O ATOM 62 CB ILE A 360 10.404 6.402 2.102 1.00 71.21 C ATOM 63 CG1 ILE A 360 9.989 5.231 3.039 1.00 42.41 C ATOM 64 CG2 ILE A 360 10.857 7.588 2.948 1.00 60.13 C ATOM 65 CD1 ILE A 360 9.804 3.881 2.368 1.00 55.11 C ATOM 0 H ILE A 360 9.586 5.099 -0.007 1.00 62.45 H new ATOM 0 HA ILE A 360 8.377 7.047 1.717 1.00 34.43 H new ATOM 0 HB ILE A 360 11.230 6.057 1.480 1.00 71.21 H new ATOM 0 HG12 ILE A 360 10.745 5.128 3.817 1.00 42.41 H new ATOM 0 HG13 ILE A 360 9.056 5.500 3.534 1.00 42.41 H new ATOM 0 HG21 ILE A 360 11.649 7.270 3.626 1.00 60.13 H new ATOM 0 HG22 ILE A 360 11.232 8.378 2.297 1.00 60.13 H new ATOM 0 HG23 ILE A 360 10.014 7.965 3.527 1.00 60.13 H new ATOM 0 HD11 ILE A 360 9.516 3.140 3.114 1.00 55.11 H new ATOM 0 HD12 ILE A 360 9.024 3.955 1.610 1.00 55.11 H new ATOM 0 HD13 ILE A 360 10.739 3.577 1.898 1.00 55.11 H new ATOM 77 N LYS A 361 9.015 9.162 0.609 1.00 73.41 N ATOM 78 CA LYS A 361 9.338 10.416 -0.017 1.00 12.32 C ATOM 79 C LYS A 361 10.186 11.231 0.929 1.00 25.11 C ATOM 80 O LYS A 361 9.782 11.496 2.061 1.00 1.42 O ATOM 81 CB LYS A 361 8.072 11.172 -0.417 1.00 71.14 C ATOM 82 CG LYS A 361 7.245 10.463 -1.479 1.00 3.32 C ATOM 83 CD LYS A 361 5.983 11.240 -1.811 1.00 44.11 C ATOM 84 CE LYS A 361 5.189 10.571 -2.924 1.00 62.33 C ATOM 85 NZ LYS A 361 5.924 10.557 -4.213 1.00 5.13 N ATOM 0 H LYS A 361 8.256 9.214 1.288 1.00 73.41 H new ATOM 0 HA LYS A 361 9.900 10.230 -0.932 1.00 12.32 H new ATOM 0 HB2 LYS A 361 7.456 11.324 0.469 1.00 71.14 H new ATOM 0 HB3 LYS A 361 8.350 12.159 -0.785 1.00 71.14 H new ATOM 0 HG2 LYS A 361 7.843 10.334 -2.381 1.00 3.32 H new ATOM 0 HG3 LYS A 361 6.978 9.466 -1.129 1.00 3.32 H new ATOM 0 HD2 LYS A 361 5.361 11.323 -0.920 1.00 44.11 H new ATOM 0 HD3 LYS A 361 6.248 12.254 -2.111 1.00 44.11 H new ATOM 0 HE2 LYS A 361 4.952 9.548 -2.633 1.00 62.33 H new ATOM 0 HE3 LYS A 361 4.241 11.093 -3.055 1.00 62.33 H new ATOM 0 HZ1 LYS A 361 5.295 10.216 -4.968 1.00 5.13 H new ATOM 0 HZ2 LYS A 361 6.247 11.519 -4.439 1.00 5.13 H new ATOM 0 HZ3 LYS A 361 6.747 9.925 -4.137 1.00 5.13 H new ATOM 99 N GLY A 362 11.362 11.597 0.487 1.00 11.03 N ATOM 100 CA GLY A 362 12.280 12.306 1.333 1.00 41.24 C ATOM 101 C GLY A 362 12.469 13.734 0.922 1.00 53.22 C ATOM 102 O GLY A 362 13.608 14.188 0.774 1.00 31.24 O ATOM 0 H GLY A 362 11.704 11.414 -0.456 1.00 11.03 H new ATOM 0 HA2 GLY A 362 11.918 12.274 2.361 1.00 41.24 H new ATOM 0 HA3 GLY A 362 13.245 11.799 1.319 1.00 41.24 H new ATOM 106 N MET A 363 11.350 14.433 0.743 1.00 75.01 N ATOM 107 CA MET A 363 11.313 15.838 0.328 1.00 33.32 C ATOM 108 C MET A 363 11.731 15.975 -1.120 1.00 42.22 C ATOM 109 O MET A 363 12.921 15.929 -1.431 1.00 64.13 O ATOM 110 CB MET A 363 12.173 16.789 1.225 1.00 71.33 C ATOM 111 CG MET A 363 11.683 17.129 2.668 1.00 42.42 C ATOM 112 SD MET A 363 11.498 15.733 3.840 1.00 44.14 S ATOM 113 CE MET A 363 9.882 15.083 3.409 1.00 53.25 C ATOM 0 H MET A 363 10.423 14.032 0.885 1.00 75.01 H new ATOM 0 HA MET A 363 10.277 16.155 0.450 1.00 33.32 H new ATOM 0 HB2 MET A 363 13.166 16.348 1.312 1.00 71.33 H new ATOM 0 HB3 MET A 363 12.288 17.730 0.688 1.00 71.33 H new ATOM 0 HG2 MET A 363 12.382 17.844 3.102 1.00 42.42 H new ATOM 0 HG3 MET A 363 10.720 17.633 2.588 1.00 42.42 H new ATOM 0 HE1 MET A 363 9.224 15.138 4.277 1.00 53.25 H new ATOM 0 HE2 MET A 363 9.459 15.671 2.595 1.00 53.25 H new ATOM 0 HE3 MET A 363 9.980 14.044 3.093 1.00 53.25 H new ATOM 123 N GLU A 364 10.757 16.116 -2.018 1.00 5.03 N ATOM 124 CA GLU A 364 11.064 16.270 -3.425 1.00 24.45 C ATOM 125 C GLU A 364 11.767 17.597 -3.681 1.00 65.13 C ATOM 126 O GLU A 364 11.137 18.660 -3.793 1.00 13.21 O ATOM 127 CB GLU A 364 9.826 16.073 -4.354 1.00 15.40 C ATOM 128 CG GLU A 364 8.626 16.974 -4.059 1.00 3.22 C ATOM 129 CD GLU A 364 7.522 16.842 -5.089 1.00 52.31 C ATOM 130 OE1 GLU A 364 6.680 15.922 -4.979 1.00 54.01 O ATOM 131 OE2 GLU A 364 7.466 17.676 -6.035 1.00 60.13 O ATOM 0 H GLU A 364 9.762 16.126 -1.793 1.00 5.03 H new ATOM 0 HA GLU A 364 11.750 15.465 -3.687 1.00 24.45 H new ATOM 0 HB2 GLU A 364 10.138 16.240 -5.385 1.00 15.40 H new ATOM 0 HB3 GLU A 364 9.503 15.034 -4.283 1.00 15.40 H new ATOM 0 HG2 GLU A 364 8.228 16.730 -3.074 1.00 3.22 H new ATOM 0 HG3 GLU A 364 8.958 18.012 -4.020 1.00 3.22 H new ATOM 138 N THR A 365 13.063 17.541 -3.713 1.00 44.12 N ATOM 139 CA THR A 365 13.855 18.694 -3.934 1.00 4.23 C ATOM 140 C THR A 365 13.976 18.883 -5.429 1.00 65.43 C ATOM 141 O THR A 365 14.330 17.948 -6.147 1.00 2.22 O ATOM 142 CB THR A 365 15.253 18.509 -3.341 1.00 65.22 C ATOM 143 OG1 THR A 365 15.134 17.946 -2.022 1.00 63.44 O ATOM 144 CG2 THR A 365 15.939 19.862 -3.228 1.00 33.45 C ATOM 0 H THR A 365 13.598 16.682 -3.584 1.00 44.12 H new ATOM 0 HA THR A 365 13.391 19.558 -3.459 1.00 4.23 H new ATOM 0 HB THR A 365 15.835 17.849 -3.984 1.00 65.22 H new ATOM 0 HG1 THR A 365 14.892 18.651 -1.386 1.00 63.44 H new ATOM 0 HG21 THR A 365 16.935 19.731 -2.805 1.00 33.45 H new ATOM 0 HG22 THR A 365 16.021 20.312 -4.217 1.00 33.45 H new ATOM 0 HG23 THR A 365 15.353 20.514 -2.580 1.00 33.45 H new ATOM 152 N LYS A 366 13.666 20.050 -5.900 1.00 34.51 N ATOM 153 CA LYS A 366 13.682 20.312 -7.307 1.00 73.10 C ATOM 154 C LYS A 366 14.550 21.476 -7.607 1.00 35.45 C ATOM 155 O LYS A 366 14.529 22.480 -6.888 1.00 11.33 O ATOM 156 CB LYS A 366 12.259 20.501 -7.811 1.00 70.31 C ATOM 157 CG LYS A 366 11.479 19.208 -7.730 1.00 34.10 C ATOM 158 CD LYS A 366 9.990 19.367 -7.976 1.00 75.12 C ATOM 159 CE LYS A 366 9.335 20.229 -6.905 1.00 62.15 C ATOM 160 NZ LYS A 366 7.865 20.223 -7.021 1.00 31.43 N ATOM 0 H LYS A 366 13.395 20.847 -5.323 1.00 34.51 H new ATOM 0 HA LYS A 366 14.106 19.458 -7.835 1.00 73.10 H new ATOM 0 HB2 LYS A 366 11.759 21.269 -7.220 1.00 70.31 H new ATOM 0 HB3 LYS A 366 12.278 20.854 -8.842 1.00 70.31 H new ATOM 0 HG2 LYS A 366 11.884 18.506 -8.459 1.00 34.10 H new ATOM 0 HG3 LYS A 366 11.629 18.767 -6.745 1.00 34.10 H new ATOM 0 HD2 LYS A 366 9.828 19.817 -8.956 1.00 75.12 H new ATOM 0 HD3 LYS A 366 9.517 18.385 -7.994 1.00 75.12 H new ATOM 0 HE2 LYS A 366 9.623 19.865 -5.919 1.00 62.15 H new ATOM 0 HE3 LYS A 366 9.702 21.252 -6.987 1.00 62.15 H new ATOM 0 HZ1 LYS A 366 7.465 20.958 -6.403 1.00 31.43 H new ATOM 0 HZ2 LYS A 366 7.594 20.414 -8.007 1.00 31.43 H new ATOM 0 HZ3 LYS A 366 7.498 19.293 -6.735 1.00 31.43 H new ATOM 174 N ARG A 367 15.351 21.339 -8.625 1.00 13.32 N ATOM 175 CA ARG A 367 16.252 22.379 -8.990 1.00 73.04 C ATOM 176 C ARG A 367 16.570 22.236 -10.454 1.00 71.15 C ATOM 177 O ARG A 367 16.808 21.137 -10.931 1.00 64.34 O ATOM 178 CB ARG A 367 17.532 22.238 -8.191 1.00 3.33 C ATOM 179 CG ARG A 367 18.322 23.504 -8.018 1.00 0.03 C ATOM 180 CD ARG A 367 17.594 24.402 -7.056 1.00 24.32 C ATOM 181 NE ARG A 367 18.302 25.640 -6.773 1.00 55.31 N ATOM 182 CZ ARG A 367 17.955 26.479 -5.800 1.00 3.25 C ATOM 183 NH1 ARG A 367 16.900 26.206 -5.028 1.00 52.15 N ATOM 184 NH2 ARG A 367 18.654 27.581 -5.592 1.00 3.22 N ATOM 0 H ARG A 367 15.394 20.509 -9.216 1.00 13.32 H new ATOM 0 HA ARG A 367 15.804 23.352 -8.790 1.00 73.04 H new ATOM 0 HB2 ARG A 367 17.284 21.846 -7.205 1.00 3.33 H new ATOM 0 HB3 ARG A 367 18.166 21.497 -8.678 1.00 3.33 H new ATOM 0 HG2 ARG A 367 19.320 23.278 -7.642 1.00 0.03 H new ATOM 0 HG3 ARG A 367 18.449 24.004 -8.978 1.00 0.03 H new ATOM 0 HD2 ARG A 367 16.612 24.639 -7.464 1.00 24.32 H new ATOM 0 HD3 ARG A 367 17.430 23.864 -6.122 1.00 24.32 H new ATOM 0 HE ARG A 367 19.108 25.878 -7.351 1.00 55.31 H new ATOM 0 HH11 ARG A 367 16.360 25.355 -5.184 1.00 52.15 H new ATOM 0 HH12 ARG A 367 16.634 26.849 -4.282 1.00 52.15 H new ATOM 0 HH21 ARG A 367 19.462 27.791 -6.178 1.00 3.22 H new ATOM 0 HH22 ARG A 367 18.385 28.222 -4.845 1.00 3.22 H new ATOM 198 N GLU A 368 16.580 23.309 -11.154 1.00 51.10 N ATOM 199 CA GLU A 368 16.843 23.281 -12.537 1.00 34.22 C ATOM 200 C GLU A 368 18.313 23.527 -12.815 1.00 3.00 C ATOM 201 O GLU A 368 18.830 24.616 -12.551 1.00 15.13 O ATOM 202 CB GLU A 368 16.015 24.325 -13.224 1.00 3.31 C ATOM 203 CG GLU A 368 14.519 24.166 -13.049 1.00 54.24 C ATOM 204 CD GLU A 368 13.758 25.211 -13.812 1.00 3.14 C ATOM 205 OE1 GLU A 368 13.760 26.383 -13.392 1.00 20.01 O ATOM 206 OE2 GLU A 368 13.187 24.889 -14.876 1.00 53.55 O ATOM 0 H GLU A 368 16.404 24.240 -10.776 1.00 51.10 H new ATOM 0 HA GLU A 368 16.584 22.294 -12.920 1.00 34.22 H new ATOM 0 HB2 GLU A 368 16.308 25.306 -12.849 1.00 3.31 H new ATOM 0 HB3 GLU A 368 16.246 24.309 -14.289 1.00 3.31 H new ATOM 0 HG2 GLU A 368 14.216 23.175 -13.387 1.00 54.24 H new ATOM 0 HG3 GLU A 368 14.267 24.232 -11.991 1.00 54.24 H new ATOM 213 N ILE A 369 18.992 22.515 -13.300 1.00 62.53 N ATOM 214 CA ILE A 369 20.382 22.648 -13.694 1.00 25.24 C ATOM 215 C ILE A 369 20.487 22.389 -15.200 1.00 52.41 C ATOM 216 O ILE A 369 19.935 21.420 -15.696 1.00 42.23 O ATOM 217 CB ILE A 369 21.371 21.671 -12.917 1.00 11.13 C ATOM 218 CG1 ILE A 369 21.403 21.917 -11.382 1.00 30.41 C ATOM 219 CG2 ILE A 369 22.788 21.743 -13.480 1.00 51.21 C ATOM 220 CD1 ILE A 369 20.168 21.478 -10.628 1.00 24.42 C ATOM 0 H ILE A 369 18.604 21.581 -13.434 1.00 62.53 H new ATOM 0 HA ILE A 369 20.693 23.660 -13.435 1.00 25.24 H new ATOM 0 HB ILE A 369 20.970 20.670 -13.077 1.00 11.13 H new ATOM 0 HG12 ILE A 369 22.266 21.397 -10.966 1.00 30.41 H new ATOM 0 HG13 ILE A 369 21.557 22.982 -11.205 1.00 30.41 H new ATOM 0 HG21 ILE A 369 23.435 21.063 -12.925 1.00 51.21 H new ATOM 0 HG22 ILE A 369 22.777 21.456 -14.532 1.00 51.21 H new ATOM 0 HG23 ILE A 369 23.166 22.761 -13.386 1.00 51.21 H new ATOM 0 HD11 ILE A 369 20.293 21.694 -9.567 1.00 24.42 H new ATOM 0 HD12 ILE A 369 19.299 22.016 -11.008 1.00 24.42 H new ATOM 0 HD13 ILE A 369 20.020 20.407 -10.765 1.00 24.42 H new ATOM 232 N GLY A 370 21.164 23.275 -15.912 1.00 31.25 N ATOM 233 CA GLY A 370 21.377 23.125 -17.352 1.00 42.10 C ATOM 234 C GLY A 370 20.096 23.120 -18.180 1.00 73.24 C ATOM 235 O GLY A 370 20.058 22.544 -19.273 1.00 34.33 O ATOM 0 H GLY A 370 21.582 24.117 -15.515 1.00 31.25 H new ATOM 0 HA2 GLY A 370 22.017 23.936 -17.699 1.00 42.10 H new ATOM 0 HA3 GLY A 370 21.916 22.195 -17.533 1.00 42.10 H new ATOM 239 N GLY A 371 19.056 23.746 -17.664 1.00 1.33 N ATOM 240 CA GLY A 371 17.795 23.825 -18.380 1.00 21.00 C ATOM 241 C GLY A 371 16.825 22.712 -18.017 1.00 20.21 C ATOM 242 O GLY A 371 15.620 22.808 -18.293 1.00 50.40 O ATOM 0 H GLY A 371 19.058 24.207 -16.754 1.00 1.33 H new ATOM 0 HA2 GLY A 371 17.327 24.787 -18.172 1.00 21.00 H new ATOM 0 HA3 GLY A 371 17.991 23.791 -19.452 1.00 21.00 H new ATOM 246 N TYR A 372 17.328 21.677 -17.386 1.00 30.25 N ATOM 247 CA TYR A 372 16.507 20.556 -16.986 1.00 23.51 C ATOM 248 C TYR A 372 16.279 20.514 -15.491 1.00 25.21 C ATOM 249 O TYR A 372 17.149 20.879 -14.705 1.00 4.32 O ATOM 250 CB TYR A 372 16.986 19.209 -17.584 1.00 33.04 C ATOM 251 CG TYR A 372 18.484 19.055 -17.747 1.00 43.33 C ATOM 252 CD1 TYR A 372 19.275 18.604 -16.726 1.00 51.54 C ATOM 253 CD2 TYR A 372 19.098 19.362 -18.957 1.00 24.10 C ATOM 254 CE1 TYR A 372 20.639 18.464 -16.890 1.00 3.14 C ATOM 255 CE2 TYR A 372 20.459 19.220 -19.126 1.00 22.12 C ATOM 256 CZ TYR A 372 21.222 18.770 -18.088 1.00 20.12 C ATOM 257 OH TYR A 372 22.589 18.616 -18.243 1.00 4.45 O ATOM 0 H TYR A 372 18.313 21.587 -17.136 1.00 30.25 H new ATOM 0 HA TYR A 372 15.524 20.721 -17.427 1.00 23.51 H new ATOM 0 HB2 TYR A 372 16.624 18.402 -16.948 1.00 33.04 H new ATOM 0 HB3 TYR A 372 16.518 19.080 -18.560 1.00 33.04 H new ATOM 0 HD1 TYR A 372 18.826 18.353 -15.776 1.00 51.54 H new ATOM 0 HD2 TYR A 372 18.497 19.719 -19.780 1.00 24.10 H new ATOM 0 HE1 TYR A 372 21.247 18.112 -16.070 1.00 3.14 H new ATOM 0 HE2 TYR A 372 20.918 19.463 -20.073 1.00 22.12 H new ATOM 0 HH TYR A 372 22.846 18.875 -19.153 1.00 4.45 H new ATOM 267 N THR A 373 15.116 20.066 -15.107 1.00 63.11 N ATOM 268 CA THR A 373 14.710 20.102 -13.731 1.00 51.30 C ATOM 269 C THR A 373 15.050 18.809 -13.040 1.00 30.15 C ATOM 270 O THR A 373 14.527 17.754 -13.389 1.00 22.43 O ATOM 271 CB THR A 373 13.192 20.375 -13.611 1.00 1.30 C ATOM 272 OG1 THR A 373 12.879 21.582 -14.324 1.00 72.24 O ATOM 273 CG2 THR A 373 12.778 20.540 -12.146 1.00 74.35 C ATOM 0 H THR A 373 14.423 19.666 -15.740 1.00 63.11 H new ATOM 0 HA THR A 373 15.252 20.914 -13.247 1.00 51.30 H new ATOM 0 HB THR A 373 12.651 19.528 -14.031 1.00 1.30 H new ATOM 0 HG1 THR A 373 11.918 21.763 -14.255 1.00 72.24 H new ATOM 0 HG21 THR A 373 11.706 20.731 -12.090 1.00 74.35 H new ATOM 0 HG22 THR A 373 13.013 19.629 -11.597 1.00 74.35 H new ATOM 0 HG23 THR A 373 13.319 21.378 -11.707 1.00 74.35 H new ATOM 281 N TYR A 374 15.916 18.897 -12.089 1.00 4.34 N ATOM 282 CA TYR A 374 16.296 17.782 -11.300 1.00 24.15 C ATOM 283 C TYR A 374 15.349 17.623 -10.149 1.00 31.21 C ATOM 284 O TYR A 374 15.071 18.584 -9.434 1.00 33.42 O ATOM 285 CB TYR A 374 17.727 17.936 -10.792 1.00 13.12 C ATOM 286 CG TYR A 374 18.791 17.656 -11.816 1.00 64.43 C ATOM 287 CD1 TYR A 374 19.263 18.638 -12.663 1.00 25.14 C ATOM 288 CD2 TYR A 374 19.342 16.390 -11.914 1.00 32.44 C ATOM 289 CE1 TYR A 374 20.255 18.361 -13.578 1.00 41.23 C ATOM 290 CE2 TYR A 374 20.328 16.110 -12.827 1.00 61.34 C ATOM 291 CZ TYR A 374 20.781 17.091 -13.651 1.00 32.23 C ATOM 292 OH TYR A 374 21.772 16.802 -14.557 1.00 22.55 O ATOM 0 H TYR A 374 16.388 19.765 -11.835 1.00 4.34 H new ATOM 0 HA TYR A 374 16.253 16.888 -11.923 1.00 24.15 H new ATOM 0 HB2 TYR A 374 17.859 18.952 -10.420 1.00 13.12 H new ATOM 0 HB3 TYR A 374 17.872 17.265 -9.945 1.00 13.12 H new ATOM 0 HD1 TYR A 374 18.850 19.634 -12.608 1.00 25.14 H new ATOM 0 HD2 TYR A 374 18.989 15.607 -11.259 1.00 32.44 H new ATOM 0 HE1 TYR A 374 20.618 19.137 -14.235 1.00 41.23 H new ATOM 0 HE2 TYR A 374 20.742 15.114 -12.890 1.00 61.34 H new ATOM 0 HH TYR A 374 21.401 16.262 -15.286 1.00 22.55 H new ATOM 302 N LYS A 375 14.834 16.434 -9.993 1.00 32.30 N ATOM 303 CA LYS A 375 13.942 16.132 -8.904 1.00 2.41 C ATOM 304 C LYS A 375 14.583 15.066 -8.065 1.00 54.35 C ATOM 305 O LYS A 375 14.888 13.998 -8.572 1.00 22.45 O ATOM 306 CB LYS A 375 12.620 15.560 -9.442 1.00 74.44 C ATOM 307 CG LYS A 375 11.596 15.242 -8.349 1.00 11.04 C ATOM 308 CD LYS A 375 10.406 14.424 -8.865 1.00 74.12 C ATOM 309 CE LYS A 375 9.720 15.079 -10.044 1.00 52.21 C ATOM 310 NZ LYS A 375 8.494 14.357 -10.446 1.00 40.52 N ATOM 0 H LYS A 375 15.020 15.647 -10.615 1.00 32.30 H new ATOM 0 HA LYS A 375 13.747 17.041 -8.334 1.00 2.41 H new ATOM 0 HB2 LYS A 375 12.183 16.274 -10.140 1.00 74.44 H new ATOM 0 HB3 LYS A 375 12.830 14.651 -10.006 1.00 74.44 H new ATOM 0 HG2 LYS A 375 12.088 14.692 -7.547 1.00 11.04 H new ATOM 0 HG3 LYS A 375 11.230 16.174 -7.919 1.00 11.04 H new ATOM 0 HD2 LYS A 375 10.750 13.431 -9.155 1.00 74.12 H new ATOM 0 HD3 LYS A 375 9.685 14.289 -8.059 1.00 74.12 H new ATOM 0 HE2 LYS A 375 9.467 16.108 -9.790 1.00 52.21 H new ATOM 0 HE3 LYS A 375 10.409 15.119 -10.887 1.00 52.21 H new ATOM 0 HZ1 LYS A 375 8.057 14.840 -11.257 1.00 40.52 H new ATOM 0 HZ2 LYS A 375 8.737 13.382 -10.714 1.00 40.52 H new ATOM 0 HZ3 LYS A 375 7.824 14.340 -9.650 1.00 40.52 H new ATOM 324 N VAL A 376 14.756 15.328 -6.810 1.00 51.14 N ATOM 325 CA VAL A 376 15.312 14.357 -5.913 1.00 54.45 C ATOM 326 C VAL A 376 14.290 14.026 -4.860 1.00 22.30 C ATOM 327 O VAL A 376 13.961 14.861 -4.035 1.00 45.11 O ATOM 328 CB VAL A 376 16.616 14.864 -5.230 1.00 33.30 C ATOM 329 CG1 VAL A 376 17.189 13.804 -4.290 1.00 72.40 C ATOM 330 CG2 VAL A 376 17.655 15.260 -6.266 1.00 24.21 C ATOM 0 H VAL A 376 14.517 16.219 -6.374 1.00 51.14 H new ATOM 0 HA VAL A 376 15.572 13.472 -6.493 1.00 54.45 H new ATOM 0 HB VAL A 376 16.359 15.746 -4.643 1.00 33.30 H new ATOM 0 HG11 VAL A 376 18.099 14.183 -3.826 1.00 72.40 H new ATOM 0 HG12 VAL A 376 16.458 13.570 -3.516 1.00 72.40 H new ATOM 0 HG13 VAL A 376 17.419 12.902 -4.856 1.00 72.40 H new ATOM 0 HG21 VAL A 376 18.556 15.610 -5.762 1.00 24.21 H new ATOM 0 HG22 VAL A 376 17.898 14.397 -6.886 1.00 24.21 H new ATOM 0 HG23 VAL A 376 17.257 16.057 -6.894 1.00 24.21 H new ATOM 340 N VAL A 377 13.750 12.821 -4.915 1.00 30.35 N ATOM 341 CA VAL A 377 12.795 12.392 -3.906 1.00 54.02 C ATOM 342 C VAL A 377 13.553 11.657 -2.791 1.00 40.42 C ATOM 343 O VAL A 377 12.986 11.233 -1.774 1.00 55.25 O ATOM 344 CB VAL A 377 11.719 11.473 -4.500 1.00 23.34 C ATOM 345 CG1 VAL A 377 10.616 11.221 -3.476 1.00 14.32 C ATOM 346 CG2 VAL A 377 11.141 12.064 -5.777 1.00 11.01 C ATOM 0 H VAL A 377 13.952 12.130 -5.637 1.00 30.35 H new ATOM 0 HA VAL A 377 12.290 13.272 -3.507 1.00 54.02 H new ATOM 0 HB VAL A 377 12.184 10.520 -4.753 1.00 23.34 H new ATOM 0 HG11 VAL A 377 9.859 10.568 -3.910 1.00 14.32 H new ATOM 0 HG12 VAL A 377 11.042 10.746 -2.592 1.00 14.32 H new ATOM 0 HG13 VAL A 377 10.158 12.169 -3.194 1.00 14.32 H new ATOM 0 HG21 VAL A 377 10.381 11.393 -6.177 1.00 11.01 H new ATOM 0 HG22 VAL A 377 10.691 13.033 -5.559 1.00 11.01 H new ATOM 0 HG23 VAL A 377 11.936 12.191 -6.512 1.00 11.01 H new ATOM 356 N PHE A 378 14.842 11.500 -3.029 1.00 54.20 N ATOM 357 CA PHE A 378 15.813 10.907 -2.108 1.00 63.24 C ATOM 358 C PHE A 378 15.634 9.372 -1.985 1.00 52.42 C ATOM 359 O PHE A 378 16.548 8.621 -2.266 1.00 15.22 O ATOM 360 CB PHE A 378 15.777 11.612 -0.728 1.00 0.24 C ATOM 361 CG PHE A 378 17.025 11.439 0.093 1.00 53.22 C ATOM 362 CD1 PHE A 378 18.184 12.109 -0.262 1.00 12.33 C ATOM 363 CD2 PHE A 378 17.042 10.643 1.216 1.00 55.52 C ATOM 364 CE1 PHE A 378 19.330 11.983 0.487 1.00 74.12 C ATOM 365 CE2 PHE A 378 18.187 10.508 1.971 1.00 45.24 C ATOM 366 CZ PHE A 378 19.334 11.180 1.605 1.00 54.21 C ATOM 0 H PHE A 378 15.267 11.794 -3.908 1.00 54.20 H new ATOM 0 HA PHE A 378 16.805 11.068 -2.529 1.00 63.24 H new ATOM 0 HB2 PHE A 378 15.604 12.677 -0.883 1.00 0.24 H new ATOM 0 HB3 PHE A 378 14.928 11.230 -0.161 1.00 0.24 H new ATOM 0 HD1 PHE A 378 18.188 12.739 -1.139 1.00 12.33 H new ATOM 0 HD2 PHE A 378 16.146 10.117 1.509 1.00 55.52 H new ATOM 0 HE1 PHE A 378 20.226 12.513 0.199 1.00 74.12 H new ATOM 0 HE2 PHE A 378 18.186 9.877 2.848 1.00 45.24 H new ATOM 0 HZ PHE A 378 20.233 11.077 2.194 1.00 54.21 H new ATOM 376 N TYR A 379 14.462 8.922 -1.605 1.00 30.03 N ATOM 377 CA TYR A 379 14.230 7.494 -1.419 1.00 21.34 C ATOM 378 C TYR A 379 13.561 6.879 -2.621 1.00 72.01 C ATOM 379 O TYR A 379 13.562 5.665 -2.783 1.00 0.42 O ATOM 380 CB TYR A 379 13.395 7.230 -0.182 1.00 42.15 C ATOM 381 CG TYR A 379 14.015 7.728 1.088 1.00 14.44 C ATOM 382 CD1 TYR A 379 13.784 9.019 1.524 1.00 25.35 C ATOM 383 CD2 TYR A 379 14.831 6.911 1.849 1.00 22.31 C ATOM 384 CE1 TYR A 379 14.347 9.487 2.680 1.00 2.31 C ATOM 385 CE2 TYR A 379 15.403 7.371 3.012 1.00 31.44 C ATOM 386 CZ TYR A 379 15.157 8.658 3.423 1.00 30.34 C ATOM 387 OH TYR A 379 15.729 9.125 4.569 1.00 61.34 O ATOM 0 H TYR A 379 13.653 9.514 -1.417 1.00 30.03 H new ATOM 0 HA TYR A 379 15.208 7.030 -1.291 1.00 21.34 H new ATOM 0 HB2 TYR A 379 12.420 7.700 -0.307 1.00 42.15 H new ATOM 0 HB3 TYR A 379 13.223 6.157 -0.094 1.00 42.15 H new ATOM 0 HD1 TYR A 379 13.148 9.670 0.942 1.00 25.35 H new ATOM 0 HD2 TYR A 379 15.022 5.898 1.526 1.00 22.31 H new ATOM 0 HE1 TYR A 379 14.157 10.499 3.007 1.00 2.31 H new ATOM 0 HE2 TYR A 379 16.041 6.725 3.597 1.00 31.44 H new ATOM 0 HH TYR A 379 16.270 8.417 4.977 1.00 61.34 H new ATOM 397 N GLU A 380 12.957 7.698 -3.448 1.00 15.43 N ATOM 398 CA GLU A 380 12.357 7.188 -4.652 1.00 11.41 C ATOM 399 C GLU A 380 13.352 7.120 -5.786 1.00 12.21 C ATOM 400 O GLU A 380 13.768 6.032 -6.171 1.00 1.42 O ATOM 401 CB GLU A 380 11.082 7.932 -5.066 1.00 54.32 C ATOM 402 CG GLU A 380 9.885 7.665 -4.184 1.00 45.12 C ATOM 403 CD GLU A 380 8.608 8.238 -4.758 1.00 71.11 C ATOM 404 OE1 GLU A 380 7.937 7.536 -5.546 1.00 72.20 O ATOM 405 OE2 GLU A 380 8.256 9.390 -4.449 1.00 42.12 O ATOM 0 H GLU A 380 12.869 8.705 -3.311 1.00 15.43 H new ATOM 0 HA GLU A 380 12.044 6.171 -4.416 1.00 11.41 H new ATOM 0 HB2 GLU A 380 11.285 9.003 -5.066 1.00 54.32 H new ATOM 0 HB3 GLU A 380 10.832 7.655 -6.090 1.00 54.32 H new ATOM 0 HG2 GLU A 380 9.769 6.590 -4.049 1.00 45.12 H new ATOM 0 HG3 GLU A 380 10.061 8.093 -3.197 1.00 45.12 H new ATOM 412 N ASN A 381 13.731 8.279 -6.322 1.00 42.15 N ATOM 413 CA ASN A 381 14.664 8.362 -7.452 1.00 44.25 C ATOM 414 C ASN A 381 14.861 9.804 -7.875 1.00 74.12 C ATOM 415 O ASN A 381 14.274 10.715 -7.258 1.00 3.02 O ATOM 416 CB ASN A 381 14.204 7.461 -8.628 1.00 42.04 C ATOM 417 CG ASN A 381 12.815 7.751 -9.164 1.00 75.34 C ATOM 418 OD1 ASN A 381 11.976 8.372 -8.507 1.00 32.24 O ATOM 419 ND2 ASN A 381 12.517 7.183 -10.282 1.00 4.25 N ATOM 0 H ASN A 381 13.403 9.186 -5.989 1.00 42.15 H new ATOM 0 HA ASN A 381 15.633 7.982 -7.129 1.00 44.25 H new ATOM 0 HB2 ASN A 381 14.919 7.564 -9.444 1.00 42.04 H new ATOM 0 HB3 ASN A 381 14.240 6.421 -8.303 1.00 42.04 H new ATOM 0 HD21 ASN A 381 11.566 7.240 -10.646 1.00 4.25 H new ATOM 0 HD22 ASN A 381 13.232 6.676 -10.803 1.00 4.25 H new ATOM 426 N VAL A 382 15.708 10.029 -8.884 1.00 73.44 N ATOM 427 CA VAL A 382 16.018 11.380 -9.336 1.00 23.23 C ATOM 428 C VAL A 382 15.796 11.520 -10.842 1.00 13.22 C ATOM 429 O VAL A 382 16.175 10.637 -11.623 1.00 21.22 O ATOM 430 CB VAL A 382 17.481 11.778 -8.992 1.00 15.55 C ATOM 431 CG1 VAL A 382 17.771 13.214 -9.418 1.00 40.45 C ATOM 432 CG2 VAL A 382 17.748 11.604 -7.509 1.00 34.14 C ATOM 0 H VAL A 382 16.188 9.292 -9.400 1.00 73.44 H new ATOM 0 HA VAL A 382 15.341 12.052 -8.809 1.00 23.23 H new ATOM 0 HB VAL A 382 18.148 11.116 -9.545 1.00 15.55 H new ATOM 0 HG11 VAL A 382 18.801 13.467 -9.166 1.00 40.45 H new ATOM 0 HG12 VAL A 382 17.626 13.311 -10.494 1.00 40.45 H new ATOM 0 HG13 VAL A 382 17.093 13.892 -8.899 1.00 40.45 H new ATOM 0 HG21 VAL A 382 18.777 11.888 -7.289 1.00 34.14 H new ATOM 0 HG22 VAL A 382 17.067 12.237 -6.940 1.00 34.14 H new ATOM 0 HG23 VAL A 382 17.592 10.562 -7.231 1.00 34.14 H new ATOM 442 N PHE A 383 15.200 12.629 -11.237 1.00 70.24 N ATOM 443 CA PHE A 383 14.895 12.899 -12.635 1.00 31.33 C ATOM 444 C PHE A 383 15.530 14.207 -13.073 1.00 53.13 C ATOM 445 O PHE A 383 15.953 15.001 -12.243 1.00 72.13 O ATOM 446 CB PHE A 383 13.378 13.059 -12.838 1.00 22.14 C ATOM 447 CG PHE A 383 12.531 11.896 -12.423 1.00 13.33 C ATOM 448 CD1 PHE A 383 12.127 11.757 -11.107 1.00 10.11 C ATOM 449 CD2 PHE A 383 12.125 10.956 -13.347 1.00 23.34 C ATOM 450 CE1 PHE A 383 11.340 10.705 -10.720 1.00 11.50 C ATOM 451 CE2 PHE A 383 11.330 9.896 -12.968 1.00 23.14 C ATOM 452 CZ PHE A 383 10.937 9.769 -11.653 1.00 53.21 C ATOM 0 H PHE A 383 14.912 13.371 -10.599 1.00 70.24 H new ATOM 0 HA PHE A 383 15.280 12.060 -13.215 1.00 31.33 H new ATOM 0 HB2 PHE A 383 13.049 13.938 -12.284 1.00 22.14 H new ATOM 0 HB3 PHE A 383 13.192 13.259 -13.893 1.00 22.14 H new ATOM 0 HD1 PHE A 383 12.437 12.488 -10.375 1.00 10.11 H new ATOM 0 HD2 PHE A 383 12.433 11.052 -14.378 1.00 23.34 H new ATOM 0 HE1 PHE A 383 11.035 10.607 -9.688 1.00 11.50 H new ATOM 0 HE2 PHE A 383 11.016 9.166 -13.700 1.00 23.14 H new ATOM 0 HZ PHE A 383 10.315 8.939 -11.352 1.00 53.21 H new ATOM 462 N GLN A 384 15.589 14.395 -14.371 1.00 21.20 N ATOM 463 CA GLN A 384 15.953 15.638 -15.014 1.00 71.33 C ATOM 464 C GLN A 384 14.981 15.897 -16.150 1.00 55.34 C ATOM 465 O GLN A 384 15.017 15.216 -17.178 1.00 60.21 O ATOM 466 CB GLN A 384 17.396 15.653 -15.538 1.00 32.10 C ATOM 467 CG GLN A 384 17.780 14.421 -16.341 1.00 52.05 C ATOM 468 CD GLN A 384 19.135 14.501 -17.032 1.00 71.52 C ATOM 469 OE1 GLN A 384 20.077 15.206 -16.459 1.00 12.14 O flip ATOM 470 NE2 GLN A 384 19.324 13.903 -18.086 1.00 2.40 N flip ATOM 0 H GLN A 384 15.375 13.653 -15.038 1.00 21.20 H new ATOM 0 HA GLN A 384 15.898 16.427 -14.264 1.00 71.33 H new ATOM 0 HB2 GLN A 384 17.535 16.537 -16.161 1.00 32.10 H new ATOM 0 HB3 GLN A 384 18.077 15.748 -14.692 1.00 32.10 H new ATOM 0 HG2 GLN A 384 17.778 13.557 -15.676 1.00 52.05 H new ATOM 0 HG3 GLN A 384 17.014 14.244 -17.096 1.00 52.05 H new ATOM 0 HE21 GLN A 384 18.569 13.362 -18.508 1.00 2.40 H new ATOM 0 HE22 GLN A 384 20.236 13.947 -18.541 1.00 2.40 H new ATOM 479 N ASP A 385 14.081 16.834 -15.932 1.00 21.12 N ATOM 480 CA ASP A 385 13.059 17.235 -16.919 1.00 35.14 C ATOM 481 C ASP A 385 12.027 16.123 -17.097 1.00 42.32 C ATOM 482 O ASP A 385 11.000 16.107 -16.425 1.00 22.12 O ATOM 483 CB ASP A 385 13.704 17.639 -18.275 1.00 14.32 C ATOM 484 CG ASP A 385 12.724 18.154 -19.304 1.00 72.33 C ATOM 485 OD1 ASP A 385 12.496 19.383 -19.341 1.00 32.12 O ATOM 486 OD2 ASP A 385 12.194 17.350 -20.101 1.00 2.03 O ATOM 0 H ASP A 385 14.025 17.355 -15.057 1.00 21.12 H new ATOM 0 HA ASP A 385 12.545 18.117 -16.537 1.00 35.14 H new ATOM 0 HB2 ASP A 385 14.456 18.406 -18.091 1.00 14.32 H new ATOM 0 HB3 ASP A 385 14.225 16.775 -18.688 1.00 14.32 H new ATOM 491 N SER A 386 12.334 15.182 -17.950 1.00 3.54 N ATOM 492 CA SER A 386 11.487 14.040 -18.174 1.00 51.12 C ATOM 493 C SER A 386 12.365 12.789 -18.305 1.00 31.31 C ATOM 494 O SER A 386 11.887 11.697 -18.629 1.00 72.10 O ATOM 495 CB SER A 386 10.617 14.260 -19.435 1.00 71.34 C ATOM 496 OG SER A 386 9.721 13.175 -19.657 1.00 44.34 O ATOM 0 H SER A 386 13.185 15.186 -18.513 1.00 3.54 H new ATOM 0 HA SER A 386 10.809 13.904 -17.331 1.00 51.12 H new ATOM 0 HB2 SER A 386 10.049 15.184 -19.328 1.00 71.34 H new ATOM 0 HB3 SER A 386 11.262 14.382 -20.305 1.00 71.34 H new ATOM 0 HG SER A 386 10.145 12.338 -19.374 1.00 44.34 H new ATOM 502 N ILE A 387 13.646 12.962 -18.044 1.00 64.34 N ATOM 503 CA ILE A 387 14.604 11.888 -18.094 1.00 12.53 C ATOM 504 C ILE A 387 14.950 11.411 -16.706 1.00 11.53 C ATOM 505 O ILE A 387 15.359 12.184 -15.854 1.00 44.44 O ATOM 506 CB ILE A 387 15.901 12.289 -18.866 1.00 62.42 C ATOM 507 CG1 ILE A 387 15.625 12.424 -20.363 1.00 64.44 C ATOM 508 CG2 ILE A 387 17.048 11.312 -18.614 1.00 32.34 C ATOM 509 CD1 ILE A 387 15.170 11.139 -21.016 1.00 23.11 C ATOM 0 H ILE A 387 14.050 13.863 -17.789 1.00 64.34 H new ATOM 0 HA ILE A 387 14.134 11.071 -18.642 1.00 12.53 H new ATOM 0 HB ILE A 387 16.214 13.260 -18.481 1.00 62.42 H new ATOM 0 HG12 ILE A 387 14.863 13.188 -20.515 1.00 64.44 H new ATOM 0 HG13 ILE A 387 16.530 12.773 -20.860 1.00 64.44 H new ATOM 0 HG21 ILE A 387 17.928 11.632 -19.172 1.00 32.34 H new ATOM 0 HG22 ILE A 387 17.281 11.291 -17.549 1.00 32.34 H new ATOM 0 HG23 ILE A 387 16.755 10.314 -18.941 1.00 32.34 H new ATOM 0 HD11 ILE A 387 14.994 11.313 -22.078 1.00 23.11 H new ATOM 0 HD12 ILE A 387 15.940 10.377 -20.896 1.00 23.11 H new ATOM 0 HD13 ILE A 387 14.247 10.799 -20.546 1.00 23.11 H new ATOM 521 N LEU A 388 14.754 10.162 -16.485 1.00 21.20 N ATOM 522 CA LEU A 388 15.106 9.535 -15.255 1.00 74.22 C ATOM 523 C LEU A 388 16.604 9.234 -15.228 1.00 34.00 C ATOM 524 O LEU A 388 17.117 8.542 -16.116 1.00 74.13 O ATOM 525 CB LEU A 388 14.297 8.252 -15.123 1.00 25.33 C ATOM 526 CG LEU A 388 14.600 7.359 -13.938 1.00 53.24 C ATOM 527 CD1 LEU A 388 14.423 8.103 -12.636 1.00 72.34 C ATOM 528 CD2 LEU A 388 13.706 6.144 -13.985 1.00 52.33 C ATOM 0 H LEU A 388 14.335 9.530 -17.167 1.00 21.20 H new ATOM 0 HA LEU A 388 14.883 10.196 -14.418 1.00 74.22 H new ATOM 0 HB2 LEU A 388 13.242 8.521 -15.081 1.00 25.33 H new ATOM 0 HB3 LEU A 388 14.441 7.667 -16.032 1.00 25.33 H new ATOM 0 HG LEU A 388 15.641 7.042 -13.994 1.00 53.24 H new ATOM 0 HD11 LEU A 388 14.647 7.437 -11.803 1.00 72.34 H new ATOM 0 HD12 LEU A 388 15.100 8.957 -12.610 1.00 72.34 H new ATOM 0 HD13 LEU A 388 13.394 8.453 -12.554 1.00 72.34 H new ATOM 0 HD21 LEU A 388 13.923 5.500 -13.133 1.00 52.33 H new ATOM 0 HD22 LEU A 388 12.663 6.458 -13.947 1.00 52.33 H new ATOM 0 HD23 LEU A 388 13.886 5.595 -14.910 1.00 52.33 H new ATOM 540 N LEU A 389 17.302 9.769 -14.229 1.00 62.51 N ATOM 541 CA LEU A 389 18.729 9.507 -14.072 1.00 11.35 C ATOM 542 C LEU A 389 18.929 8.065 -13.691 1.00 23.41 C ATOM 543 O LEU A 389 19.407 7.270 -14.469 1.00 25.24 O ATOM 544 CB LEU A 389 19.338 10.395 -12.983 1.00 50.51 C ATOM 545 CG LEU A 389 19.274 11.894 -13.208 1.00 12.13 C ATOM 546 CD1 LEU A 389 19.924 12.608 -12.051 1.00 72.53 C ATOM 547 CD2 LEU A 389 19.970 12.264 -14.501 1.00 3.52 C ATOM 0 H LEU A 389 16.904 10.384 -13.519 1.00 62.51 H new ATOM 0 HA LEU A 389 19.223 9.727 -15.018 1.00 11.35 H new ATOM 0 HB2 LEU A 389 18.836 10.171 -12.042 1.00 50.51 H new ATOM 0 HB3 LEU A 389 20.384 10.114 -12.861 1.00 50.51 H new ATOM 0 HG LEU A 389 18.229 12.196 -13.278 1.00 12.13 H new ATOM 0 HD11 LEU A 389 19.877 13.685 -12.215 1.00 72.53 H new ATOM 0 HD12 LEU A 389 19.400 12.358 -11.128 1.00 72.53 H new ATOM 0 HD13 LEU A 389 20.966 12.298 -11.972 1.00 72.53 H new ATOM 0 HD21 LEU A 389 19.915 13.343 -14.648 1.00 3.52 H new ATOM 0 HD22 LEU A 389 21.015 11.957 -14.453 1.00 3.52 H new ATOM 0 HD23 LEU A 389 19.482 11.759 -15.334 1.00 3.52 H new ATOM 559 N GLY A 390 18.506 7.738 -12.507 1.00 73.43 N ATOM 560 CA GLY A 390 18.641 6.417 -12.002 1.00 44.20 C ATOM 561 C GLY A 390 17.592 6.172 -10.978 1.00 53.15 C ATOM 562 O GLY A 390 16.852 7.096 -10.626 1.00 30.42 O ATOM 0 H GLY A 390 18.055 8.389 -11.865 1.00 73.43 H new ATOM 0 HA2 GLY A 390 18.549 5.694 -12.813 1.00 44.20 H new ATOM 0 HA3 GLY A 390 19.630 6.282 -11.565 1.00 44.20 H new ATOM 566 N ASN A 391 17.532 4.978 -10.457 1.00 4.31 N ATOM 567 CA ASN A 391 16.498 4.645 -9.500 1.00 2.45 C ATOM 568 C ASN A 391 17.089 4.212 -8.261 1.00 62.34 C ATOM 569 O ASN A 391 18.206 3.677 -8.256 1.00 22.42 O ATOM 570 CB ASN A 391 15.535 3.586 -9.996 1.00 61.05 C ATOM 571 CG ASN A 391 14.771 4.043 -11.171 1.00 72.54 C ATOM 572 OD1 ASN A 391 13.723 4.661 -11.047 1.00 0.53 O ATOM 573 ND2 ASN A 391 15.262 3.747 -12.318 1.00 51.31 N ATOM 0 H ASN A 391 18.179 4.220 -10.673 1.00 4.31 H new ATOM 0 HA ASN A 391 15.919 5.556 -9.349 1.00 2.45 H new ATOM 0 HB2 ASN A 391 16.089 2.683 -10.252 1.00 61.05 H new ATOM 0 HB3 ASN A 391 14.845 3.320 -9.196 1.00 61.05 H new ATOM 0 HD21 ASN A 391 14.775 4.029 -13.169 1.00 51.31 H new ATOM 0 HD22 ASN A 391 16.139 3.230 -12.379 1.00 51.31 H new ATOM 580 N PHE A 392 16.371 4.422 -7.209 1.00 2.22 N ATOM 581 CA PHE A 392 16.879 4.085 -5.879 1.00 44.04 C ATOM 582 C PHE A 392 17.139 2.598 -5.787 1.00 53.33 C ATOM 583 O PHE A 392 16.221 1.780 -5.927 1.00 13.12 O ATOM 584 CB PHE A 392 15.920 4.542 -4.766 1.00 33.22 C ATOM 585 CG PHE A 392 16.357 4.177 -3.371 1.00 42.14 C ATOM 586 CD1 PHE A 392 17.290 4.938 -2.698 1.00 61.33 C ATOM 587 CD2 PHE A 392 15.822 3.072 -2.737 1.00 54.11 C ATOM 588 CE1 PHE A 392 17.679 4.598 -1.421 1.00 31.34 C ATOM 589 CE2 PHE A 392 16.205 2.728 -1.465 1.00 25.33 C ATOM 590 CZ PHE A 392 17.132 3.491 -0.803 1.00 11.23 C ATOM 0 H PHE A 392 15.433 4.822 -7.221 1.00 2.22 H new ATOM 0 HA PHE A 392 17.817 4.620 -5.732 1.00 44.04 H new ATOM 0 HB2 PHE A 392 15.806 5.624 -4.825 1.00 33.22 H new ATOM 0 HB3 PHE A 392 14.938 4.107 -4.950 1.00 33.22 H new ATOM 0 HD1 PHE A 392 17.719 5.807 -3.176 1.00 61.33 H new ATOM 0 HD2 PHE A 392 15.089 2.468 -3.252 1.00 54.11 H new ATOM 0 HE1 PHE A 392 18.412 5.198 -0.903 1.00 31.34 H new ATOM 0 HE2 PHE A 392 15.778 1.859 -0.987 1.00 25.33 H new ATOM 0 HZ PHE A 392 17.434 3.227 0.200 1.00 11.23 H new ATOM 600 N ALA A 393 18.388 2.262 -5.615 1.00 72.34 N ATOM 601 CA ALA A 393 18.780 0.896 -5.481 1.00 35.31 C ATOM 602 C ALA A 393 19.368 0.650 -4.118 1.00 22.14 C ATOM 603 O ALA A 393 18.922 -0.232 -3.379 1.00 64.31 O ATOM 604 CB ALA A 393 19.783 0.532 -6.562 1.00 51.30 C ATOM 0 H ALA A 393 19.157 2.930 -5.565 1.00 72.34 H new ATOM 0 HA ALA A 393 17.897 0.267 -5.595 1.00 35.31 H new ATOM 0 HB1 ALA A 393 20.075 -0.512 -6.450 1.00 51.30 H new ATOM 0 HB2 ALA A 393 19.331 0.679 -7.543 1.00 51.30 H new ATOM 0 HB3 ALA A 393 20.664 1.167 -6.470 1.00 51.30 H new ATOM 610 N SER A 394 20.346 1.460 -3.765 1.00 60.13 N ATOM 611 CA SER A 394 21.080 1.254 -2.556 1.00 12.23 C ATOM 612 C SER A 394 21.221 2.541 -1.750 1.00 63.13 C ATOM 613 O SER A 394 21.212 3.655 -2.308 1.00 14.24 O ATOM 614 CB SER A 394 22.444 0.681 -2.905 1.00 72.21 C ATOM 615 OG SER A 394 22.299 -0.515 -3.661 1.00 50.34 O ATOM 0 H SER A 394 20.644 2.269 -4.310 1.00 60.13 H new ATOM 0 HA SER A 394 20.533 0.552 -1.927 1.00 12.23 H new ATOM 0 HB2 SER A 394 23.018 1.412 -3.475 1.00 72.21 H new ATOM 0 HB3 SER A 394 23.004 0.477 -1.993 1.00 72.21 H new ATOM 0 HG SER A 394 23.185 -0.873 -3.881 1.00 50.34 H new ATOM 621 N GLN A 395 21.353 2.372 -0.458 1.00 70.23 N ATOM 622 CA GLN A 395 21.463 3.447 0.497 1.00 3.25 C ATOM 623 C GLN A 395 22.558 3.087 1.482 1.00 34.30 C ATOM 624 O GLN A 395 22.497 2.039 2.123 1.00 0.53 O ATOM 625 CB GLN A 395 20.068 3.622 1.177 1.00 45.23 C ATOM 626 CG GLN A 395 19.904 4.680 2.291 1.00 14.41 C ATOM 627 CD GLN A 395 20.470 4.270 3.641 1.00 35.10 C ATOM 628 OE1 GLN A 395 21.618 4.538 3.969 1.00 5.44 O ATOM 629 NE2 GLN A 395 19.662 3.609 4.423 1.00 53.21 N ATOM 0 H GLN A 395 21.388 1.448 -0.027 1.00 70.23 H new ATOM 0 HA GLN A 395 21.733 4.397 0.036 1.00 3.25 H new ATOM 0 HB2 GLN A 395 19.347 3.855 0.393 1.00 45.23 H new ATOM 0 HB3 GLN A 395 19.783 2.657 1.596 1.00 45.23 H new ATOM 0 HG2 GLN A 395 20.390 5.602 1.973 1.00 14.41 H new ATOM 0 HG3 GLN A 395 18.844 4.903 2.409 1.00 14.41 H new ATOM 0 HE21 GLN A 395 18.711 3.403 4.117 1.00 53.21 H new ATOM 0 HE22 GLN A 395 19.981 3.298 5.341 1.00 53.21 H new ATOM 638 N GLU A 396 23.572 3.915 1.572 1.00 73.53 N ATOM 639 CA GLU A 396 24.652 3.662 2.482 1.00 22.20 C ATOM 640 C GLU A 396 24.976 4.911 3.282 1.00 44.02 C ATOM 641 O GLU A 396 25.673 5.829 2.802 1.00 71.51 O ATOM 642 CB GLU A 396 25.881 3.150 1.735 1.00 4.23 C ATOM 643 CG GLU A 396 27.068 2.838 2.625 1.00 22.12 C ATOM 644 CD GLU A 396 28.238 2.327 1.842 1.00 1.03 C ATOM 645 OE1 GLU A 396 28.980 3.139 1.266 1.00 23.21 O ATOM 646 OE2 GLU A 396 28.424 1.094 1.771 1.00 12.03 O ATOM 0 H GLU A 396 23.667 4.770 1.023 1.00 73.53 H new ATOM 0 HA GLU A 396 24.341 2.885 3.180 1.00 22.20 H new ATOM 0 HB2 GLU A 396 25.608 2.250 1.185 1.00 4.23 H new ATOM 0 HB3 GLU A 396 26.180 3.895 0.998 1.00 4.23 H new ATOM 0 HG2 GLU A 396 27.360 3.737 3.168 1.00 22.12 H new ATOM 0 HG3 GLU A 396 26.778 2.096 3.369 1.00 22.12 H new ATOM 653 N GLY A 397 24.440 4.958 4.476 1.00 12.13 N ATOM 654 CA GLY A 397 24.671 6.055 5.368 1.00 32.34 C ATOM 655 C GLY A 397 24.028 7.331 4.888 1.00 50.24 C ATOM 656 O GLY A 397 22.807 7.469 4.899 1.00 2.42 O ATOM 0 H GLY A 397 23.830 4.232 4.853 1.00 12.13 H new ATOM 0 HA2 GLY A 397 24.283 5.805 6.355 1.00 32.34 H new ATOM 0 HA3 GLY A 397 25.744 6.211 5.477 1.00 32.34 H new ATOM 660 N ASN A 398 24.845 8.245 4.458 1.00 54.01 N ATOM 661 CA ASN A 398 24.390 9.547 4.000 1.00 14.32 C ATOM 662 C ASN A 398 24.497 9.634 2.458 1.00 42.42 C ATOM 663 O ASN A 398 24.163 10.638 1.840 1.00 63.42 O ATOM 664 CB ASN A 398 25.228 10.633 4.720 1.00 50.41 C ATOM 665 CG ASN A 398 24.857 12.076 4.406 1.00 73.11 C ATOM 666 OD1 ASN A 398 23.736 12.398 4.082 1.00 2.32 O ATOM 667 ND2 ASN A 398 25.798 12.956 4.580 1.00 63.44 N ATOM 0 H ASN A 398 25.856 8.119 4.410 1.00 54.01 H new ATOM 0 HA ASN A 398 23.340 9.705 4.246 1.00 14.32 H new ATOM 0 HB2 ASN A 398 25.137 10.481 5.795 1.00 50.41 H new ATOM 0 HB3 ASN A 398 26.277 10.484 4.464 1.00 50.41 H new ATOM 0 HD21 ASN A 398 25.601 13.947 4.443 1.00 63.44 H new ATOM 0 HD22 ASN A 398 26.734 12.655 4.853 1.00 63.44 H new ATOM 674 N VAL A 399 24.956 8.551 1.841 1.00 31.30 N ATOM 675 CA VAL A 399 25.080 8.509 0.396 1.00 73.10 C ATOM 676 C VAL A 399 24.115 7.486 -0.196 1.00 74.15 C ATOM 677 O VAL A 399 24.149 6.298 0.151 1.00 14.34 O ATOM 678 CB VAL A 399 26.521 8.181 -0.071 1.00 53.33 C ATOM 679 CG1 VAL A 399 26.588 8.166 -1.596 1.00 74.20 C ATOM 680 CG2 VAL A 399 27.522 9.181 0.496 1.00 12.33 C ATOM 0 H VAL A 399 25.246 7.698 2.319 1.00 31.30 H new ATOM 0 HA VAL A 399 24.832 9.508 0.037 1.00 73.10 H new ATOM 0 HB VAL A 399 26.785 7.192 0.304 1.00 53.33 H new ATOM 0 HG11 VAL A 399 27.605 7.935 -1.913 1.00 74.20 H new ATOM 0 HG12 VAL A 399 25.906 7.409 -1.983 1.00 74.20 H new ATOM 0 HG13 VAL A 399 26.301 9.144 -1.982 1.00 74.20 H new ATOM 0 HG21 VAL A 399 28.525 8.927 0.152 1.00 12.33 H new ATOM 0 HG22 VAL A 399 27.266 10.185 0.157 1.00 12.33 H new ATOM 0 HG23 VAL A 399 27.493 9.148 1.585 1.00 12.33 H new ATOM 690 N LEU A 400 23.270 7.944 -1.076 1.00 15.55 N ATOM 691 CA LEU A 400 22.311 7.093 -1.760 1.00 70.51 C ATOM 692 C LEU A 400 22.659 6.994 -3.230 1.00 3.33 C ATOM 693 O LEU A 400 23.061 7.993 -3.847 1.00 30.14 O ATOM 694 CB LEU A 400 20.866 7.595 -1.571 1.00 73.14 C ATOM 695 CG LEU A 400 20.183 7.330 -0.213 1.00 64.13 C ATOM 696 CD1 LEU A 400 20.904 8.011 0.945 1.00 24.41 C ATOM 697 CD2 LEU A 400 18.744 7.771 -0.254 1.00 60.41 C ATOM 0 H LEU A 400 23.219 8.926 -1.348 1.00 15.55 H new ATOM 0 HA LEU A 400 22.367 6.099 -1.316 1.00 70.51 H new ATOM 0 HB2 LEU A 400 20.860 8.671 -1.744 1.00 73.14 H new ATOM 0 HB3 LEU A 400 20.250 7.144 -2.349 1.00 73.14 H new ATOM 0 HG LEU A 400 20.230 6.255 -0.039 1.00 64.13 H new ATOM 0 HD11 LEU A 400 20.383 7.793 1.877 1.00 24.41 H new ATOM 0 HD12 LEU A 400 21.927 7.639 1.006 1.00 24.41 H new ATOM 0 HD13 LEU A 400 20.919 9.089 0.781 1.00 24.41 H new ATOM 0 HD21 LEU A 400 18.276 7.577 0.711 1.00 60.41 H new ATOM 0 HD22 LEU A 400 18.696 8.838 -0.473 1.00 60.41 H new ATOM 0 HD23 LEU A 400 18.216 7.218 -1.030 1.00 60.41 H new ATOM 709 N LYS A 401 22.523 5.810 -3.793 1.00 72.13 N ATOM 710 CA LYS A 401 22.911 5.597 -5.167 1.00 20.33 C ATOM 711 C LYS A 401 21.673 5.182 -5.993 1.00 75.24 C ATOM 712 O LYS A 401 20.907 4.290 -5.591 1.00 2.11 O ATOM 713 CB LYS A 401 23.982 4.489 -5.232 1.00 20.34 C ATOM 714 CG LYS A 401 25.061 4.670 -6.307 1.00 23.10 C ATOM 715 CD LYS A 401 24.502 4.769 -7.711 1.00 2.45 C ATOM 716 CE LYS A 401 23.796 3.502 -8.170 1.00 63.55 C ATOM 717 NZ LYS A 401 24.666 2.304 -8.127 1.00 61.14 N ATOM 0 H LYS A 401 22.149 4.987 -3.321 1.00 72.13 H new ATOM 0 HA LYS A 401 23.323 6.518 -5.579 1.00 20.33 H new ATOM 0 HB2 LYS A 401 24.471 4.424 -4.260 1.00 20.34 H new ATOM 0 HB3 LYS A 401 23.482 3.535 -5.402 1.00 20.34 H new ATOM 0 HG2 LYS A 401 25.634 5.571 -6.088 1.00 23.10 H new ATOM 0 HG3 LYS A 401 25.755 3.831 -6.259 1.00 23.10 H new ATOM 0 HD2 LYS A 401 23.802 5.603 -7.758 1.00 2.45 H new ATOM 0 HD3 LYS A 401 25.314 4.995 -8.402 1.00 2.45 H new ATOM 0 HE2 LYS A 401 22.922 3.332 -7.541 1.00 63.55 H new ATOM 0 HE3 LYS A 401 23.433 3.644 -9.188 1.00 63.55 H new ATOM 0 HZ1 LYS A 401 24.158 1.491 -8.530 1.00 61.14 H new ATOM 0 HZ2 LYS A 401 25.529 2.481 -8.680 1.00 61.14 H new ATOM 0 HZ3 LYS A 401 24.924 2.097 -7.141 1.00 61.14 H new ATOM 731 N TYR A 402 21.502 5.809 -7.139 1.00 4.12 N ATOM 732 CA TYR A 402 20.405 5.542 -8.029 1.00 11.42 C ATOM 733 C TYR A 402 20.987 5.005 -9.336 1.00 14.21 C ATOM 734 O TYR A 402 21.888 5.607 -9.877 1.00 72.44 O ATOM 735 CB TYR A 402 19.665 6.849 -8.323 1.00 53.23 C ATOM 736 CG TYR A 402 19.291 7.645 -7.093 1.00 64.05 C ATOM 737 CD1 TYR A 402 18.098 7.432 -6.425 1.00 40.44 C ATOM 738 CD2 TYR A 402 20.148 8.619 -6.605 1.00 24.12 C ATOM 739 CE1 TYR A 402 17.776 8.171 -5.304 1.00 64.40 C ATOM 740 CE2 TYR A 402 19.837 9.353 -5.498 1.00 51.34 C ATOM 741 CZ TYR A 402 18.657 9.132 -4.848 1.00 53.41 C ATOM 742 OH TYR A 402 18.347 9.876 -3.748 1.00 12.51 O ATOM 0 H TYR A 402 22.137 6.531 -7.479 1.00 4.12 H new ATOM 0 HA TYR A 402 19.717 4.824 -7.583 1.00 11.42 H new ATOM 0 HB2 TYR A 402 20.289 7.469 -8.966 1.00 53.23 H new ATOM 0 HB3 TYR A 402 18.758 6.621 -8.883 1.00 53.23 H new ATOM 0 HD1 TYR A 402 17.411 6.680 -6.784 1.00 40.44 H new ATOM 0 HD2 TYR A 402 21.084 8.801 -7.113 1.00 24.12 H new ATOM 0 HE1 TYR A 402 16.843 7.999 -4.788 1.00 64.40 H new ATOM 0 HE2 TYR A 402 20.522 10.106 -5.137 1.00 51.34 H new ATOM 0 HH TYR A 402 17.918 9.305 -3.077 1.00 12.51 H new ATOM 752 N GLU A 403 20.501 3.888 -9.828 1.00 50.32 N ATOM 753 CA GLU A 403 21.048 3.302 -11.067 1.00 23.04 C ATOM 754 C GLU A 403 19.981 2.838 -12.017 1.00 61.23 C ATOM 755 O GLU A 403 18.801 2.744 -11.648 1.00 51.03 O ATOM 756 CB GLU A 403 21.969 2.124 -10.763 1.00 34.24 C ATOM 757 CG GLU A 403 21.344 1.058 -9.888 1.00 51.13 C ATOM 758 CD GLU A 403 22.289 -0.070 -9.620 1.00 53.31 C ATOM 759 OE1 GLU A 403 23.242 0.123 -8.837 1.00 14.13 O ATOM 760 OE2 GLU A 403 22.098 -1.153 -10.174 1.00 13.35 O ATOM 0 H GLU A 403 19.737 3.359 -9.407 1.00 50.32 H new ATOM 0 HA GLU A 403 21.609 4.105 -11.544 1.00 23.04 H new ATOM 0 HB2 GLU A 403 22.282 1.669 -11.703 1.00 34.24 H new ATOM 0 HB3 GLU A 403 22.869 2.497 -10.275 1.00 34.24 H new ATOM 0 HG2 GLU A 403 21.031 1.502 -8.943 1.00 51.13 H new ATOM 0 HG3 GLU A 403 20.446 0.672 -10.371 1.00 51.13 H new ATOM 767 N ASN A 404 20.416 2.555 -13.244 1.00 42.52 N ATOM 768 CA ASN A 404 19.589 1.969 -14.287 1.00 60.04 C ATOM 769 C ASN A 404 18.369 2.788 -14.639 1.00 45.35 C ATOM 770 O ASN A 404 17.248 2.270 -14.693 1.00 44.23 O ATOM 771 CB ASN A 404 19.233 0.512 -13.977 1.00 4.44 C ATOM 772 CG ASN A 404 20.432 -0.415 -14.041 1.00 72.32 C ATOM 773 OD1 ASN A 404 21.360 -0.202 -14.827 1.00 55.42 O ATOM 774 ND2 ASN A 404 20.438 -1.434 -13.216 1.00 31.23 N ATOM 0 H ASN A 404 21.375 2.732 -13.543 1.00 42.52 H new ATOM 0 HA ASN A 404 20.206 1.977 -15.186 1.00 60.04 H new ATOM 0 HB2 ASN A 404 18.789 0.455 -12.983 1.00 4.44 H new ATOM 0 HB3 ASN A 404 18.477 0.170 -14.684 1.00 4.44 H new ATOM 0 HD21 ASN A 404 21.227 -2.081 -13.210 1.00 31.23 H new ATOM 0 HD22 ASN A 404 19.654 -1.580 -12.580 1.00 31.23 H new ATOM 781 N GLY A 405 18.577 4.063 -14.865 1.00 4.15 N ATOM 782 CA GLY A 405 17.503 4.903 -15.323 1.00 2.43 C ATOM 783 C GLY A 405 17.442 4.891 -16.834 1.00 51.43 C ATOM 784 O GLY A 405 17.571 3.828 -17.457 1.00 22.41 O ATOM 0 H GLY A 405 19.472 4.536 -14.740 1.00 4.15 H new ATOM 0 HA2 GLY A 405 16.557 4.554 -14.910 1.00 2.43 H new ATOM 0 HA3 GLY A 405 17.650 5.922 -14.965 1.00 2.43 H new ATOM 788 N GLN A 406 17.286 6.044 -17.424 1.00 34.22 N ATOM 789 CA GLN A 406 17.241 6.179 -18.873 1.00 55.21 C ATOM 790 C GLN A 406 18.608 5.935 -19.472 1.00 52.25 C ATOM 791 O GLN A 406 19.635 6.214 -18.827 1.00 12.33 O ATOM 792 CB GLN A 406 16.748 7.571 -19.276 1.00 10.21 C ATOM 793 CG GLN A 406 15.305 7.855 -18.923 1.00 34.43 C ATOM 794 CD GLN A 406 14.345 6.944 -19.648 1.00 4.04 C ATOM 795 OE1 GLN A 406 13.995 5.879 -19.162 1.00 52.31 O ATOM 796 NE2 GLN A 406 13.925 7.353 -20.814 1.00 32.15 N ATOM 0 H GLN A 406 17.185 6.926 -16.921 1.00 34.22 H new ATOM 0 HA GLN A 406 16.544 5.433 -19.255 1.00 55.21 H new ATOM 0 HB2 GLN A 406 17.380 8.319 -18.796 1.00 10.21 H new ATOM 0 HB3 GLN A 406 16.875 7.690 -20.352 1.00 10.21 H new ATOM 0 HG2 GLN A 406 15.168 7.741 -17.848 1.00 34.43 H new ATOM 0 HG3 GLN A 406 15.072 8.892 -19.166 1.00 34.43 H new ATOM 0 HE21 GLN A 406 14.241 8.249 -21.184 1.00 32.15 H new ATOM 0 HE22 GLN A 406 13.280 6.776 -21.355 1.00 32.15 H new ATOM 805 N SER A 407 18.634 5.362 -20.669 1.00 73.50 N ATOM 806 CA SER A 407 19.868 5.178 -21.392 1.00 25.54 C ATOM 807 C SER A 407 20.589 6.511 -21.550 1.00 1.24 C ATOM 808 O SER A 407 19.972 7.545 -21.818 1.00 75.11 O ATOM 809 CB SER A 407 19.611 4.524 -22.745 1.00 43.03 C ATOM 810 OG SER A 407 19.083 3.219 -22.571 1.00 51.42 O ATOM 0 H SER A 407 17.805 5.018 -21.154 1.00 73.50 H new ATOM 0 HA SER A 407 20.511 4.509 -20.820 1.00 25.54 H new ATOM 0 HB2 SER A 407 18.914 5.131 -23.323 1.00 43.03 H new ATOM 0 HB3 SER A 407 20.539 4.475 -23.314 1.00 43.03 H new ATOM 0 HG SER A 407 19.819 2.576 -22.497 1.00 51.42 H new ATOM 816 N CYS A 408 21.871 6.477 -21.358 1.00 21.31 N ATOM 817 CA CYS A 408 22.687 7.655 -21.392 1.00 13.45 C ATOM 818 C CYS A 408 22.929 8.057 -22.817 1.00 32.02 C ATOM 819 O CYS A 408 22.805 9.221 -23.185 1.00 70.42 O ATOM 820 CB CYS A 408 23.996 7.357 -20.689 1.00 64.24 C ATOM 821 SG CYS A 408 25.206 8.699 -20.708 1.00 12.32 S ATOM 0 H CYS A 408 22.389 5.619 -21.170 1.00 21.31 H new ATOM 0 HA CYS A 408 22.186 8.479 -20.884 1.00 13.45 H new ATOM 0 HB2 CYS A 408 23.782 7.098 -19.652 1.00 64.24 H new ATOM 0 HB3 CYS A 408 24.446 6.478 -21.151 1.00 64.24 H new ATOM 826 N ALA A 409 23.246 7.080 -23.611 1.00 73.23 N ATOM 827 CA ALA A 409 23.467 7.259 -25.000 1.00 51.54 C ATOM 828 C ALA A 409 23.316 5.929 -25.667 1.00 61.32 C ATOM 829 O ALA A 409 24.247 5.115 -25.647 1.00 55.23 O ATOM 830 CB ALA A 409 24.849 7.848 -25.269 1.00 4.21 C ATOM 0 H ALA A 409 23.359 6.116 -23.296 1.00 73.23 H new ATOM 0 HA ALA A 409 22.740 7.965 -25.401 1.00 51.54 H new ATOM 0 HB1 ALA A 409 24.988 7.973 -26.343 1.00 4.21 H new ATOM 0 HB2 ALA A 409 24.934 8.817 -24.777 1.00 4.21 H new ATOM 0 HB3 ALA A 409 25.613 7.175 -24.880 1.00 4.21 H new ATOM 836 N ASN A 410 22.104 5.669 -26.147 1.00 1.32 N ATOM 837 CA ASN A 410 21.737 4.445 -26.895 1.00 41.33 C ATOM 838 C ASN A 410 21.714 3.155 -26.030 1.00 34.22 C ATOM 839 O ASN A 410 20.735 2.403 -26.058 1.00 71.13 O ATOM 840 CB ASN A 410 22.649 4.249 -28.127 1.00 21.44 C ATOM 841 CG ASN A 410 22.287 3.041 -28.989 1.00 53.41 C ATOM 842 OD1 ASN A 410 23.165 2.403 -29.568 1.00 32.13 O ATOM 843 ND2 ASN A 410 21.019 2.741 -29.117 1.00 0.32 N ATOM 0 H ASN A 410 21.321 6.313 -26.030 1.00 1.32 H new ATOM 0 HA ASN A 410 20.711 4.608 -27.225 1.00 41.33 H new ATOM 0 HB2 ASN A 410 22.606 5.147 -28.743 1.00 21.44 H new ATOM 0 HB3 ASN A 410 23.680 4.144 -27.789 1.00 21.44 H new ATOM 0 HD21 ASN A 410 20.737 1.960 -29.709 1.00 0.32 H new ATOM 0 HD22 ASN A 410 20.313 3.288 -28.624 1.00 0.32 H new ATOM 850 N GLY A 411 22.761 2.917 -25.267 1.00 65.34 N ATOM 851 CA GLY A 411 22.870 1.673 -24.539 1.00 41.22 C ATOM 852 C GLY A 411 22.813 1.829 -23.040 1.00 14.40 C ATOM 853 O GLY A 411 21.711 1.925 -22.481 1.00 33.40 O ATOM 0 H GLY A 411 23.540 3.562 -25.136 1.00 65.34 H new ATOM 0 HA2 GLY A 411 22.066 1.008 -24.855 1.00 41.22 H new ATOM 0 HA3 GLY A 411 23.809 1.188 -24.808 1.00 41.22 H new ATOM 857 N PRO A 412 23.996 1.861 -22.353 1.00 53.20 N ATOM 858 CA PRO A 412 24.082 1.937 -20.886 1.00 22.15 C ATOM 859 C PRO A 412 23.231 3.033 -20.282 1.00 73.44 C ATOM 860 O PRO A 412 22.919 4.048 -20.928 1.00 24.54 O ATOM 861 CB PRO A 412 25.551 2.186 -20.604 1.00 11.31 C ATOM 862 CG PRO A 412 26.258 1.609 -21.778 1.00 25.23 C ATOM 863 CD PRO A 412 25.343 1.815 -22.962 1.00 42.23 C ATOM 0 HA PRO A 412 23.701 1.021 -20.435 1.00 22.15 H new ATOM 0 HB2 PRO A 412 25.760 3.251 -20.498 1.00 11.31 H new ATOM 0 HB3 PRO A 412 25.864 1.706 -19.677 1.00 11.31 H new ATOM 0 HG2 PRO A 412 27.217 2.102 -21.936 1.00 25.23 H new ATOM 0 HG3 PRO A 412 26.466 0.550 -21.626 1.00 25.23 H new ATOM 0 HD2 PRO A 412 25.575 2.738 -23.493 1.00 42.23 H new ATOM 0 HD3 PRO A 412 25.430 1.002 -23.683 1.00 42.23 H new ATOM 871 N HIS A 413 22.888 2.847 -19.045 1.00 11.12 N ATOM 872 CA HIS A 413 21.946 3.702 -18.376 1.00 44.04 C ATOM 873 C HIS A 413 22.654 4.765 -17.584 1.00 10.20 C ATOM 874 O HIS A 413 23.843 4.649 -17.277 1.00 31.22 O ATOM 875 CB HIS A 413 21.069 2.879 -17.415 1.00 61.00 C ATOM 876 CG HIS A 413 20.345 1.720 -18.041 1.00 54.32 C ATOM 877 ND1 HIS A 413 18.979 1.658 -18.187 1.00 23.24 N ATOM 878 CD2 HIS A 413 20.818 0.548 -18.511 1.00 71.22 C ATOM 879 CE1 HIS A 413 18.648 0.499 -18.712 1.00 12.23 C ATOM 880 NE2 HIS A 413 19.746 -0.192 -18.919 1.00 54.03 N ATOM 0 H HIS A 413 23.254 2.093 -18.463 1.00 11.12 H new ATOM 0 HA HIS A 413 21.326 4.172 -19.140 1.00 44.04 H new ATOM 0 HB2 HIS A 413 21.698 2.501 -16.609 1.00 61.00 H new ATOM 0 HB3 HIS A 413 20.334 3.543 -16.961 1.00 61.00 H new ATOM 0 HD1 HIS A 413 18.324 2.396 -17.928 1.00 23.24 H new ATOM 0 HD2 HIS A 413 21.855 0.250 -18.556 1.00 71.22 H new ATOM 0 HE1 HIS A 413 17.644 0.171 -18.935 1.00 12.23 H new ATOM 889 N ARG A 414 21.939 5.801 -17.298 1.00 23.10 N ATOM 890 CA ARG A 414 22.389 6.821 -16.413 1.00 51.14 C ATOM 891 C ARG A 414 22.226 6.351 -14.973 1.00 42.13 C ATOM 892 O ARG A 414 21.502 5.363 -14.693 1.00 70.31 O ATOM 893 CB ARG A 414 21.598 8.119 -16.641 1.00 14.12 C ATOM 894 CG ARG A 414 21.924 8.848 -17.937 1.00 24.30 C ATOM 895 CD ARG A 414 21.009 10.054 -18.139 1.00 24.54 C ATOM 896 NE ARG A 414 21.513 10.969 -19.180 1.00 10.33 N ATOM 897 CZ ARG A 414 20.838 11.393 -20.261 1.00 45.14 C ATOM 898 NH1 ARG A 414 19.658 10.881 -20.557 1.00 13.11 N ATOM 899 NH2 ARG A 414 21.363 12.323 -21.050 1.00 43.12 N ATOM 0 H ARG A 414 21.008 5.965 -17.680 1.00 23.10 H new ATOM 0 HA ARG A 414 23.442 7.024 -16.610 1.00 51.14 H new ATOM 0 HB2 ARG A 414 20.533 7.885 -16.630 1.00 14.12 H new ATOM 0 HB3 ARG A 414 21.785 8.793 -15.805 1.00 14.12 H new ATOM 0 HG2 ARG A 414 22.963 9.176 -17.921 1.00 24.30 H new ATOM 0 HG3 ARG A 414 21.818 8.163 -18.779 1.00 24.30 H new ATOM 0 HD2 ARG A 414 20.012 9.709 -18.413 1.00 24.54 H new ATOM 0 HD3 ARG A 414 20.912 10.596 -17.198 1.00 24.54 H new ATOM 0 HE ARG A 414 22.467 11.313 -19.068 1.00 10.33 H new ATOM 0 HH11 ARG A 414 19.252 10.158 -19.963 1.00 13.11 H new ATOM 0 HH12 ARG A 414 19.152 11.209 -21.380 1.00 13.11 H new ATOM 0 HH21 ARG A 414 22.279 12.716 -20.835 1.00 43.12 H new ATOM 0 HH22 ARG A 414 20.850 12.644 -21.871 1.00 43.12 H new ATOM 913 N SER A 415 22.894 7.015 -14.093 1.00 30.33 N ATOM 914 CA SER A 415 22.812 6.757 -12.697 1.00 44.44 C ATOM 915 C SER A 415 23.058 8.052 -11.938 1.00 41.31 C ATOM 916 O SER A 415 23.583 9.011 -12.497 1.00 54.22 O ATOM 917 CB SER A 415 23.774 5.612 -12.306 1.00 20.42 C ATOM 918 OG SER A 415 25.078 5.813 -12.816 1.00 65.33 O ATOM 0 H SER A 415 23.531 7.775 -14.333 1.00 30.33 H new ATOM 0 HA SER A 415 21.815 6.411 -12.425 1.00 44.44 H new ATOM 0 HB2 SER A 415 23.819 5.532 -11.220 1.00 20.42 H new ATOM 0 HB3 SER A 415 23.381 4.666 -12.679 1.00 20.42 H new ATOM 0 HG SER A 415 25.737 5.574 -12.131 1.00 65.33 H new ATOM 924 N ALA A 416 22.658 8.100 -10.707 1.00 52.11 N ATOM 925 CA ALA A 416 22.780 9.295 -9.919 1.00 63.14 C ATOM 926 C ALA A 416 23.269 8.942 -8.546 1.00 70.11 C ATOM 927 O ALA A 416 22.908 7.904 -8.007 1.00 0.21 O ATOM 928 CB ALA A 416 21.434 10.011 -9.840 1.00 32.13 C ATOM 0 H ALA A 416 22.236 7.313 -10.215 1.00 52.11 H new ATOM 0 HA ALA A 416 23.499 9.966 -10.389 1.00 63.14 H new ATOM 0 HB1 ALA A 416 21.538 10.915 -9.240 1.00 32.13 H new ATOM 0 HB2 ALA A 416 21.104 10.277 -10.844 1.00 32.13 H new ATOM 0 HB3 ALA A 416 20.698 9.352 -9.379 1.00 32.13 H new ATOM 934 N ILE A 417 24.107 9.754 -8.004 1.00 33.23 N ATOM 935 CA ILE A 417 24.602 9.540 -6.672 1.00 10.23 C ATOM 936 C ILE A 417 24.359 10.797 -5.844 1.00 53.40 C ATOM 937 O ILE A 417 24.765 11.893 -6.238 1.00 65.52 O ATOM 938 CB ILE A 417 26.113 9.130 -6.676 1.00 43.50 C ATOM 939 CG1 ILE A 417 26.615 8.835 -5.255 1.00 32.43 C ATOM 940 CG2 ILE A 417 26.978 10.168 -7.370 1.00 41.12 C ATOM 941 CD1 ILE A 417 28.055 8.365 -5.191 1.00 43.33 C ATOM 0 H ILE A 417 24.474 10.587 -8.463 1.00 33.23 H new ATOM 0 HA ILE A 417 24.062 8.708 -6.220 1.00 10.23 H new ATOM 0 HB ILE A 417 26.197 8.209 -7.252 1.00 43.50 H new ATOM 0 HG12 ILE A 417 26.511 9.736 -4.650 1.00 32.43 H new ATOM 0 HG13 ILE A 417 25.976 8.075 -4.806 1.00 32.43 H new ATOM 0 HG21 ILE A 417 28.019 9.846 -7.351 1.00 41.12 H new ATOM 0 HG22 ILE A 417 26.652 10.281 -8.404 1.00 41.12 H new ATOM 0 HG23 ILE A 417 26.885 11.123 -6.854 1.00 41.12 H new ATOM 0 HD11 ILE A 417 28.331 8.179 -4.153 1.00 43.33 H new ATOM 0 HD12 ILE A 417 28.163 7.445 -5.766 1.00 43.33 H new ATOM 0 HD13 ILE A 417 28.707 9.133 -5.608 1.00 43.33 H new ATOM 953 N VAL A 418 23.687 10.669 -4.733 1.00 10.44 N ATOM 954 CA VAL A 418 23.397 11.838 -3.951 1.00 15.13 C ATOM 955 C VAL A 418 24.455 12.034 -2.875 1.00 34.23 C ATOM 956 O VAL A 418 24.762 11.125 -2.099 1.00 44.32 O ATOM 957 CB VAL A 418 21.949 11.842 -3.341 1.00 64.30 C ATOM 958 CG1 VAL A 418 21.770 10.787 -2.285 1.00 14.13 C ATOM 959 CG2 VAL A 418 21.562 13.222 -2.826 1.00 11.23 C ATOM 0 H VAL A 418 23.337 9.789 -4.355 1.00 10.44 H new ATOM 0 HA VAL A 418 23.427 12.686 -4.635 1.00 15.13 H new ATOM 0 HB VAL A 418 21.266 11.591 -4.153 1.00 64.30 H new ATOM 0 HG11 VAL A 418 20.753 10.831 -1.895 1.00 14.13 H new ATOM 0 HG12 VAL A 418 21.950 9.803 -2.719 1.00 14.13 H new ATOM 0 HG13 VAL A 418 22.477 10.960 -1.474 1.00 14.13 H new ATOM 0 HG21 VAL A 418 20.555 13.186 -2.411 1.00 11.23 H new ATOM 0 HG22 VAL A 418 22.263 13.531 -2.050 1.00 11.23 H new ATOM 0 HG23 VAL A 418 21.591 13.938 -3.647 1.00 11.23 H new ATOM 969 N THR A 419 25.043 13.184 -2.879 1.00 1.42 N ATOM 970 CA THR A 419 26.004 13.539 -1.908 1.00 54.52 C ATOM 971 C THR A 419 25.385 14.619 -1.048 1.00 64.33 C ATOM 972 O THR A 419 25.101 15.721 -1.530 1.00 15.42 O ATOM 973 CB THR A 419 27.255 14.090 -2.606 1.00 53.31 C ATOM 974 OG1 THR A 419 27.661 13.150 -3.614 1.00 35.21 O ATOM 975 CG2 THR A 419 28.390 14.274 -1.610 1.00 32.31 C ATOM 0 H THR A 419 24.861 13.910 -3.572 1.00 1.42 H new ATOM 0 HA THR A 419 26.292 12.678 -1.306 1.00 54.52 H new ATOM 0 HB THR A 419 27.023 15.059 -3.049 1.00 53.31 H new ATOM 0 HG1 THR A 419 28.459 13.486 -4.073 1.00 35.21 H new ATOM 0 HG21 THR A 419 29.267 14.665 -2.126 1.00 32.31 H new ATOM 0 HG22 THR A 419 28.083 14.975 -0.834 1.00 32.31 H new ATOM 0 HG23 THR A 419 28.635 13.314 -1.156 1.00 32.31 H new ATOM 983 N VAL A 420 25.151 14.311 0.191 1.00 15.51 N ATOM 984 CA VAL A 420 24.533 15.249 1.076 1.00 61.10 C ATOM 985 C VAL A 420 25.570 15.738 2.066 1.00 12.45 C ATOM 986 O VAL A 420 26.326 14.948 2.620 1.00 12.34 O ATOM 987 CB VAL A 420 23.319 14.629 1.820 1.00 22.32 C ATOM 988 CG1 VAL A 420 22.563 15.687 2.601 1.00 32.30 C ATOM 989 CG2 VAL A 420 22.388 13.919 0.853 1.00 20.14 C ATOM 0 H VAL A 420 25.380 13.412 0.614 1.00 15.51 H new ATOM 0 HA VAL A 420 24.151 16.085 0.490 1.00 61.10 H new ATOM 0 HB VAL A 420 23.705 13.892 2.524 1.00 22.32 H new ATOM 0 HG11 VAL A 420 21.718 15.227 3.113 1.00 32.30 H new ATOM 0 HG12 VAL A 420 23.228 16.142 3.335 1.00 32.30 H new ATOM 0 HG13 VAL A 420 22.199 16.454 1.917 1.00 32.30 H new ATOM 0 HG21 VAL A 420 21.547 13.495 1.402 1.00 20.14 H new ATOM 0 HG22 VAL A 420 22.017 14.631 0.116 1.00 20.14 H new ATOM 0 HG23 VAL A 420 22.930 13.121 0.346 1.00 20.14 H new ATOM 999 N GLU A 421 25.615 17.021 2.272 1.00 24.50 N ATOM 1000 CA GLU A 421 26.615 17.625 3.142 1.00 43.20 C ATOM 1001 C GLU A 421 25.984 18.056 4.460 1.00 3.23 C ATOM 1002 O GLU A 421 26.679 18.553 5.346 1.00 33.55 O ATOM 1003 CB GLU A 421 27.160 18.875 2.459 1.00 2.31 C ATOM 1004 CG GLU A 421 26.068 19.905 2.231 1.00 60.11 C ATOM 1005 CD GLU A 421 26.525 21.163 1.584 1.00 65.43 C ATOM 1006 OE1 GLU A 421 27.109 22.016 2.264 1.00 61.52 O ATOM 1007 OE2 GLU A 421 26.280 21.338 0.386 1.00 50.42 O ATOM 0 H GLU A 421 24.968 17.687 1.850 1.00 24.50 H new ATOM 0 HA GLU A 421 27.403 16.896 3.333 1.00 43.20 H new ATOM 0 HB2 GLU A 421 27.950 19.310 3.071 1.00 2.31 H new ATOM 0 HB3 GLU A 421 27.610 18.603 1.504 1.00 2.31 H new ATOM 0 HG2 GLU A 421 25.289 19.458 1.614 1.00 60.11 H new ATOM 0 HG3 GLU A 421 25.613 20.151 3.191 1.00 60.11 H new ATOM 1014 N CYS A 422 24.674 17.829 4.581 1.00 43.43 N ATOM 1015 CA CYS A 422 23.872 18.313 5.709 1.00 53.41 C ATOM 1016 C CYS A 422 23.637 19.815 5.629 1.00 41.04 C ATOM 1017 O CYS A 422 24.531 20.589 5.293 1.00 2.00 O ATOM 1018 CB CYS A 422 24.436 17.879 7.085 1.00 15.50 C ATOM 1019 SG CYS A 422 23.775 18.805 8.526 1.00 70.23 S ATOM 0 H CYS A 422 24.135 17.301 3.895 1.00 43.43 H new ATOM 0 HA CYS A 422 22.899 17.829 5.624 1.00 53.41 H new ATOM 0 HB2 CYS A 422 24.227 16.819 7.228 1.00 15.50 H new ATOM 0 HB3 CYS A 422 25.520 17.991 7.067 1.00 15.50 H new ATOM 1024 N GLY A 423 22.420 20.210 5.889 1.00 64.40 N ATOM 1025 CA GLY A 423 22.062 21.593 5.852 1.00 73.31 C ATOM 1026 C GLY A 423 20.860 21.834 6.706 1.00 1.20 C ATOM 1027 O GLY A 423 20.350 20.897 7.331 1.00 22.42 O ATOM 0 H GLY A 423 21.655 19.581 6.131 1.00 64.40 H new ATOM 0 HA2 GLY A 423 22.895 22.202 6.203 1.00 73.31 H new ATOM 0 HA3 GLY A 423 21.855 21.896 4.826 1.00 73.31 H new ATOM 1031 N VAL A 424 20.404 23.051 6.741 1.00 21.22 N ATOM 1032 CA VAL A 424 19.236 23.422 7.526 1.00 34.35 C ATOM 1033 C VAL A 424 17.977 23.180 6.688 1.00 54.44 C ATOM 1034 O VAL A 424 16.886 22.883 7.207 1.00 33.14 O ATOM 1035 CB VAL A 424 19.326 24.914 7.967 1.00 11.44 C ATOM 1036 CG1 VAL A 424 18.129 25.321 8.805 1.00 64.13 C ATOM 1037 CG2 VAL A 424 20.614 25.154 8.740 1.00 20.10 C ATOM 0 H VAL A 424 20.824 23.826 6.228 1.00 21.22 H new ATOM 0 HA VAL A 424 19.193 22.811 8.428 1.00 34.35 H new ATOM 0 HB VAL A 424 19.326 25.529 7.067 1.00 11.44 H new ATOM 0 HG11 VAL A 424 18.226 26.367 9.094 1.00 64.13 H new ATOM 0 HG12 VAL A 424 17.216 25.188 8.224 1.00 64.13 H new ATOM 0 HG13 VAL A 424 18.083 24.700 9.700 1.00 64.13 H new ATOM 0 HG21 VAL A 424 20.667 26.200 9.043 1.00 20.10 H new ATOM 0 HG22 VAL A 424 20.631 24.518 9.625 1.00 20.10 H new ATOM 0 HG23 VAL A 424 21.468 24.917 8.106 1.00 20.10 H new ATOM 1047 N GLU A 425 18.155 23.261 5.399 1.00 21.10 N ATOM 1048 CA GLU A 425 17.107 23.050 4.450 1.00 22.54 C ATOM 1049 C GLU A 425 17.640 22.189 3.322 1.00 13.22 C ATOM 1050 O GLU A 425 18.860 22.099 3.131 1.00 72.23 O ATOM 1051 CB GLU A 425 16.588 24.403 3.923 1.00 42.04 C ATOM 1052 CG GLU A 425 15.481 24.313 2.879 1.00 22.30 C ATOM 1053 CD GLU A 425 14.233 23.655 3.413 1.00 51.22 C ATOM 1054 OE1 GLU A 425 14.260 22.432 3.682 1.00 62.12 O ATOM 1055 OE2 GLU A 425 13.201 24.344 3.540 1.00 35.40 O ATOM 0 H GLU A 425 19.055 23.481 4.973 1.00 21.10 H new ATOM 0 HA GLU A 425 16.269 22.538 4.923 1.00 22.54 H new ATOM 0 HB2 GLU A 425 16.222 24.987 4.767 1.00 42.04 H new ATOM 0 HB3 GLU A 425 17.426 24.953 3.494 1.00 42.04 H new ATOM 0 HG2 GLU A 425 15.237 25.315 2.526 1.00 22.30 H new ATOM 0 HG3 GLU A 425 15.843 23.752 2.018 1.00 22.30 H new ATOM 1062 N ASN A 426 16.751 21.543 2.609 1.00 14.14 N ATOM 1063 CA ASN A 426 17.137 20.724 1.488 1.00 61.14 C ATOM 1064 C ASN A 426 17.257 21.587 0.259 1.00 13.34 C ATOM 1065 O ASN A 426 16.414 22.456 0.017 1.00 72.21 O ATOM 1066 CB ASN A 426 16.146 19.560 1.238 1.00 34.53 C ATOM 1067 CG ASN A 426 14.740 20.004 0.853 1.00 74.40 C ATOM 1068 OD1 ASN A 426 14.415 20.173 -0.314 1.00 71.25 O ATOM 1069 ND2 ASN A 426 13.908 20.216 1.818 1.00 61.20 N ATOM 0 H ASN A 426 15.747 21.570 2.788 1.00 14.14 H new ATOM 0 HA ASN A 426 18.101 20.270 1.720 1.00 61.14 H new ATOM 0 HB2 ASN A 426 16.543 18.924 0.447 1.00 34.53 H new ATOM 0 HB3 ASN A 426 16.087 18.949 2.139 1.00 34.53 H new ATOM 0 HD21 ASN A 426 12.959 20.530 1.614 1.00 61.20 H new ATOM 0 HD22 ASN A 426 14.200 20.069 2.784 1.00 61.20 H new ATOM 1076 N GLU A 427 18.309 21.393 -0.486 1.00 71.13 N ATOM 1077 CA GLU A 427 18.514 22.137 -1.699 1.00 64.51 C ATOM 1078 C GLU A 427 19.522 21.434 -2.558 1.00 23.10 C ATOM 1079 O GLU A 427 20.503 20.871 -2.049 1.00 61.54 O ATOM 1080 CB GLU A 427 18.985 23.579 -1.403 1.00 14.04 C ATOM 1081 CG GLU A 427 19.131 24.454 -2.650 1.00 42.54 C ATOM 1082 CD GLU A 427 19.525 25.869 -2.330 1.00 44.13 C ATOM 1083 OE1 GLU A 427 18.699 26.596 -1.745 1.00 23.12 O ATOM 1084 OE2 GLU A 427 20.654 26.293 -2.675 1.00 62.41 O ATOM 0 H GLU A 427 19.045 20.720 -0.272 1.00 71.13 H new ATOM 0 HA GLU A 427 17.562 22.198 -2.226 1.00 64.51 H new ATOM 0 HB2 GLU A 427 18.275 24.050 -0.722 1.00 14.04 H new ATOM 0 HB3 GLU A 427 19.944 23.538 -0.886 1.00 14.04 H new ATOM 0 HG2 GLU A 427 19.879 24.015 -3.310 1.00 42.54 H new ATOM 0 HG3 GLU A 427 18.188 24.460 -3.196 1.00 42.54 H new ATOM 1091 N ILE A 428 19.267 21.425 -3.836 1.00 45.03 N ATOM 1092 CA ILE A 428 20.191 20.898 -4.787 1.00 15.34 C ATOM 1093 C ILE A 428 21.120 22.017 -5.147 1.00 72.31 C ATOM 1094 O ILE A 428 20.701 23.012 -5.730 1.00 1.03 O ATOM 1095 CB ILE A 428 19.480 20.393 -6.063 1.00 30.11 C ATOM 1096 CG1 ILE A 428 18.419 19.344 -5.712 1.00 21.05 C ATOM 1097 CG2 ILE A 428 20.492 19.829 -7.057 1.00 10.41 C ATOM 1098 CD1 ILE A 428 17.613 18.855 -6.898 1.00 3.43 C ATOM 0 H ILE A 428 18.405 21.787 -4.245 1.00 45.03 H new ATOM 0 HA ILE A 428 20.717 20.046 -4.356 1.00 15.34 H new ATOM 0 HB ILE A 428 18.979 21.239 -6.533 1.00 30.11 H new ATOM 0 HG12 ILE A 428 18.909 18.491 -5.243 1.00 21.05 H new ATOM 0 HG13 ILE A 428 17.738 19.766 -4.973 1.00 21.05 H new ATOM 0 HG21 ILE A 428 19.971 19.479 -7.948 1.00 10.41 H new ATOM 0 HG22 ILE A 428 21.202 20.608 -7.335 1.00 10.41 H new ATOM 0 HG23 ILE A 428 21.027 18.997 -6.599 1.00 10.41 H new ATOM 0 HD11 ILE A 428 16.885 18.116 -6.563 1.00 3.43 H new ATOM 0 HD12 ILE A 428 17.092 19.696 -7.355 1.00 3.43 H new ATOM 0 HD13 ILE A 428 18.281 18.401 -7.630 1.00 3.43 H new ATOM 1110 N VAL A 429 22.352 21.871 -4.784 1.00 63.50 N ATOM 1111 CA VAL A 429 23.322 22.895 -5.025 1.00 2.41 C ATOM 1112 C VAL A 429 23.737 22.836 -6.484 1.00 60.33 C ATOM 1113 O VAL A 429 23.730 23.854 -7.191 1.00 64.12 O ATOM 1114 CB VAL A 429 24.559 22.718 -4.107 1.00 41.30 C ATOM 1115 CG1 VAL A 429 25.558 23.837 -4.319 1.00 13.43 C ATOM 1116 CG2 VAL A 429 24.138 22.642 -2.641 1.00 72.11 C ATOM 0 H VAL A 429 22.716 21.043 -4.313 1.00 63.50 H new ATOM 0 HA VAL A 429 22.882 23.867 -4.801 1.00 2.41 H new ATOM 0 HB VAL A 429 25.043 21.779 -4.374 1.00 41.30 H new ATOM 0 HG11 VAL A 429 26.416 23.688 -3.663 1.00 13.43 H new ATOM 0 HG12 VAL A 429 25.891 23.836 -5.357 1.00 13.43 H new ATOM 0 HG13 VAL A 429 25.087 24.793 -4.090 1.00 13.43 H new ATOM 0 HG21 VAL A 429 25.021 22.518 -2.015 1.00 72.11 H new ATOM 0 HG22 VAL A 429 23.622 23.561 -2.363 1.00 72.11 H new ATOM 0 HG23 VAL A 429 23.470 21.793 -2.498 1.00 72.11 H new ATOM 1126 N SER A 430 24.054 21.640 -6.937 1.00 10.54 N ATOM 1127 CA SER A 430 24.437 21.417 -8.301 1.00 12.14 C ATOM 1128 C SER A 430 24.448 19.917 -8.567 1.00 30.32 C ATOM 1129 O SER A 430 24.339 19.115 -7.629 1.00 12.44 O ATOM 1130 CB SER A 430 25.833 22.025 -8.575 1.00 43.14 C ATOM 1131 OG SER A 430 26.173 21.949 -9.955 1.00 11.15 O ATOM 0 H SER A 430 24.051 20.798 -6.361 1.00 10.54 H new ATOM 0 HA SER A 430 23.723 21.902 -8.967 1.00 12.14 H new ATOM 0 HB2 SER A 430 25.847 23.066 -8.252 1.00 43.14 H new ATOM 0 HB3 SER A 430 26.583 21.498 -7.985 1.00 43.14 H new ATOM 0 HG SER A 430 27.059 22.343 -10.096 1.00 11.15 H new ATOM 1137 N VAL A 431 24.547 19.553 -9.823 1.00 43.42 N ATOM 1138 CA VAL A 431 24.643 18.174 -10.251 1.00 15.45 C ATOM 1139 C VAL A 431 25.693 18.131 -11.340 1.00 72.14 C ATOM 1140 O VAL A 431 25.630 18.927 -12.283 1.00 51.03 O ATOM 1141 CB VAL A 431 23.296 17.628 -10.817 1.00 13.11 C ATOM 1142 CG1 VAL A 431 23.445 16.174 -11.231 1.00 43.13 C ATOM 1143 CG2 VAL A 431 22.166 17.771 -9.805 1.00 62.24 C ATOM 0 H VAL A 431 24.564 20.220 -10.594 1.00 43.42 H new ATOM 0 HA VAL A 431 24.900 17.549 -9.395 1.00 15.45 H new ATOM 0 HB VAL A 431 23.041 18.224 -11.693 1.00 13.11 H new ATOM 0 HG11 VAL A 431 22.496 15.808 -11.624 1.00 43.13 H new ATOM 0 HG12 VAL A 431 24.212 16.092 -12.001 1.00 43.13 H new ATOM 0 HG13 VAL A 431 23.734 15.577 -10.366 1.00 43.13 H new ATOM 0 HG21 VAL A 431 21.243 17.381 -10.233 1.00 62.24 H new ATOM 0 HG22 VAL A 431 22.413 17.211 -8.903 1.00 62.24 H new ATOM 0 HG23 VAL A 431 22.033 18.823 -9.554 1.00 62.24 H new ATOM 1153 N LEU A 432 26.654 17.251 -11.221 1.00 60.55 N ATOM 1154 CA LEU A 432 27.737 17.220 -12.178 1.00 41.10 C ATOM 1155 C LEU A 432 27.943 15.831 -12.756 1.00 72.24 C ATOM 1156 O LEU A 432 28.028 14.837 -12.020 1.00 70.03 O ATOM 1157 CB LEU A 432 29.034 17.725 -11.523 1.00 5.32 C ATOM 1158 CG LEU A 432 30.277 17.797 -12.425 1.00 13.01 C ATOM 1159 CD1 LEU A 432 30.067 18.770 -13.578 1.00 25.31 C ATOM 1160 CD2 LEU A 432 31.501 18.183 -11.613 1.00 35.42 C ATOM 0 H LEU A 432 26.712 16.552 -10.480 1.00 60.55 H new ATOM 0 HA LEU A 432 27.469 17.879 -13.003 1.00 41.10 H new ATOM 0 HB2 LEU A 432 28.847 18.720 -11.120 1.00 5.32 H new ATOM 0 HB3 LEU A 432 29.264 17.077 -10.677 1.00 5.32 H new ATOM 0 HG LEU A 432 30.441 16.807 -12.851 1.00 13.01 H new ATOM 0 HD11 LEU A 432 30.963 18.799 -14.198 1.00 25.31 H new ATOM 0 HD12 LEU A 432 29.220 18.443 -14.180 1.00 25.31 H new ATOM 0 HD13 LEU A 432 29.868 19.766 -13.182 1.00 25.31 H new ATOM 0 HD21 LEU A 432 32.372 18.229 -12.267 1.00 35.42 H new ATOM 0 HD22 LEU A 432 31.340 19.158 -11.153 1.00 35.42 H new ATOM 0 HD23 LEU A 432 31.671 17.439 -10.835 1.00 35.42 H new ATOM 1172 N GLU A 433 28.011 15.760 -14.066 1.00 51.32 N ATOM 1173 CA GLU A 433 28.294 14.525 -14.760 1.00 40.20 C ATOM 1174 C GLU A 433 29.813 14.340 -14.822 1.00 3.43 C ATOM 1175 O GLU A 433 30.458 14.644 -15.826 1.00 4.31 O ATOM 1176 CB GLU A 433 27.675 14.541 -16.172 1.00 55.32 C ATOM 1177 CG GLU A 433 27.896 13.282 -17.005 1.00 23.43 C ATOM 1178 CD GLU A 433 27.295 13.408 -18.387 1.00 43.23 C ATOM 1179 OE1 GLU A 433 27.927 14.018 -19.272 1.00 12.34 O ATOM 1180 OE2 GLU A 433 26.175 12.924 -18.607 1.00 73.22 O ATOM 0 H GLU A 433 27.871 16.561 -14.682 1.00 51.32 H new ATOM 0 HA GLU A 433 27.850 13.686 -14.224 1.00 40.20 H new ATOM 0 HB2 GLU A 433 26.602 14.708 -16.077 1.00 55.32 H new ATOM 0 HB3 GLU A 433 28.083 15.392 -16.718 1.00 55.32 H new ATOM 0 HG2 GLU A 433 28.965 13.086 -17.090 1.00 23.43 H new ATOM 0 HG3 GLU A 433 27.455 12.426 -16.494 1.00 23.43 H new ATOM 1187 N ALA A 434 30.380 13.927 -13.717 1.00 31.11 N ATOM 1188 CA ALA A 434 31.822 13.756 -13.618 1.00 43.31 C ATOM 1189 C ALA A 434 32.189 12.295 -13.616 1.00 4.22 C ATOM 1190 O ALA A 434 33.351 11.928 -13.464 1.00 40.33 O ATOM 1191 CB ALA A 434 32.334 14.424 -12.364 1.00 3.22 C ATOM 0 H ALA A 434 29.869 13.700 -12.864 1.00 31.11 H new ATOM 0 HA ALA A 434 32.286 14.223 -14.487 1.00 43.31 H new ATOM 0 HB1 ALA A 434 33.414 14.292 -12.296 1.00 3.22 H new ATOM 0 HB2 ALA A 434 32.100 15.488 -12.397 1.00 3.22 H new ATOM 0 HB3 ALA A 434 31.858 13.975 -11.492 1.00 3.22 H new ATOM 1197 N GLN A 435 31.202 11.466 -13.774 1.00 3.14 N ATOM 1198 CA GLN A 435 31.396 10.045 -13.806 1.00 12.44 C ATOM 1199 C GLN A 435 30.673 9.483 -15.006 1.00 2.14 C ATOM 1200 O GLN A 435 29.950 10.217 -15.680 1.00 13.14 O ATOM 1201 CB GLN A 435 30.883 9.396 -12.522 1.00 21.43 C ATOM 1202 CG GLN A 435 31.574 9.884 -11.251 1.00 33.54 C ATOM 1203 CD GLN A 435 31.050 9.214 -9.997 1.00 32.44 C ATOM 1204 OE1 GLN A 435 29.801 8.846 -10.008 1.00 42.24 O flip ATOM 1205 NE2 GLN A 435 31.777 9.044 -9.016 1.00 72.44 N flip ATOM 0 H GLN A 435 30.231 11.757 -13.885 1.00 3.14 H new ATOM 0 HA GLN A 435 32.461 9.828 -13.882 1.00 12.44 H new ATOM 0 HB2 GLN A 435 29.813 9.586 -12.435 1.00 21.43 H new ATOM 0 HB3 GLN A 435 31.010 8.316 -12.599 1.00 21.43 H new ATOM 0 HG2 GLN A 435 32.645 9.701 -11.333 1.00 33.54 H new ATOM 0 HG3 GLN A 435 31.441 10.962 -11.163 1.00 33.54 H new ATOM 0 HE21 GLN A 435 32.751 9.346 -9.045 1.00 72.44 H new ATOM 0 HE22 GLN A 435 31.405 8.602 -8.176 1.00 72.44 H new ATOM 1214 N LYS A 436 30.875 8.200 -15.259 1.00 54.42 N ATOM 1215 CA LYS A 436 30.275 7.463 -16.390 1.00 2.14 C ATOM 1216 C LYS A 436 28.737 7.502 -16.446 1.00 33.31 C ATOM 1217 O LYS A 436 28.058 6.590 -16.009 1.00 13.31 O ATOM 1218 CB LYS A 436 30.864 6.028 -16.476 1.00 44.14 C ATOM 1219 CG LYS A 436 31.073 5.298 -15.108 1.00 34.31 C ATOM 1220 CD LYS A 436 29.785 4.925 -14.358 1.00 75.21 C ATOM 1221 CE LYS A 436 29.002 3.832 -15.083 1.00 71.42 C ATOM 1222 NZ LYS A 436 29.780 2.579 -15.186 1.00 65.03 N ATOM 0 H LYS A 436 31.474 7.616 -14.676 1.00 54.42 H new ATOM 0 HA LYS A 436 30.562 7.999 -17.295 1.00 2.14 H new ATOM 0 HB2 LYS A 436 30.203 5.420 -17.094 1.00 44.14 H new ATOM 0 HB3 LYS A 436 31.824 6.079 -16.990 1.00 44.14 H new ATOM 0 HG2 LYS A 436 31.647 4.388 -15.285 1.00 34.31 H new ATOM 0 HG3 LYS A 436 31.677 5.936 -14.463 1.00 34.31 H new ATOM 0 HD2 LYS A 436 30.035 4.587 -13.352 1.00 75.21 H new ATOM 0 HD3 LYS A 436 29.158 5.810 -14.250 1.00 75.21 H new ATOM 0 HE2 LYS A 436 28.070 3.639 -14.552 1.00 71.42 H new ATOM 0 HE3 LYS A 436 28.734 4.177 -16.082 1.00 71.42 H new ATOM 0 HZ1 LYS A 436 29.140 1.791 -15.413 1.00 65.03 H new ATOM 0 HZ2 LYS A 436 30.493 2.674 -15.937 1.00 65.03 H new ATOM 0 HZ3 LYS A 436 30.255 2.390 -14.280 1.00 65.03 H new ATOM 1236 N CYS A 437 28.207 8.614 -16.952 1.00 40.14 N ATOM 1237 CA CYS A 437 26.765 8.859 -17.023 1.00 51.41 C ATOM 1238 C CYS A 437 26.148 8.822 -15.631 1.00 1.52 C ATOM 1239 O CYS A 437 24.933 8.674 -15.472 1.00 42.10 O ATOM 1240 CB CYS A 437 26.083 7.863 -17.959 1.00 30.30 C ATOM 1241 SG CYS A 437 26.737 7.921 -19.655 1.00 54.31 S ATOM 0 H CYS A 437 28.770 9.377 -17.328 1.00 40.14 H new ATOM 0 HA CYS A 437 26.608 9.855 -17.436 1.00 51.41 H new ATOM 0 HB2 CYS A 437 26.207 6.856 -17.562 1.00 30.30 H new ATOM 0 HB3 CYS A 437 25.013 8.067 -17.981 1.00 30.30 H new ATOM 1246 N GLU A 438 26.990 9.000 -14.634 1.00 45.22 N ATOM 1247 CA GLU A 438 26.559 8.998 -13.286 1.00 33.21 C ATOM 1248 C GLU A 438 26.678 10.400 -12.756 1.00 41.12 C ATOM 1249 O GLU A 438 27.765 11.005 -12.762 1.00 24.13 O ATOM 1250 CB GLU A 438 27.326 7.967 -12.451 1.00 31.54 C ATOM 1251 CG GLU A 438 26.758 7.788 -11.044 1.00 60.11 C ATOM 1252 CD GLU A 438 27.265 6.542 -10.379 1.00 45.24 C ATOM 1253 OE1 GLU A 438 26.742 5.449 -10.685 1.00 53.01 O ATOM 1254 OE2 GLU A 438 28.192 6.614 -9.570 1.00 10.02 O ATOM 0 H GLU A 438 27.992 9.149 -14.755 1.00 45.22 H new ATOM 0 HA GLU A 438 25.515 8.690 -13.221 1.00 33.21 H new ATOM 0 HB2 GLU A 438 27.310 7.007 -12.967 1.00 31.54 H new ATOM 0 HB3 GLU A 438 28.370 8.272 -12.378 1.00 31.54 H new ATOM 0 HG2 GLU A 438 27.020 8.654 -10.436 1.00 60.11 H new ATOM 0 HG3 GLU A 438 25.670 7.752 -11.096 1.00 60.11 H new ATOM 1261 N TYR A 439 25.572 10.912 -12.334 1.00 61.33 N ATOM 1262 CA TYR A 439 25.438 12.286 -11.963 1.00 51.10 C ATOM 1263 C TYR A 439 25.619 12.483 -10.482 1.00 64.20 C ATOM 1264 O TYR A 439 24.898 11.898 -9.668 1.00 35.14 O ATOM 1265 CB TYR A 439 24.071 12.809 -12.452 1.00 60.32 C ATOM 1266 CG TYR A 439 23.932 12.705 -13.948 1.00 64.12 C ATOM 1267 CD1 TYR A 439 23.474 11.536 -14.528 1.00 2.22 C ATOM 1268 CD2 TYR A 439 24.290 13.749 -14.780 1.00 3.41 C ATOM 1269 CE1 TYR A 439 23.374 11.406 -15.883 1.00 0.41 C ATOM 1270 CE2 TYR A 439 24.199 13.620 -16.151 1.00 13.03 C ATOM 1271 CZ TYR A 439 23.739 12.438 -16.692 1.00 12.15 C ATOM 1272 OH TYR A 439 23.664 12.285 -18.058 1.00 21.23 O ATOM 0 H TYR A 439 24.711 10.375 -12.234 1.00 61.33 H new ATOM 0 HA TYR A 439 26.228 12.864 -12.442 1.00 51.10 H new ATOM 0 HB2 TYR A 439 23.273 12.242 -11.973 1.00 60.32 H new ATOM 0 HB3 TYR A 439 23.950 13.849 -12.148 1.00 60.32 H new ATOM 0 HD1 TYR A 439 23.189 10.708 -13.895 1.00 2.22 H new ATOM 0 HD2 TYR A 439 24.645 14.675 -14.353 1.00 3.41 H new ATOM 0 HE1 TYR A 439 23.006 10.486 -16.312 1.00 0.41 H new ATOM 0 HE2 TYR A 439 24.486 14.438 -16.795 1.00 13.03 H new ATOM 0 HH TYR A 439 24.450 12.694 -18.477 1.00 21.23 H new ATOM 1282 N LEU A 440 26.600 13.292 -10.140 1.00 53.31 N ATOM 1283 CA LEU A 440 26.895 13.621 -8.767 1.00 10.01 C ATOM 1284 C LEU A 440 25.911 14.679 -8.333 1.00 61.34 C ATOM 1285 O LEU A 440 25.956 15.804 -8.832 1.00 51.43 O ATOM 1286 CB LEU A 440 28.304 14.229 -8.650 1.00 13.11 C ATOM 1287 CG LEU A 440 29.476 13.421 -9.200 1.00 30.21 C ATOM 1288 CD1 LEU A 440 30.758 14.219 -9.068 1.00 74.35 C ATOM 1289 CD2 LEU A 440 29.612 12.102 -8.482 1.00 75.52 C ATOM 0 H LEU A 440 27.218 13.742 -10.815 1.00 53.31 H new ATOM 0 HA LEU A 440 26.834 12.720 -8.157 1.00 10.01 H new ATOM 0 HB2 LEU A 440 28.295 15.194 -9.157 1.00 13.11 H new ATOM 0 HB3 LEU A 440 28.498 14.425 -7.595 1.00 13.11 H new ATOM 0 HG LEU A 440 29.285 13.214 -10.253 1.00 30.21 H new ATOM 0 HD11 LEU A 440 31.591 13.637 -9.462 1.00 74.35 H new ATOM 0 HD12 LEU A 440 30.667 15.149 -9.629 1.00 74.35 H new ATOM 0 HD13 LEU A 440 30.939 14.446 -8.017 1.00 74.35 H new ATOM 0 HD21 LEU A 440 30.455 11.548 -8.895 1.00 75.52 H new ATOM 0 HD22 LEU A 440 29.781 12.281 -7.420 1.00 75.52 H new ATOM 0 HD23 LEU A 440 28.698 11.522 -8.611 1.00 75.52 H new ATOM 1301 N ILE A 441 25.024 14.336 -7.467 1.00 34.21 N ATOM 1302 CA ILE A 441 24.057 15.276 -6.981 1.00 2.40 C ATOM 1303 C ILE A 441 24.569 15.842 -5.682 1.00 74.31 C ATOM 1304 O ILE A 441 24.829 15.103 -4.742 1.00 13.13 O ATOM 1305 CB ILE A 441 22.696 14.600 -6.755 1.00 61.31 C ATOM 1306 CG1 ILE A 441 22.245 13.906 -8.037 1.00 54.52 C ATOM 1307 CG2 ILE A 441 21.663 15.636 -6.327 1.00 54.33 C ATOM 1308 CD1 ILE A 441 20.972 13.129 -7.884 1.00 0.31 C ATOM 0 H ILE A 441 24.942 13.399 -7.071 1.00 34.21 H new ATOM 0 HA ILE A 441 23.916 16.067 -7.717 1.00 2.40 H new ATOM 0 HB ILE A 441 22.794 13.856 -5.964 1.00 61.31 H new ATOM 0 HG12 ILE A 441 22.112 14.655 -8.818 1.00 54.52 H new ATOM 0 HG13 ILE A 441 23.034 13.232 -8.372 1.00 54.52 H new ATOM 0 HG21 ILE A 441 20.701 15.147 -6.169 1.00 54.33 H new ATOM 0 HG22 ILE A 441 21.986 16.110 -5.400 1.00 54.33 H new ATOM 0 HG23 ILE A 441 21.562 16.392 -7.105 1.00 54.33 H new ATOM 0 HD11 ILE A 441 20.713 12.663 -8.835 1.00 0.31 H new ATOM 0 HD12 ILE A 441 21.106 12.357 -7.126 1.00 0.31 H new ATOM 0 HD13 ILE A 441 20.170 13.801 -7.579 1.00 0.31 H new ATOM 1320 N LYS A 442 24.726 17.124 -5.633 1.00 15.22 N ATOM 1321 CA LYS A 442 25.300 17.766 -4.488 1.00 65.24 C ATOM 1322 C LYS A 442 24.159 18.478 -3.747 1.00 12.41 C ATOM 1323 O LYS A 442 23.550 19.416 -4.280 1.00 23.21 O ATOM 1324 CB LYS A 442 26.362 18.742 -5.041 1.00 62.33 C ATOM 1325 CG LYS A 442 27.525 19.117 -4.132 1.00 72.32 C ATOM 1326 CD LYS A 442 27.177 20.031 -2.989 1.00 13.12 C ATOM 1327 CE LYS A 442 28.450 20.355 -2.222 1.00 13.04 C ATOM 1328 NZ LYS A 442 28.269 21.401 -1.217 1.00 1.22 N ATOM 0 H LYS A 442 24.461 17.760 -6.385 1.00 15.22 H new ATOM 0 HA LYS A 442 25.778 17.088 -3.781 1.00 65.24 H new ATOM 0 HB2 LYS A 442 26.775 18.307 -5.951 1.00 62.33 H new ATOM 0 HB3 LYS A 442 25.853 19.662 -5.330 1.00 62.33 H new ATOM 0 HG2 LYS A 442 27.957 18.202 -3.726 1.00 72.32 H new ATOM 0 HG3 LYS A 442 28.297 19.594 -4.735 1.00 72.32 H new ATOM 0 HD2 LYS A 442 26.717 20.946 -3.363 1.00 13.12 H new ATOM 0 HD3 LYS A 442 26.450 19.554 -2.331 1.00 13.12 H new ATOM 0 HE2 LYS A 442 28.812 19.450 -1.734 1.00 13.04 H new ATOM 0 HE3 LYS A 442 29.221 20.667 -2.926 1.00 13.04 H new ATOM 0 HZ1 LYS A 442 29.096 21.424 -0.587 1.00 1.22 H new ATOM 0 HZ2 LYS A 442 28.168 22.322 -1.689 1.00 1.22 H new ATOM 0 HZ3 LYS A 442 27.414 21.202 -0.659 1.00 1.22 H new ATOM 1342 N MET A 443 23.856 18.015 -2.538 1.00 71.54 N ATOM 1343 CA MET A 443 22.729 18.505 -1.772 1.00 73.11 C ATOM 1344 C MET A 443 23.053 18.614 -0.328 1.00 73.54 C ATOM 1345 O MET A 443 24.135 18.245 0.129 1.00 23.44 O ATOM 1346 CB MET A 443 21.497 17.581 -1.877 1.00 44.35 C ATOM 1347 CG MET A 443 20.746 17.609 -3.178 1.00 65.44 C ATOM 1348 SD MET A 443 19.286 16.546 -3.149 1.00 21.12 S ATOM 1349 CE MET A 443 18.334 17.274 -1.792 1.00 35.32 C ATOM 0 H MET A 443 24.391 17.286 -2.066 1.00 71.54 H new ATOM 0 HA MET A 443 22.504 19.483 -2.198 1.00 73.11 H new ATOM 0 HB2 MET A 443 21.822 16.557 -1.693 1.00 44.35 H new ATOM 0 HB3 MET A 443 20.804 17.844 -1.078 1.00 44.35 H new ATOM 0 HG2 MET A 443 20.443 18.633 -3.398 1.00 65.44 H new ATOM 0 HG3 MET A 443 21.408 17.292 -3.984 1.00 65.44 H new ATOM 0 HE1 MET A 443 17.324 16.864 -1.795 1.00 35.32 H new ATOM 0 HE2 MET A 443 18.817 17.041 -0.843 1.00 35.32 H new ATOM 0 HE3 MET A 443 18.287 18.355 -1.920 1.00 35.32 H new ATOM 1359 N LYS A 444 22.091 19.091 0.383 1.00 63.22 N ATOM 1360 CA LYS A 444 22.140 19.230 1.782 1.00 35.21 C ATOM 1361 C LYS A 444 20.729 19.143 2.291 1.00 73.34 C ATOM 1362 O LYS A 444 19.804 19.525 1.575 1.00 63.20 O ATOM 1363 CB LYS A 444 22.752 20.566 2.138 1.00 2.43 C ATOM 1364 CG LYS A 444 22.022 21.758 1.599 1.00 31.41 C ATOM 1365 CD LYS A 444 22.810 22.972 1.894 1.00 72.14 C ATOM 1366 CE LYS A 444 22.018 24.222 1.597 1.00 63.25 C ATOM 1367 NZ LYS A 444 22.754 25.444 1.967 1.00 61.34 N ATOM 0 H LYS A 444 21.210 19.407 -0.023 1.00 63.22 H new ATOM 0 HA LYS A 444 22.752 18.449 2.234 1.00 35.21 H new ATOM 0 HB2 LYS A 444 22.801 20.649 3.224 1.00 2.43 H new ATOM 0 HB3 LYS A 444 23.778 20.589 1.770 1.00 2.43 H new ATOM 0 HG2 LYS A 444 21.874 21.656 0.524 1.00 31.41 H new ATOM 0 HG3 LYS A 444 21.033 21.831 2.051 1.00 31.41 H new ATOM 0 HD2 LYS A 444 23.110 22.969 2.942 1.00 72.14 H new ATOM 0 HD3 LYS A 444 23.725 22.968 1.301 1.00 72.14 H new ATOM 0 HE2 LYS A 444 21.775 24.253 0.535 1.00 63.25 H new ATOM 0 HE3 LYS A 444 21.073 24.190 2.140 1.00 63.25 H new ATOM 0 HZ1 LYS A 444 22.174 26.279 1.746 1.00 61.34 H new ATOM 0 HZ2 LYS A 444 22.964 25.428 2.985 1.00 61.34 H new ATOM 0 HZ3 LYS A 444 23.644 25.489 1.431 1.00 61.34 H new ATOM 1381 N SER A 445 20.555 18.595 3.468 1.00 53.50 N ATOM 1382 CA SER A 445 19.260 18.503 4.091 1.00 21.55 C ATOM 1383 C SER A 445 19.437 18.049 5.527 1.00 73.41 C ATOM 1384 O SER A 445 20.399 17.329 5.836 1.00 3.43 O ATOM 1385 CB SER A 445 18.353 17.506 3.326 1.00 23.34 C ATOM 1386 OG SER A 445 18.923 16.205 3.286 1.00 34.42 O ATOM 0 H SER A 445 21.313 18.198 4.023 1.00 53.50 H new ATOM 0 HA SER A 445 18.780 19.482 4.068 1.00 21.55 H new ATOM 0 HB2 SER A 445 17.375 17.461 3.806 1.00 23.34 H new ATOM 0 HB3 SER A 445 18.193 17.865 2.309 1.00 23.34 H new ATOM 0 HG SER A 445 18.325 15.601 2.798 1.00 34.42 H new ATOM 1392 N PRO A 446 18.564 18.492 6.444 1.00 24.53 N ATOM 1393 CA PRO A 446 18.578 18.015 7.836 1.00 25.20 C ATOM 1394 C PRO A 446 18.171 16.534 7.921 1.00 71.12 C ATOM 1395 O PRO A 446 18.489 15.836 8.886 1.00 43.13 O ATOM 1396 CB PRO A 446 17.522 18.897 8.525 1.00 20.22 C ATOM 1397 CG PRO A 446 16.637 19.357 7.416 1.00 34.52 C ATOM 1398 CD PRO A 446 17.537 19.543 6.236 1.00 3.52 C ATOM 0 HA PRO A 446 19.566 18.082 8.292 1.00 25.20 H new ATOM 0 HB2 PRO A 446 16.962 18.335 9.272 1.00 20.22 H new ATOM 0 HB3 PRO A 446 17.984 19.740 9.040 1.00 20.22 H new ATOM 0 HG2 PRO A 446 15.860 18.623 7.204 1.00 34.52 H new ATOM 0 HG3 PRO A 446 16.134 20.288 7.676 1.00 34.52 H new ATOM 0 HD2 PRO A 446 17.004 19.409 5.295 1.00 3.52 H new ATOM 0 HD3 PRO A 446 17.976 20.540 6.214 1.00 3.52 H new ATOM 1406 N ALA A 447 17.523 16.062 6.863 1.00 51.23 N ATOM 1407 CA ALA A 447 16.990 14.716 6.790 1.00 22.24 C ATOM 1408 C ALA A 447 18.086 13.669 6.780 1.00 45.15 C ATOM 1409 O ALA A 447 17.949 12.624 7.400 1.00 43.42 O ATOM 1410 CB ALA A 447 16.103 14.566 5.563 1.00 61.11 C ATOM 0 H ALA A 447 17.353 16.614 6.023 1.00 51.23 H new ATOM 0 HA ALA A 447 16.393 14.552 7.687 1.00 22.24 H new ATOM 0 HB1 ALA A 447 15.709 13.550 5.521 1.00 61.11 H new ATOM 0 HB2 ALA A 447 15.276 15.273 5.623 1.00 61.11 H new ATOM 0 HB3 ALA A 447 16.687 14.767 4.665 1.00 61.11 H new ATOM 1416 N ALA A 448 19.186 13.961 6.110 1.00 22.10 N ATOM 1417 CA ALA A 448 20.258 12.998 5.996 1.00 11.11 C ATOM 1418 C ALA A 448 21.345 13.341 6.977 1.00 22.00 C ATOM 1419 O ALA A 448 22.290 12.585 7.186 1.00 14.14 O ATOM 1420 CB ALA A 448 20.790 13.007 4.594 1.00 54.25 C ATOM 0 H ALA A 448 19.357 14.851 5.641 1.00 22.10 H new ATOM 0 HA ALA A 448 19.885 11.999 6.222 1.00 11.11 H new ATOM 0 HB1 ALA A 448 21.598 12.281 4.507 1.00 54.25 H new ATOM 0 HB2 ALA A 448 19.991 12.745 3.900 1.00 54.25 H new ATOM 0 HB3 ALA A 448 21.168 14.001 4.354 1.00 54.25 H new ATOM 1426 N CYS A 449 21.188 14.489 7.588 1.00 3.05 N ATOM 1427 CA CYS A 449 22.132 15.003 8.548 1.00 31.05 C ATOM 1428 C CYS A 449 21.939 14.315 9.898 1.00 64.42 C ATOM 1429 O CYS A 449 22.784 14.405 10.792 1.00 75.24 O ATOM 1430 CB CYS A 449 21.900 16.495 8.691 1.00 42.21 C ATOM 1431 SG CYS A 449 23.071 17.374 9.757 1.00 2.44 S ATOM 0 H CYS A 449 20.388 15.102 7.430 1.00 3.05 H new ATOM 0 HA CYS A 449 23.150 14.811 8.208 1.00 31.05 H new ATOM 0 HB2 CYS A 449 21.931 16.946 7.699 1.00 42.21 H new ATOM 0 HB3 CYS A 449 20.894 16.652 9.081 1.00 42.21 H new ATOM 1436 N SER A 450 20.833 13.640 10.032 1.00 3.41 N ATOM 1437 CA SER A 450 20.502 12.954 11.236 1.00 22.33 C ATOM 1438 C SER A 450 21.183 11.586 11.250 1.00 20.21 C ATOM 1439 O SER A 450 22.207 11.425 11.945 1.00 37.22 O ATOM 1440 CB SER A 450 18.986 12.836 11.352 1.00 73.31 C ATOM 1441 OG SER A 450 18.380 14.136 11.322 1.00 35.21 O ATOM 1442 OXT SER A 450 20.742 10.687 10.512 1.00 37.22 O ATOM 0 H SER A 450 20.132 13.553 9.297 1.00 3.41 H new ATOM 0 HA SER A 450 20.862 13.512 12.100 1.00 22.33 H new ATOM 0 HB2 SER A 450 18.598 12.228 10.534 1.00 73.31 H new ATOM 0 HB3 SER A 450 18.724 12.327 12.280 1.00 73.31 H new ATOM 0 HG SER A 450 18.507 14.536 10.436 1.00 35.21 H new TER 1448 SER A 450