USER MOD reduce.3.24.130724 H: found=0, std=0, add=764, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 764 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 Single : A 0 MET CE :methyl 168:sc=-0.000286 (180deg=-0.175) USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -3 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 398 GLN : amide:sc= 0.597 K(o=0.6,f=-2.9!) USER MOD Single : A 399 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 406 ASN : amide:sc= -0.556 K(o=-0.56,f=-1.5) USER MOD Single : A 410 TYR OH : rot 30:sc= 0 USER MOD Single : A 411 HIS : no HD1:sc= 0 K(o=0,f=-1.7) USER MOD Single : A 414 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 419 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 423 GLN : amide:sc= -0.0845 K(o=-0.084,f=-0.77) USER MOD Single : A 424 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 426 MET CE :methyl 161:sc= -1.68 (180deg=-3!) USER MOD Single : A 430 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 433 SER OG : rot -160:sc= -0.143 USER MOD Single : A 435 LYS NZ :NH3+ -164:sc= 0.554 (180deg=-0.487) USER MOD Single : A 440 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 GLN : amide:sc= -0.0179 K(o=-0.018,f=-1.1) USER MOD Single : A 442 THR OG1 : rot 180:sc= 0 USER MOD Single : A 443 ASN : amide:sc= 0 X(o=0,f=0.006) USER MOD Single : A 445 SER OG : rot 180:sc= 0 USER MOD Single : A 446 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 447 CYS SG : rot -15:sc= 0.834 USER MOD Single : A 452 SER OG : rot 180:sc= 0 USER MOD Single : A 453 TYR OH : rot 65:sc= -0.224 USER MOD Single : A 455 ASN : amide:sc= -0.74 K(o=-0.74,f=-3.7!) USER MOD Single : A 458 SER OG : rot 118:sc= 0.852 USER MOD Single : A 460 GLN : amide:sc= -0.57 K(o=-0.57,f=-3.9!) USER MOD Single : A 464 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 466 MET CE :methyl -169:sc= 0 (180deg=-0.0121) USER MOD Single : A 467 ASN : amide:sc= -0.008 K(o=-0.008,f=-1) USER MOD Single : A 470 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 473 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 477 LYS NZ :NH3+ -175:sc=-0.00947 (180deg=-0.0779) USER MOD Single : A 479 GLN : amide:sc= -0.24 K(o=-0.24,f=-2.3!) USER MOD Single : A 481 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0181) USER MOD Single : A 483 SER OG : rot 180:sc= 0 USER MOD Single : A 484 LYS NZ :NH3+ 162:sc= -0.0661 (180deg=-0.413) USER MOD Single : A 485 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 487 SER OG : rot 180:sc= 0 USER MOD Single : A 488 LYS NZ :NH3+ 168:sc= 0.255 (180deg=0.195) USER MOD Single : A 490 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 -12.866 -11.490 5.125 1.00 54.14 N ATOM 2 CA GLY A -3 -13.135 -10.235 5.863 1.00 31.04 C ATOM 3 C GLY A -3 -11.865 -9.569 6.340 1.00 54.45 C ATOM 4 O GLY A -3 -11.013 -9.192 5.528 1.00 10.03 O ATOM 0 H1 GLY A -3 -13.766 -11.911 4.817 1.00 54.14 H new ATOM 0 H2 GLY A -3 -12.278 -11.284 4.293 1.00 54.14 H new ATOM 0 H3 GLY A -3 -12.366 -12.157 5.746 1.00 54.14 H new ATOM 0 HA2 GLY A -3 -13.684 -9.548 5.219 1.00 31.04 H new ATOM 0 HA3 GLY A -3 -13.775 -10.449 6.719 1.00 31.04 H new ATOM 10 N SER A -2 -11.725 -9.461 7.659 1.00 75.11 N ATOM 11 CA SER A -2 -10.580 -8.784 8.257 1.00 51.21 C ATOM 12 C SER A -2 -9.377 -9.725 8.332 1.00 23.50 C ATOM 13 O SER A -2 -9.476 -10.834 8.864 1.00 31.14 O ATOM 14 CB SER A -2 -10.942 -8.249 9.650 1.00 34.01 C ATOM 15 OG SER A -2 -9.854 -7.530 10.224 1.00 64.55 O ATOM 0 H SER A -2 -12.392 -9.835 8.334 1.00 75.11 H new ATOM 0 HA SER A -2 -10.309 -7.938 7.625 1.00 51.21 H new ATOM 0 HB2 SER A -2 -11.814 -7.598 9.577 1.00 34.01 H new ATOM 0 HB3 SER A -2 -11.217 -9.079 10.301 1.00 34.01 H new ATOM 0 HG SER A -2 -10.112 -7.199 11.110 1.00 64.55 H new ATOM 21 N HIS A -1 -8.263 -9.285 7.750 1.00 22.35 N ATOM 22 CA HIS A -1 -7.001 -10.019 7.797 1.00 71.01 C ATOM 23 C HIS A -1 -5.870 -9.084 8.214 1.00 0.44 C ATOM 24 O HIS A -1 -5.867 -7.906 7.835 1.00 32.03 O ATOM 25 CB HIS A -1 -6.673 -10.625 6.418 1.00 21.11 C ATOM 26 CG HIS A -1 -6.793 -12.118 6.342 1.00 74.40 C ATOM 27 ND1 HIS A -1 -5.762 -12.940 5.931 1.00 45.33 N ATOM 28 CD2 HIS A -1 -7.839 -12.941 6.603 1.00 55.33 C ATOM 29 CE1 HIS A -1 -6.171 -14.198 5.940 1.00 74.23 C ATOM 30 NE2 HIS A -1 -7.426 -14.228 6.347 1.00 45.15 N ATOM 0 H HIS A -1 -8.210 -8.408 7.232 1.00 22.35 H new ATOM 0 HA HIS A -1 -7.101 -10.824 8.525 1.00 71.01 H new ATOM 0 HB2 HIS A -1 -7.337 -10.183 5.675 1.00 21.11 H new ATOM 0 HB3 HIS A -1 -5.656 -10.342 6.145 1.00 21.11 H new ATOM 0 HD2 HIS A -1 -8.817 -12.641 6.949 1.00 55.33 H new ATOM 0 HE1 HIS A -1 -5.578 -15.056 5.661 1.00 74.23 H new ATOM 0 HE2 HIS A -1 -7.996 -15.067 6.454 1.00 45.15 H new ATOM 39 N MET A 0 -4.907 -9.610 8.987 1.00 65.35 N ATOM 40 CA MET A 0 -3.685 -8.864 9.312 1.00 31.45 C ATOM 41 C MET A 0 -2.795 -8.814 8.066 1.00 2.33 C ATOM 42 O MET A 0 -2.842 -9.736 7.244 1.00 2.20 O ATOM 43 CB MET A 0 -2.938 -9.501 10.516 1.00 14.22 C ATOM 44 CG MET A 0 -1.862 -8.606 11.154 1.00 24.04 C ATOM 45 SD MET A 0 -1.064 -9.356 12.590 1.00 51.54 S ATOM 46 CE MET A 0 -0.155 -10.700 11.831 1.00 44.44 C ATOM 0 H MET A 0 -4.952 -10.543 9.396 1.00 65.35 H new ATOM 0 HA MET A 0 -3.948 -7.849 9.610 1.00 31.45 H new ATOM 0 HB2 MET A 0 -3.669 -9.767 11.280 1.00 14.22 H new ATOM 0 HB3 MET A 0 -2.470 -10.428 10.186 1.00 14.22 H new ATOM 0 HG2 MET A 0 -1.104 -8.373 10.406 1.00 24.04 H new ATOM 0 HG3 MET A 0 -2.316 -7.661 11.452 1.00 24.04 H new ATOM 0 HE1 MET A 0 0.548 -11.117 12.552 1.00 44.44 H new ATOM 0 HE2 MET A 0 -0.851 -11.476 11.512 1.00 44.44 H new ATOM 0 HE3 MET A 0 0.392 -10.326 10.966 1.00 44.44 H new ATOM 56 N GLN A 398 -2.047 -7.718 7.937 1.00 73.31 N ATOM 57 CA GLN A 398 -1.172 -7.413 6.785 1.00 60.34 C ATOM 58 C GLN A 398 -0.229 -8.592 6.443 1.00 71.51 C ATOM 59 O GLN A 398 0.587 -8.984 7.282 1.00 44.40 O ATOM 60 CB GLN A 398 -0.279 -6.158 7.098 1.00 34.02 C ATOM 61 CG GLN A 398 -0.943 -4.728 7.091 1.00 34.12 C ATOM 62 CD GLN A 398 -2.162 -4.522 8.014 1.00 52.32 C ATOM 63 OE1 GLN A 398 -2.267 -5.117 9.079 1.00 4.51 O ATOM 64 NE2 GLN A 398 -3.094 -3.657 7.607 1.00 21.53 N ATOM 0 H GLN A 398 -2.027 -6.989 8.650 1.00 73.31 H new ATOM 0 HA GLN A 398 -1.828 -7.223 5.936 1.00 60.34 H new ATOM 0 HB2 GLN A 398 0.168 -6.309 8.081 1.00 34.02 H new ATOM 0 HB3 GLN A 398 0.537 -6.146 6.375 1.00 34.02 H new ATOM 0 HG2 GLN A 398 -0.181 -3.999 7.366 1.00 34.12 H new ATOM 0 HG3 GLN A 398 -1.248 -4.500 6.070 1.00 34.12 H new ATOM 0 HE21 GLN A 398 -2.986 -3.173 6.716 1.00 21.53 H new ATOM 0 HE22 GLN A 398 -3.914 -3.481 8.187 1.00 21.53 H new ATOM 73 N LYS A 399 -0.363 -9.172 5.224 1.00 71.32 N ATOM 74 CA LYS A 399 0.654 -10.105 4.719 1.00 64.01 C ATOM 75 C LYS A 399 1.811 -9.271 4.182 1.00 54.32 C ATOM 76 O LYS A 399 1.670 -8.573 3.169 1.00 31.23 O ATOM 77 CB LYS A 399 0.144 -11.014 3.534 1.00 53.01 C ATOM 78 CG LYS A 399 -0.852 -12.179 3.813 1.00 5.13 C ATOM 79 CD LYS A 399 -0.149 -13.562 3.886 1.00 1.14 C ATOM 80 CE LYS A 399 0.869 -13.678 5.036 1.00 71.43 C ATOM 81 NZ LYS A 399 1.668 -14.938 4.959 1.00 54.31 N ATOM 0 H LYS A 399 -1.147 -9.011 4.592 1.00 71.32 H new ATOM 0 HA LYS A 399 0.932 -10.762 5.543 1.00 64.01 H new ATOM 0 HB2 LYS A 399 -0.324 -10.357 2.801 1.00 53.01 H new ATOM 0 HB3 LYS A 399 1.023 -11.448 3.058 1.00 53.01 H new ATOM 0 HG2 LYS A 399 -1.372 -11.990 4.752 1.00 5.13 H new ATOM 0 HG3 LYS A 399 -1.608 -12.201 3.028 1.00 5.13 H new ATOM 0 HD2 LYS A 399 -0.905 -14.339 4.002 1.00 1.14 H new ATOM 0 HD3 LYS A 399 0.360 -13.751 2.941 1.00 1.14 H new ATOM 0 HE2 LYS A 399 1.542 -12.821 5.011 1.00 71.43 H new ATOM 0 HE3 LYS A 399 0.343 -13.642 5.990 1.00 71.43 H new ATOM 0 HZ1 LYS A 399 2.339 -14.972 5.753 1.00 54.31 H new ATOM 0 HZ2 LYS A 399 1.030 -15.757 5.010 1.00 54.31 H new ATOM 0 HZ3 LYS A 399 2.192 -14.962 4.061 1.00 54.31 H new ATOM 95 N GLU A 400 2.950 -9.343 4.866 1.00 43.03 N ATOM 96 CA GLU A 400 4.207 -8.804 4.336 1.00 74.31 C ATOM 97 C GLU A 400 4.942 -9.916 3.567 1.00 34.23 C ATOM 98 O GLU A 400 4.704 -11.088 3.879 1.00 21.44 O ATOM 99 CB GLU A 400 5.088 -8.195 5.477 1.00 54.44 C ATOM 100 CG GLU A 400 5.259 -9.056 6.759 1.00 5.41 C ATOM 101 CD GLU A 400 6.374 -8.533 7.646 1.00 44.21 C ATOM 102 OE1 GLU A 400 6.225 -7.424 8.199 1.00 2.40 O ATOM 103 OE2 GLU A 400 7.405 -9.228 7.792 1.00 11.51 O ATOM 0 H GLU A 400 3.032 -9.769 5.789 1.00 43.03 H new ATOM 0 HA GLU A 400 3.993 -7.987 3.647 1.00 74.31 H new ATOM 0 HB2 GLU A 400 6.078 -7.990 5.070 1.00 54.44 H new ATOM 0 HB3 GLU A 400 4.657 -7.236 5.765 1.00 54.44 H new ATOM 0 HG2 GLU A 400 4.324 -9.064 7.318 1.00 5.41 H new ATOM 0 HG3 GLU A 400 5.472 -10.087 6.478 1.00 5.41 H new ATOM 110 N GLY A 401 5.719 -9.558 2.483 1.00 1.42 N ATOM 111 CA GLY A 401 6.645 -10.473 1.825 1.00 61.15 C ATOM 112 C GLY A 401 7.276 -11.564 2.712 1.00 21.34 C ATOM 113 O GLY A 401 7.808 -11.242 3.774 1.00 4.13 O ATOM 0 H GLY A 401 5.699 -8.627 2.067 1.00 1.42 H new ATOM 0 HA2 GLY A 401 6.118 -10.961 1.005 1.00 61.15 H new ATOM 0 HA3 GLY A 401 7.449 -9.885 1.382 1.00 61.15 H new ATOM 117 N PRO A 402 7.268 -12.873 2.295 1.00 53.24 N ATOM 118 CA PRO A 402 7.759 -13.981 3.110 1.00 21.44 C ATOM 119 C PRO A 402 9.281 -14.117 2.974 1.00 13.32 C ATOM 120 O PRO A 402 9.944 -13.223 2.429 1.00 45.22 O ATOM 121 CB PRO A 402 7.034 -15.194 2.511 1.00 64.41 C ATOM 122 CG PRO A 402 7.132 -14.924 1.074 1.00 73.52 C ATOM 123 CD PRO A 402 6.882 -13.425 0.947 1.00 3.33 C ATOM 0 HA PRO A 402 7.570 -13.857 4.176 1.00 21.44 H new ATOM 0 HB2 PRO A 402 7.515 -16.133 2.784 1.00 64.41 H new ATOM 0 HB3 PRO A 402 5.998 -15.257 2.845 1.00 64.41 H new ATOM 0 HG2 PRO A 402 8.113 -15.197 0.685 1.00 73.52 H new ATOM 0 HG3 PRO A 402 6.396 -15.498 0.512 1.00 73.52 H new ATOM 0 HD2 PRO A 402 7.483 -12.987 0.150 1.00 3.33 H new ATOM 0 HD3 PRO A 402 5.839 -13.213 0.713 1.00 3.33 H new ATOM 131 N GLU A 403 9.788 -15.204 3.563 1.00 4.41 N ATOM 132 CA GLU A 403 11.186 -15.684 3.458 1.00 23.12 C ATOM 133 C GLU A 403 11.919 -15.218 2.109 1.00 55.13 C ATOM 134 O GLU A 403 11.592 -15.724 1.036 1.00 0.41 O ATOM 135 CB GLU A 403 10.995 -17.246 3.440 1.00 45.30 C ATOM 136 CG GLU A 403 11.748 -18.006 4.509 1.00 3.44 C ATOM 137 CD GLU A 403 11.286 -19.444 4.621 1.00 34.43 C ATOM 138 OE1 GLU A 403 10.305 -19.704 5.343 1.00 10.12 O ATOM 139 OE2 GLU A 403 11.920 -20.324 3.985 1.00 4.32 O ATOM 0 H GLU A 403 9.216 -15.807 4.155 1.00 4.41 H new ATOM 0 HA GLU A 403 11.811 -15.295 4.262 1.00 23.12 H new ATOM 0 HB2 GLU A 403 9.932 -17.466 3.543 1.00 45.30 H new ATOM 0 HB3 GLU A 403 11.305 -17.621 2.465 1.00 45.30 H new ATOM 0 HG2 GLU A 403 12.814 -17.985 4.284 1.00 3.44 H new ATOM 0 HG3 GLU A 403 11.615 -17.507 5.469 1.00 3.44 H new ATOM 146 N GLY A 404 12.830 -14.168 2.183 1.00 1.43 N ATOM 147 CA GLY A 404 13.715 -13.759 1.067 1.00 74.43 C ATOM 148 C GLY A 404 13.176 -12.715 0.082 1.00 43.15 C ATOM 149 O GLY A 404 13.989 -11.943 -0.434 1.00 72.13 O ATOM 0 H GLY A 404 12.951 -13.601 3.022 1.00 1.43 H new ATOM 0 HA2 GLY A 404 14.639 -13.371 1.495 1.00 74.43 H new ATOM 0 HA3 GLY A 404 13.976 -14.653 0.500 1.00 74.43 H new ATOM 153 N ALA A 405 11.860 -12.644 -0.210 1.00 31.40 N ATOM 154 CA ALA A 405 11.399 -11.523 -1.076 1.00 44.03 C ATOM 155 C ALA A 405 10.380 -10.594 -0.413 1.00 32.41 C ATOM 156 O ALA A 405 9.310 -10.997 0.038 1.00 13.41 O ATOM 157 CB ALA A 405 10.888 -12.003 -2.431 1.00 43.01 C ATOM 0 H ALA A 405 11.140 -13.293 0.109 1.00 31.40 H new ATOM 0 HA ALA A 405 12.296 -10.926 -1.240 1.00 44.03 H new ATOM 0 HB1 ALA A 405 10.565 -11.146 -3.022 1.00 43.01 H new ATOM 0 HB2 ALA A 405 11.687 -12.526 -2.957 1.00 43.01 H new ATOM 0 HB3 ALA A 405 10.047 -12.680 -2.284 1.00 43.01 H new ATOM 163 N ASN A 406 10.769 -9.318 -0.425 1.00 12.15 N ATOM 164 CA ASN A 406 10.056 -8.182 0.179 1.00 12.55 C ATOM 165 C ASN A 406 10.285 -6.922 -0.713 1.00 2.10 C ATOM 166 O ASN A 406 11.438 -6.519 -0.881 1.00 5.44 O ATOM 167 CB ASN A 406 10.440 -8.009 1.699 1.00 3.42 C ATOM 168 CG ASN A 406 11.854 -8.435 2.068 1.00 51.21 C ATOM 169 OD1 ASN A 406 12.810 -8.308 1.309 1.00 31.34 O ATOM 170 ND2 ASN A 406 11.982 -8.947 3.281 1.00 32.23 N ATOM 0 H ASN A 406 11.635 -9.030 -0.880 1.00 12.15 H new ATOM 0 HA ASN A 406 8.981 -8.360 0.202 1.00 12.55 H new ATOM 0 HB2 ASN A 406 10.312 -6.961 1.972 1.00 3.42 H new ATOM 0 HB3 ASN A 406 9.737 -8.584 2.302 1.00 3.42 H new ATOM 0 HD21 ASN A 406 12.898 -9.251 3.612 1.00 32.23 H new ATOM 0 HD22 ASN A 406 11.165 -9.038 3.885 1.00 32.23 H new ATOM 177 N LEU A 407 9.230 -6.298 -1.307 1.00 1.34 N ATOM 178 CA LEU A 407 9.436 -5.238 -2.322 1.00 63.24 C ATOM 179 C LEU A 407 8.793 -3.953 -1.723 1.00 11.00 C ATOM 180 O LEU A 407 7.571 -3.907 -1.665 1.00 52.23 O ATOM 181 CB LEU A 407 8.729 -5.660 -3.721 1.00 24.05 C ATOM 182 CG LEU A 407 9.149 -6.944 -4.437 1.00 3.33 C ATOM 183 CD1 LEU A 407 8.689 -8.209 -3.700 1.00 4.22 C ATOM 184 CD2 LEU A 407 8.581 -6.942 -5.840 1.00 25.41 C ATOM 0 H LEU A 407 8.253 -6.507 -1.104 1.00 1.34 H new ATOM 0 HA LEU A 407 10.491 -5.078 -2.544 1.00 63.24 H new ATOM 0 HB2 LEU A 407 7.657 -5.730 -3.534 1.00 24.05 H new ATOM 0 HB3 LEU A 407 8.877 -4.837 -4.420 1.00 24.05 H new ATOM 0 HG LEU A 407 10.239 -6.963 -4.462 1.00 3.33 H new ATOM 0 HD11 LEU A 407 9.014 -9.091 -4.252 1.00 4.22 H new ATOM 0 HD12 LEU A 407 9.124 -8.226 -2.701 1.00 4.22 H new ATOM 0 HD13 LEU A 407 7.602 -8.210 -3.623 1.00 4.22 H new ATOM 0 HD21 LEU A 407 8.878 -7.856 -6.354 1.00 25.41 H new ATOM 0 HD22 LEU A 407 7.493 -6.890 -5.792 1.00 25.41 H new ATOM 0 HD23 LEU A 407 8.962 -6.079 -6.386 1.00 25.41 H new ATOM 196 N PHE A 408 9.530 -2.876 -1.281 1.00 73.34 N ATOM 197 CA PHE A 408 8.739 -1.725 -0.788 1.00 22.23 C ATOM 198 C PHE A 408 8.590 -0.620 -1.900 1.00 61.05 C ATOM 199 O PHE A 408 9.567 0.076 -2.186 1.00 14.34 O ATOM 200 CB PHE A 408 9.377 -1.087 0.484 1.00 2.34 C ATOM 201 CG PHE A 408 9.504 -1.946 1.724 1.00 60.32 C ATOM 202 CD1 PHE A 408 10.597 -2.769 1.921 1.00 35.44 C ATOM 203 CD2 PHE A 408 8.563 -1.848 2.733 1.00 31.03 C ATOM 204 CE1 PHE A 408 10.736 -3.484 3.096 1.00 13.13 C ATOM 205 CE2 PHE A 408 8.698 -2.545 3.908 1.00 24.14 C ATOM 206 CZ PHE A 408 9.787 -3.368 4.099 1.00 55.14 C ATOM 0 H PHE A 408 10.546 -2.791 -1.259 1.00 73.34 H new ATOM 0 HA PHE A 408 7.754 -2.112 -0.529 1.00 22.23 H new ATOM 0 HB2 PHE A 408 10.374 -0.737 0.217 1.00 2.34 H new ATOM 0 HB3 PHE A 408 8.790 -0.207 0.746 1.00 2.34 H new ATOM 0 HD1 PHE A 408 11.349 -2.854 1.150 1.00 35.44 H new ATOM 0 HD2 PHE A 408 7.703 -1.209 2.593 1.00 31.03 H new ATOM 0 HE1 PHE A 408 11.587 -4.135 3.233 1.00 13.13 H new ATOM 0 HE2 PHE A 408 7.951 -2.449 4.682 1.00 24.14 H new ATOM 0 HZ PHE A 408 9.900 -3.917 5.022 1.00 55.14 H new ATOM 216 N ILE A 409 7.358 -0.413 -2.506 1.00 3.13 N ATOM 217 CA ILE A 409 7.195 0.606 -3.610 1.00 21.44 C ATOM 218 C ILE A 409 6.568 1.881 -3.106 1.00 52.00 C ATOM 219 O ILE A 409 5.461 1.895 -2.569 1.00 52.12 O ATOM 220 CB ILE A 409 6.436 0.026 -4.887 1.00 32.04 C ATOM 221 CG1 ILE A 409 5.796 -1.363 -4.633 1.00 71.11 C ATOM 222 CG2 ILE A 409 7.388 -0.105 -6.071 1.00 53.35 C ATOM 223 CD1 ILE A 409 4.283 -1.375 -4.445 1.00 74.50 C ATOM 0 H ILE A 409 6.505 -0.915 -2.259 1.00 3.13 H new ATOM 0 HA ILE A 409 8.201 0.853 -3.949 1.00 21.44 H new ATOM 0 HB ILE A 409 5.642 0.740 -5.104 1.00 32.04 H new ATOM 0 HG12 ILE A 409 6.044 -2.014 -5.471 1.00 71.11 H new ATOM 0 HG13 ILE A 409 6.256 -1.797 -3.745 1.00 71.11 H new ATOM 0 HG21 ILE A 409 6.848 -0.503 -6.930 1.00 53.35 H new ATOM 0 HG22 ILE A 409 7.796 0.875 -6.320 1.00 53.35 H new ATOM 0 HG23 ILE A 409 8.202 -0.781 -5.810 1.00 53.35 H new ATOM 0 HD11 ILE A 409 3.946 -2.397 -4.275 1.00 74.50 H new ATOM 0 HD12 ILE A 409 4.018 -0.758 -3.587 1.00 74.50 H new ATOM 0 HD13 ILE A 409 3.802 -0.979 -5.339 1.00 74.50 H new ATOM 235 N TYR A 410 7.321 2.972 -3.326 1.00 43.10 N ATOM 236 CA TYR A 410 7.042 4.249 -2.674 1.00 74.44 C ATOM 237 C TYR A 410 7.318 5.405 -3.656 1.00 42.00 C ATOM 238 O TYR A 410 8.028 5.154 -4.642 1.00 14.22 O ATOM 239 CB TYR A 410 7.917 4.378 -1.382 1.00 3.12 C ATOM 240 CG TYR A 410 9.415 4.735 -1.540 1.00 52.40 C ATOM 241 CD1 TYR A 410 9.834 6.069 -1.578 1.00 71.34 C ATOM 242 CD2 TYR A 410 10.419 3.757 -1.604 1.00 44.30 C ATOM 243 CE1 TYR A 410 11.170 6.411 -1.676 1.00 21.23 C ATOM 244 CE2 TYR A 410 11.759 4.112 -1.705 1.00 74.22 C ATOM 245 CZ TYR A 410 12.122 5.432 -1.744 1.00 22.34 C ATOM 246 OH TYR A 410 13.459 5.768 -1.844 1.00 72.41 O ATOM 0 H TYR A 410 8.126 2.988 -3.952 1.00 43.10 H new ATOM 0 HA TYR A 410 5.993 4.296 -2.382 1.00 74.44 H new ATOM 0 HB2 TYR A 410 7.460 5.136 -0.746 1.00 3.12 H new ATOM 0 HB3 TYR A 410 7.856 3.432 -0.844 1.00 3.12 H new ATOM 0 HD1 TYR A 410 9.093 6.854 -1.529 1.00 71.34 H new ATOM 0 HD2 TYR A 410 10.146 2.712 -1.574 1.00 44.30 H new ATOM 0 HE1 TYR A 410 11.461 7.451 -1.699 1.00 21.23 H new ATOM 0 HE2 TYR A 410 12.517 3.344 -1.753 1.00 74.22 H new ATOM 0 HH TYR A 410 13.615 6.625 -1.396 1.00 72.41 H new ATOM 256 N HIS A 411 6.764 6.651 -3.411 1.00 63.41 N ATOM 257 CA HIS A 411 7.054 7.830 -4.265 1.00 74.21 C ATOM 258 C HIS A 411 6.491 7.648 -5.701 1.00 63.02 C ATOM 259 O HIS A 411 7.023 8.215 -6.656 1.00 54.44 O ATOM 260 CB HIS A 411 8.575 8.149 -4.297 1.00 40.13 C ATOM 261 CG HIS A 411 8.956 9.442 -3.579 1.00 53.43 C ATOM 262 ND1 HIS A 411 9.869 9.464 -2.539 1.00 40.33 N ATOM 263 CD2 HIS A 411 8.547 10.748 -3.719 1.00 61.25 C ATOM 264 CE1 HIS A 411 10.009 10.693 -2.080 1.00 62.23 C ATOM 265 NE2 HIS A 411 9.223 11.493 -2.773 1.00 2.43 N ATOM 0 H HIS A 411 6.127 6.843 -2.638 1.00 63.41 H new ATOM 0 HA HIS A 411 6.545 8.684 -3.818 1.00 74.21 H new ATOM 0 HB2 HIS A 411 9.119 7.320 -3.843 1.00 40.13 H new ATOM 0 HB3 HIS A 411 8.900 8.213 -5.335 1.00 40.13 H new ATOM 0 HD2 HIS A 411 7.830 11.121 -4.436 1.00 61.25 H new ATOM 0 HE1 HIS A 411 10.659 10.993 -1.272 1.00 62.23 H new ATOM 0 HE2 HIS A 411 9.129 12.499 -2.633 1.00 2.43 H new ATOM 274 N LEU A 412 5.394 6.853 -5.810 1.00 10.01 N ATOM 275 CA LEU A 412 4.691 6.571 -7.087 1.00 13.04 C ATOM 276 C LEU A 412 4.201 7.830 -7.842 1.00 74.21 C ATOM 277 O LEU A 412 3.804 8.829 -7.231 1.00 50.31 O ATOM 278 CB LEU A 412 3.492 5.594 -6.842 1.00 31.20 C ATOM 279 CG LEU A 412 2.473 5.961 -5.725 1.00 25.14 C ATOM 280 CD1 LEU A 412 1.346 6.884 -6.185 1.00 50.12 C ATOM 281 CD2 LEU A 412 1.856 4.727 -5.060 1.00 64.33 C ATOM 0 H LEU A 412 4.971 6.387 -5.007 1.00 10.01 H new ATOM 0 HA LEU A 412 5.436 6.107 -7.734 1.00 13.04 H new ATOM 0 HB2 LEU A 412 2.942 5.497 -7.778 1.00 31.20 H new ATOM 0 HB3 LEU A 412 3.903 4.611 -6.611 1.00 31.20 H new ATOM 0 HG LEU A 412 3.077 6.505 -4.998 1.00 25.14 H new ATOM 0 HD11 LEU A 412 0.680 7.091 -5.347 1.00 50.12 H new ATOM 0 HD12 LEU A 412 1.769 7.819 -6.552 1.00 50.12 H new ATOM 0 HD13 LEU A 412 0.784 6.401 -6.985 1.00 50.12 H new ATOM 0 HD21 LEU A 412 1.153 5.042 -4.289 1.00 64.33 H new ATOM 0 HD22 LEU A 412 1.331 4.134 -5.809 1.00 64.33 H new ATOM 0 HD23 LEU A 412 2.644 4.125 -4.608 1.00 64.33 H new ATOM 293 N PRO A 413 4.298 7.791 -9.200 1.00 32.41 N ATOM 294 CA PRO A 413 3.718 8.798 -10.131 1.00 42.13 C ATOM 295 C PRO A 413 2.186 8.850 -10.110 1.00 74.13 C ATOM 296 O PRO A 413 1.562 7.963 -9.560 1.00 62.30 O ATOM 297 CB PRO A 413 4.247 8.339 -11.494 1.00 10.43 C ATOM 298 CG PRO A 413 4.443 6.886 -11.320 1.00 64.21 C ATOM 299 CD PRO A 413 5.045 6.766 -9.969 1.00 31.01 C ATOM 0 HA PRO A 413 4.004 9.815 -9.861 1.00 42.13 H new ATOM 0 HB2 PRO A 413 3.537 8.555 -12.293 1.00 10.43 H new ATOM 0 HB3 PRO A 413 5.179 8.841 -11.752 1.00 10.43 H new ATOM 0 HG2 PRO A 413 3.499 6.345 -11.386 1.00 64.21 H new ATOM 0 HG3 PRO A 413 5.100 6.477 -12.088 1.00 64.21 H new ATOM 0 HD2 PRO A 413 4.913 5.768 -9.552 1.00 31.01 H new ATOM 0 HD3 PRO A 413 6.116 6.967 -9.981 1.00 31.01 H new ATOM 307 N GLN A 414 1.604 9.918 -10.684 1.00 14.10 N ATOM 308 CA GLN A 414 0.126 10.122 -10.716 1.00 73.25 C ATOM 309 C GLN A 414 -0.643 8.952 -11.432 1.00 42.52 C ATOM 310 O GLN A 414 -1.788 8.681 -11.068 1.00 3.00 O ATOM 311 CB GLN A 414 -0.169 11.536 -11.334 1.00 30.23 C ATOM 312 CG GLN A 414 -1.312 11.652 -12.370 1.00 60.54 C ATOM 313 CD GLN A 414 -1.230 12.965 -13.114 1.00 64.11 C ATOM 314 OE1 GLN A 414 -1.846 13.956 -12.729 1.00 60.43 O ATOM 315 NE2 GLN A 414 -0.404 12.997 -14.154 1.00 55.25 N ATOM 0 H GLN A 414 2.131 10.664 -11.138 1.00 14.10 H new ATOM 0 HA GLN A 414 -0.260 10.098 -9.697 1.00 73.25 H new ATOM 0 HB2 GLN A 414 -0.391 12.219 -10.514 1.00 30.23 H new ATOM 0 HB3 GLN A 414 0.747 11.892 -11.806 1.00 30.23 H new ATOM 0 HG2 GLN A 414 -1.254 10.824 -13.077 1.00 60.54 H new ATOM 0 HG3 GLN A 414 -2.275 11.574 -11.866 1.00 60.54 H new ATOM 0 HE21 GLN A 414 0.088 12.151 -14.441 1.00 55.25 H new ATOM 0 HE22 GLN A 414 -0.262 13.868 -14.666 1.00 55.25 H new ATOM 324 N GLU A 415 -0.027 8.239 -12.418 1.00 24.02 N ATOM 325 CA GLU A 415 -0.742 7.088 -13.073 1.00 1.23 C ATOM 326 C GLU A 415 -0.331 5.705 -12.436 1.00 33.01 C ATOM 327 O GLU A 415 -0.768 4.651 -12.891 1.00 52.31 O ATOM 328 CB GLU A 415 -0.617 7.160 -14.638 1.00 23.15 C ATOM 329 CG GLU A 415 -1.820 6.575 -15.439 1.00 61.12 C ATOM 330 CD GLU A 415 -1.574 6.566 -16.934 1.00 23.34 C ATOM 331 OE1 GLU A 415 -1.789 7.610 -17.584 1.00 31.12 O ATOM 332 OE2 GLU A 415 -1.165 5.512 -17.462 1.00 14.33 O ATOM 0 H GLU A 415 0.914 8.421 -12.768 1.00 24.02 H new ATOM 0 HA GLU A 415 -1.809 7.175 -12.868 1.00 1.23 H new ATOM 0 HB2 GLU A 415 -0.485 8.203 -14.926 1.00 23.15 H new ATOM 0 HB3 GLU A 415 0.287 6.630 -14.937 1.00 23.15 H new ATOM 0 HG2 GLU A 415 -2.017 5.558 -15.101 1.00 61.12 H new ATOM 0 HG3 GLU A 415 -2.714 7.161 -15.225 1.00 61.12 H new ATOM 339 N PHE A 416 0.530 5.735 -11.392 1.00 74.11 N ATOM 340 CA PHE A 416 0.608 4.619 -10.354 1.00 73.12 C ATOM 341 C PHE A 416 -0.140 5.072 -9.054 1.00 62.22 C ATOM 342 O PHE A 416 -0.451 6.251 -8.910 1.00 4.53 O ATOM 343 CB PHE A 416 2.049 4.047 -10.042 1.00 43.34 C ATOM 344 CG PHE A 416 2.645 2.913 -10.910 1.00 53.32 C ATOM 345 CD1 PHE A 416 1.993 2.291 -11.997 1.00 22.31 C ATOM 346 CD2 PHE A 416 3.928 2.460 -10.579 1.00 14.31 C ATOM 347 CE1 PHE A 416 2.636 1.263 -12.715 1.00 22.02 C ATOM 348 CE2 PHE A 416 4.552 1.448 -11.285 1.00 64.23 C ATOM 349 CZ PHE A 416 3.913 0.855 -12.353 1.00 72.22 C ATOM 0 H PHE A 416 1.184 6.500 -11.226 1.00 74.11 H new ATOM 0 HA PHE A 416 0.110 3.761 -10.806 1.00 73.12 H new ATOM 0 HB2 PHE A 416 2.745 4.885 -10.084 1.00 43.34 H new ATOM 0 HB3 PHE A 416 2.039 3.693 -9.011 1.00 43.34 H new ATOM 0 HD1 PHE A 416 0.999 2.604 -12.279 1.00 22.31 H new ATOM 0 HD2 PHE A 416 4.446 2.915 -9.747 1.00 14.31 H new ATOM 0 HE1 PHE A 416 2.135 0.792 -13.548 1.00 22.02 H new ATOM 0 HE2 PHE A 416 5.541 1.122 -10.999 1.00 64.23 H new ATOM 0 HZ PHE A 416 4.407 0.072 -12.909 1.00 72.22 H new ATOM 359 N GLY A 417 -0.486 4.127 -8.153 1.00 62.12 N ATOM 360 CA GLY A 417 -1.657 4.281 -7.270 1.00 5.02 C ATOM 361 C GLY A 417 -2.123 2.899 -6.809 1.00 53.34 C ATOM 362 O GLY A 417 -1.447 1.930 -7.141 1.00 24.54 O ATOM 0 H GLY A 417 0.027 3.255 -8.020 1.00 62.12 H new ATOM 0 HA2 GLY A 417 -1.400 4.897 -6.409 1.00 5.02 H new ATOM 0 HA3 GLY A 417 -2.462 4.792 -7.799 1.00 5.02 H new ATOM 366 N ASP A 418 -3.259 2.754 -6.075 1.00 72.21 N ATOM 367 CA ASP A 418 -3.447 1.484 -5.328 1.00 23.13 C ATOM 368 C ASP A 418 -4.013 0.271 -6.099 1.00 10.51 C ATOM 369 O ASP A 418 -3.358 -0.775 -6.091 1.00 74.14 O ATOM 370 CB ASP A 418 -4.179 1.590 -3.987 1.00 43.44 C ATOM 371 CG ASP A 418 -5.430 2.435 -4.020 1.00 43.51 C ATOM 372 OD1 ASP A 418 -5.329 3.675 -3.901 1.00 30.22 O ATOM 373 OD2 ASP A 418 -6.523 1.863 -4.157 1.00 41.13 O ATOM 0 H ASP A 418 -4.006 3.443 -5.986 1.00 72.21 H new ATOM 0 HA ASP A 418 -2.393 1.280 -5.142 1.00 23.13 H new ATOM 0 HB2 ASP A 418 -4.442 0.587 -3.651 1.00 43.44 H new ATOM 0 HB3 ASP A 418 -3.495 2.005 -3.246 1.00 43.44 H new ATOM 378 N GLN A 419 -5.211 0.351 -6.748 1.00 71.03 N ATOM 379 CA GLN A 419 -5.757 -0.842 -7.418 1.00 41.42 C ATOM 380 C GLN A 419 -4.956 -1.091 -8.712 1.00 12.32 C ATOM 381 O GLN A 419 -4.940 -2.201 -9.248 1.00 42.34 O ATOM 382 CB GLN A 419 -7.267 -0.731 -7.729 1.00 14.12 C ATOM 383 CG GLN A 419 -7.926 -2.069 -8.106 1.00 0.53 C ATOM 384 CD GLN A 419 -8.776 -1.980 -9.358 1.00 74.21 C ATOM 385 OE1 GLN A 419 -9.958 -1.641 -9.304 1.00 13.13 O ATOM 386 NE2 GLN A 419 -8.179 -2.321 -10.495 1.00 53.11 N ATOM 0 H GLN A 419 -5.785 1.191 -6.815 1.00 71.03 H new ATOM 0 HA GLN A 419 -5.655 -1.684 -6.733 1.00 41.42 H new ATOM 0 HB2 GLN A 419 -7.778 -0.318 -6.859 1.00 14.12 H new ATOM 0 HB3 GLN A 419 -7.409 -0.024 -8.547 1.00 14.12 H new ATOM 0 HG2 GLN A 419 -7.150 -2.821 -8.253 1.00 0.53 H new ATOM 0 HG3 GLN A 419 -8.546 -2.409 -7.276 1.00 0.53 H new ATOM 0 HE21 GLN A 419 -7.197 -2.596 -10.493 1.00 53.11 H new ATOM 0 HE22 GLN A 419 -8.703 -2.308 -11.370 1.00 53.11 H new ATOM 395 N ASP A 420 -4.246 -0.036 -9.174 1.00 11.31 N ATOM 396 CA ASP A 420 -3.370 -0.113 -10.349 1.00 43.22 C ATOM 397 C ASP A 420 -1.947 -0.648 -10.018 1.00 12.40 C ATOM 398 O ASP A 420 -1.159 -0.876 -10.943 1.00 60.42 O ATOM 399 CB ASP A 420 -3.311 1.215 -11.162 1.00 22.02 C ATOM 400 CG ASP A 420 -3.222 2.473 -10.341 1.00 25.12 C ATOM 401 OD1 ASP A 420 -4.188 2.807 -9.608 1.00 13.44 O ATOM 402 OD2 ASP A 420 -2.203 3.148 -10.453 1.00 4.24 O ATOM 0 H ASP A 420 -4.269 0.886 -8.739 1.00 11.31 H new ATOM 0 HA ASP A 420 -3.839 -0.853 -10.998 1.00 43.22 H new ATOM 0 HB2 ASP A 420 -2.449 1.175 -11.828 1.00 22.02 H new ATOM 0 HB3 ASP A 420 -4.199 1.275 -11.792 1.00 22.02 H new ATOM 407 N ILE A 421 -1.617 -0.834 -8.710 1.00 22.42 N ATOM 408 CA ILE A 421 -0.272 -1.325 -8.266 1.00 14.23 C ATOM 409 C ILE A 421 -0.122 -2.793 -8.709 1.00 60.31 C ATOM 410 O ILE A 421 0.970 -3.248 -9.049 1.00 52.14 O ATOM 411 CB ILE A 421 -0.064 -1.140 -6.676 1.00 44.32 C ATOM 412 CG1 ILE A 421 1.037 -0.061 -6.310 1.00 22.12 C ATOM 413 CG2 ILE A 421 0.264 -2.460 -5.916 1.00 61.02 C ATOM 414 CD1 ILE A 421 0.858 0.637 -4.941 1.00 62.34 C ATOM 0 H ILE A 421 -2.262 -0.652 -7.941 1.00 22.42 H new ATOM 0 HA ILE A 421 0.511 -0.729 -8.734 1.00 14.23 H new ATOM 0 HB ILE A 421 -1.040 -0.787 -6.342 1.00 44.32 H new ATOM 0 HG12 ILE A 421 2.014 -0.544 -6.326 1.00 22.12 H new ATOM 0 HG13 ILE A 421 1.046 0.702 -7.089 1.00 22.12 H new ATOM 0 HG21 ILE A 421 0.388 -2.247 -4.854 1.00 61.02 H new ATOM 0 HG22 ILE A 421 -0.552 -3.170 -6.051 1.00 61.02 H new ATOM 0 HG23 ILE A 421 1.186 -2.888 -6.311 1.00 61.02 H new ATOM 0 HD11 ILE A 421 1.664 1.355 -4.791 1.00 62.34 H new ATOM 0 HD12 ILE A 421 -0.100 1.157 -4.920 1.00 62.34 H new ATOM 0 HD13 ILE A 421 0.883 -0.109 -4.146 1.00 62.34 H new ATOM 426 N LEU A 422 -1.271 -3.489 -8.762 1.00 22.31 N ATOM 427 CA LEU A 422 -1.365 -4.872 -9.199 1.00 70.11 C ATOM 428 C LEU A 422 -1.125 -4.979 -10.754 1.00 2.35 C ATOM 429 O LEU A 422 -0.775 -6.053 -11.214 1.00 22.42 O ATOM 430 CB LEU A 422 -2.765 -5.535 -8.857 1.00 31.52 C ATOM 431 CG LEU A 422 -3.575 -5.076 -7.603 1.00 54.25 C ATOM 432 CD1 LEU A 422 -4.799 -5.967 -7.435 1.00 0.14 C ATOM 433 CD2 LEU A 422 -2.769 -5.158 -6.304 1.00 53.44 C ATOM 0 H LEU A 422 -2.170 -3.089 -8.495 1.00 22.31 H new ATOM 0 HA LEU A 422 -0.592 -5.413 -8.653 1.00 70.11 H new ATOM 0 HB2 LEU A 422 -3.409 -5.393 -9.725 1.00 31.52 H new ATOM 0 HB3 LEU A 422 -2.597 -6.607 -8.757 1.00 31.52 H new ATOM 0 HG LEU A 422 -3.845 -4.034 -7.777 1.00 54.25 H new ATOM 0 HD11 LEU A 422 -5.365 -5.647 -6.560 1.00 0.14 H new ATOM 0 HD12 LEU A 422 -5.429 -5.891 -8.322 1.00 0.14 H new ATOM 0 HD13 LEU A 422 -4.481 -7.001 -7.303 1.00 0.14 H new ATOM 0 HD21 LEU A 422 -3.388 -4.826 -5.470 1.00 53.44 H new ATOM 0 HD22 LEU A 422 -2.455 -6.188 -6.135 1.00 53.44 H new ATOM 0 HD23 LEU A 422 -1.889 -4.519 -6.381 1.00 53.44 H new ATOM 445 N GLN A 423 -1.268 -3.857 -11.568 1.00 22.21 N ATOM 446 CA GLN A 423 -1.627 -3.989 -12.989 1.00 24.24 C ATOM 447 C GLN A 423 -0.383 -4.143 -13.882 1.00 55.22 C ATOM 448 O GLN A 423 -0.407 -4.905 -14.852 1.00 43.53 O ATOM 449 CB GLN A 423 -2.529 -2.827 -13.483 1.00 61.25 C ATOM 450 CG GLN A 423 -3.971 -2.847 -12.909 1.00 32.05 C ATOM 451 CD GLN A 423 -4.810 -1.710 -13.455 1.00 64.12 C ATOM 452 OE1 GLN A 423 -4.296 -0.655 -13.807 1.00 71.41 O ATOM 453 NE2 GLN A 423 -6.114 -1.906 -13.511 1.00 74.32 N ATOM 0 H GLN A 423 -1.139 -2.897 -11.249 1.00 22.21 H new ATOM 0 HA GLN A 423 -2.211 -4.905 -13.072 1.00 24.24 H new ATOM 0 HB2 GLN A 423 -2.059 -1.880 -13.218 1.00 61.25 H new ATOM 0 HB3 GLN A 423 -2.583 -2.863 -14.571 1.00 61.25 H new ATOM 0 HG2 GLN A 423 -4.446 -3.798 -13.152 1.00 32.05 H new ATOM 0 HG3 GLN A 423 -3.930 -2.779 -11.822 1.00 32.05 H new ATOM 0 HE21 GLN A 423 -6.509 -2.797 -13.210 1.00 74.32 H new ATOM 0 HE22 GLN A 423 -6.727 -1.167 -13.855 1.00 74.32 H new ATOM 462 N MET A 424 0.703 -3.397 -13.571 1.00 25.40 N ATOM 463 CA MET A 424 1.987 -3.561 -14.270 1.00 74.23 C ATOM 464 C MET A 424 2.842 -4.734 -13.696 1.00 33.14 C ATOM 465 O MET A 424 3.551 -5.397 -14.452 1.00 24.21 O ATOM 466 CB MET A 424 2.784 -2.240 -14.202 1.00 4.45 C ATOM 467 CG MET A 424 3.406 -1.752 -15.518 1.00 11.44 C ATOM 468 SD MET A 424 4.629 -2.887 -16.201 1.00 45.32 S ATOM 469 CE MET A 424 5.265 -1.907 -17.552 1.00 45.13 C ATOM 0 H MET A 424 0.710 -2.681 -12.844 1.00 25.40 H new ATOM 0 HA MET A 424 1.764 -3.813 -15.307 1.00 74.23 H new ATOM 0 HB2 MET A 424 2.122 -1.460 -13.827 1.00 4.45 H new ATOM 0 HB3 MET A 424 3.583 -2.360 -13.470 1.00 4.45 H new ATOM 0 HG2 MET A 424 2.613 -1.601 -16.251 1.00 11.44 H new ATOM 0 HG3 MET A 424 3.875 -0.782 -15.351 1.00 11.44 H new ATOM 0 HE1 MET A 424 6.036 -2.470 -18.079 1.00 45.13 H new ATOM 0 HE2 MET A 424 4.455 -1.668 -18.241 1.00 45.13 H new ATOM 0 HE3 MET A 424 5.693 -0.984 -17.162 1.00 45.13 H new ATOM 479 N PHE A 425 2.726 -5.031 -12.386 1.00 30.54 N ATOM 480 CA PHE A 425 3.629 -5.986 -11.699 1.00 24.13 C ATOM 481 C PHE A 425 3.210 -7.471 -11.860 1.00 2.42 C ATOM 482 O PHE A 425 3.853 -8.358 -11.296 1.00 3.20 O ATOM 483 CB PHE A 425 3.894 -5.583 -10.212 1.00 24.53 C ATOM 484 CG PHE A 425 5.283 -5.086 -9.979 1.00 35.23 C ATOM 485 CD1 PHE A 425 6.333 -5.945 -9.691 1.00 53.24 C ATOM 486 CD2 PHE A 425 5.526 -3.732 -10.053 1.00 41.10 C ATOM 487 CE1 PHE A 425 7.614 -5.447 -9.484 1.00 13.42 C ATOM 488 CE2 PHE A 425 6.792 -3.217 -9.854 1.00 11.43 C ATOM 489 CZ PHE A 425 7.846 -4.080 -9.569 1.00 5.11 C ATOM 0 H PHE A 425 2.015 -4.624 -11.778 1.00 30.54 H new ATOM 0 HA PHE A 425 4.585 -5.911 -12.217 1.00 24.13 H new ATOM 0 HB2 PHE A 425 3.184 -4.810 -9.919 1.00 24.53 H new ATOM 0 HB3 PHE A 425 3.710 -6.444 -9.570 1.00 24.53 H new ATOM 0 HD1 PHE A 425 6.154 -7.008 -9.627 1.00 53.24 H new ATOM 0 HD2 PHE A 425 4.710 -3.059 -10.271 1.00 41.10 H new ATOM 0 HE1 PHE A 425 8.427 -6.121 -9.258 1.00 13.42 H new ATOM 0 HE2 PHE A 425 6.963 -2.153 -9.919 1.00 11.43 H new ATOM 0 HZ PHE A 425 8.841 -3.688 -9.414 1.00 5.11 H new ATOM 499 N MET A 426 2.153 -7.727 -12.658 1.00 1.11 N ATOM 500 CA MET A 426 1.469 -9.016 -12.713 1.00 62.13 C ATOM 501 C MET A 426 2.266 -10.065 -13.560 1.00 43.04 C ATOM 502 O MET A 426 2.395 -11.214 -13.131 1.00 73.35 O ATOM 503 CB MET A 426 0.054 -8.834 -13.268 1.00 23.04 C ATOM 504 CG MET A 426 -1.018 -9.086 -12.220 1.00 60.15 C ATOM 505 SD MET A 426 -1.341 -10.843 -11.992 1.00 75.52 S ATOM 506 CE MET A 426 -1.384 -10.954 -10.217 1.00 51.12 C ATOM 0 H MET A 426 1.753 -7.030 -13.286 1.00 1.11 H new ATOM 0 HA MET A 426 1.407 -9.406 -11.697 1.00 62.13 H new ATOM 0 HB2 MET A 426 -0.053 -7.821 -13.657 1.00 23.04 H new ATOM 0 HB3 MET A 426 -0.095 -9.515 -14.106 1.00 23.04 H new ATOM 0 HG2 MET A 426 -0.707 -8.649 -11.271 1.00 60.15 H new ATOM 0 HG3 MET A 426 -1.939 -8.584 -12.516 1.00 60.15 H new ATOM 0 HE1 MET A 426 -1.895 -11.871 -9.922 1.00 51.12 H new ATOM 0 HE2 MET A 426 -0.366 -10.965 -9.828 1.00 51.12 H new ATOM 0 HE3 MET A 426 -1.918 -10.095 -9.812 1.00 51.12 H new ATOM 516 N PRO A 427 2.812 -9.710 -14.788 1.00 2.44 N ATOM 517 CA PRO A 427 3.631 -10.653 -15.569 1.00 12.11 C ATOM 518 C PRO A 427 5.080 -10.821 -15.045 1.00 51.11 C ATOM 519 O PRO A 427 5.771 -11.763 -15.441 1.00 71.25 O ATOM 520 CB PRO A 427 3.588 -10.066 -16.987 1.00 64.22 C ATOM 521 CG PRO A 427 3.388 -8.604 -16.810 1.00 2.25 C ATOM 522 CD PRO A 427 2.622 -8.434 -15.533 1.00 72.24 C ATOM 0 HA PRO A 427 3.241 -11.669 -15.507 1.00 12.11 H new ATOM 0 HB2 PRO A 427 4.513 -10.272 -17.525 1.00 64.22 H new ATOM 0 HB3 PRO A 427 2.777 -10.505 -17.568 1.00 64.22 H new ATOM 0 HG2 PRO A 427 4.345 -8.084 -16.761 1.00 2.25 H new ATOM 0 HG3 PRO A 427 2.839 -8.182 -17.652 1.00 2.25 H new ATOM 0 HD2 PRO A 427 2.995 -7.585 -14.960 1.00 72.24 H new ATOM 0 HD3 PRO A 427 1.566 -8.247 -15.729 1.00 72.24 H new ATOM 530 N PHE A 428 5.531 -9.918 -14.162 1.00 44.41 N ATOM 531 CA PHE A 428 6.793 -10.115 -13.436 1.00 33.24 C ATOM 532 C PHE A 428 6.659 -11.148 -12.234 1.00 41.11 C ATOM 533 O PHE A 428 7.658 -11.390 -11.558 1.00 51.51 O ATOM 534 CB PHE A 428 7.413 -8.730 -12.951 1.00 74.51 C ATOM 535 CG PHE A 428 8.053 -7.834 -14.019 1.00 13.22 C ATOM 536 CD1 PHE A 428 8.766 -8.374 -15.090 1.00 15.53 C ATOM 537 CD2 PHE A 428 7.954 -6.434 -13.936 1.00 12.34 C ATOM 538 CE1 PHE A 428 9.349 -7.551 -16.045 1.00 55.21 C ATOM 539 CE2 PHE A 428 8.543 -5.614 -14.899 1.00 73.34 C ATOM 540 CZ PHE A 428 9.234 -6.177 -15.952 1.00 42.30 C ATOM 0 H PHE A 428 5.045 -9.051 -13.935 1.00 44.41 H new ATOM 0 HA PHE A 428 7.489 -10.560 -14.147 1.00 33.24 H new ATOM 0 HB2 PHE A 428 6.623 -8.160 -12.461 1.00 74.51 H new ATOM 0 HB3 PHE A 428 8.168 -8.945 -12.194 1.00 74.51 H new ATOM 0 HD1 PHE A 428 8.866 -9.446 -15.178 1.00 15.53 H new ATOM 0 HD2 PHE A 428 7.414 -5.987 -13.115 1.00 12.34 H new ATOM 0 HE1 PHE A 428 9.897 -7.988 -16.867 1.00 55.21 H new ATOM 0 HE2 PHE A 428 8.458 -4.540 -14.820 1.00 73.34 H new ATOM 0 HZ PHE A 428 9.685 -5.545 -16.703 1.00 42.30 H new ATOM 550 N GLY A 429 5.486 -11.854 -12.028 1.00 13.32 N ATOM 551 CA GLY A 429 5.312 -12.645 -10.779 1.00 14.42 C ATOM 552 C GLY A 429 3.889 -12.507 -10.088 1.00 52.34 C ATOM 553 O GLY A 429 3.195 -11.530 -10.348 1.00 53.44 O ATOM 0 H GLY A 429 4.700 -11.884 -12.677 1.00 13.32 H new ATOM 0 HA2 GLY A 429 5.488 -13.697 -11.006 1.00 14.42 H new ATOM 0 HA3 GLY A 429 6.077 -12.340 -10.065 1.00 14.42 H new ATOM 557 N ASN A 430 3.468 -13.458 -9.159 1.00 11.20 N ATOM 558 CA ASN A 430 2.059 -13.487 -8.569 1.00 62.23 C ATOM 559 C ASN A 430 1.868 -12.445 -7.377 1.00 44.00 C ATOM 560 O ASN A 430 2.806 -12.260 -6.598 1.00 43.44 O ATOM 561 CB ASN A 430 1.761 -14.927 -8.050 1.00 42.22 C ATOM 562 CG ASN A 430 0.288 -15.217 -7.740 1.00 65.41 C ATOM 563 OD1 ASN A 430 -0.616 -14.776 -8.461 1.00 5.54 O ATOM 564 ND2 ASN A 430 0.050 -15.915 -6.613 1.00 35.02 N ATOM 0 H ASN A 430 4.073 -14.201 -8.809 1.00 11.20 H new ATOM 0 HA ASN A 430 1.364 -13.202 -9.358 1.00 62.23 H new ATOM 0 HB2 ASN A 430 2.107 -15.643 -8.795 1.00 42.22 H new ATOM 0 HB3 ASN A 430 2.347 -15.099 -7.147 1.00 42.22 H new ATOM 0 HD21 ASN A 430 -0.910 -16.101 -6.321 1.00 35.02 H new ATOM 0 HD22 ASN A 430 0.829 -16.258 -6.051 1.00 35.02 H new ATOM 571 N VAL A 431 0.660 -11.771 -7.236 1.00 12.44 N ATOM 572 CA VAL A 431 0.371 -10.817 -6.096 1.00 0.42 C ATOM 573 C VAL A 431 -0.198 -11.575 -4.841 1.00 0.34 C ATOM 574 O VAL A 431 -0.827 -12.629 -5.007 1.00 73.42 O ATOM 575 CB VAL A 431 -0.688 -9.670 -6.414 1.00 1.54 C ATOM 576 CG1 VAL A 431 -0.395 -8.806 -7.645 1.00 72.54 C ATOM 577 CG2 VAL A 431 -2.152 -10.163 -6.470 1.00 45.02 C ATOM 0 H VAL A 431 -0.115 -11.873 -7.891 1.00 12.44 H new ATOM 0 HA VAL A 431 1.344 -10.360 -5.916 1.00 0.42 H new ATOM 0 HB VAL A 431 -0.564 -9.025 -5.544 1.00 1.54 H new ATOM 0 HG11 VAL A 431 -1.182 -8.061 -7.762 1.00 72.54 H new ATOM 0 HG12 VAL A 431 0.564 -8.304 -7.517 1.00 72.54 H new ATOM 0 HG13 VAL A 431 -0.359 -9.438 -8.533 1.00 72.54 H new ATOM 0 HG21 VAL A 431 -2.811 -9.323 -6.691 1.00 45.02 H new ATOM 0 HG22 VAL A 431 -2.252 -10.918 -7.250 1.00 45.02 H new ATOM 0 HG23 VAL A 431 -2.427 -10.596 -5.508 1.00 45.02 H new ATOM 587 N ILE A 432 0.042 -11.089 -3.577 1.00 42.14 N ATOM 588 CA ILE A 432 -0.761 -11.646 -2.405 1.00 71.44 C ATOM 589 C ILE A 432 -1.582 -10.533 -1.676 1.00 55.42 C ATOM 590 O ILE A 432 -2.808 -10.619 -1.629 1.00 23.51 O ATOM 591 CB ILE A 432 -0.004 -12.629 -1.357 1.00 12.31 C ATOM 592 CG1 ILE A 432 1.295 -13.323 -1.914 1.00 1.02 C ATOM 593 CG2 ILE A 432 -0.949 -13.787 -0.941 1.00 72.15 C ATOM 594 CD1 ILE A 432 1.862 -14.547 -1.086 1.00 32.14 C ATOM 0 H ILE A 432 0.726 -10.370 -3.342 1.00 42.14 H new ATOM 0 HA ILE A 432 -1.442 -12.334 -2.906 1.00 71.44 H new ATOM 0 HB ILE A 432 0.278 -11.973 -0.533 1.00 12.31 H new ATOM 0 HG12 ILE A 432 1.089 -13.665 -2.928 1.00 1.02 H new ATOM 0 HG13 ILE A 432 2.079 -12.569 -1.985 1.00 1.02 H new ATOM 0 HG21 ILE A 432 -0.434 -14.442 -0.238 1.00 72.15 H new ATOM 0 HG22 ILE A 432 -1.841 -13.377 -0.468 1.00 72.15 H new ATOM 0 HG23 ILE A 432 -1.237 -14.357 -1.824 1.00 72.15 H new ATOM 0 HD11 ILE A 432 2.756 -14.934 -1.575 1.00 32.14 H new ATOM 0 HD12 ILE A 432 2.113 -14.219 -0.077 1.00 32.14 H new ATOM 0 HD13 ILE A 432 1.108 -15.332 -1.035 1.00 32.14 H new ATOM 606 N SER A 433 -0.933 -9.468 -1.119 1.00 73.31 N ATOM 607 CA SER A 433 -1.702 -8.392 -0.368 1.00 5.11 C ATOM 608 C SER A 433 -1.182 -6.951 -0.711 1.00 15.22 C ATOM 609 O SER A 433 0.036 -6.794 -0.848 1.00 22.25 O ATOM 610 CB SER A 433 -1.633 -8.659 1.173 1.00 23.03 C ATOM 611 OG SER A 433 -2.318 -9.857 1.486 1.00 14.55 O ATOM 0 H SER A 433 0.075 -9.321 -1.163 1.00 73.31 H new ATOM 0 HA SER A 433 -2.742 -8.439 -0.689 1.00 5.11 H new ATOM 0 HB2 SER A 433 -0.593 -8.731 1.492 1.00 23.03 H new ATOM 0 HB3 SER A 433 -2.076 -7.824 1.716 1.00 23.03 H new ATOM 0 HG SER A 433 -2.549 -9.862 2.438 1.00 14.55 H new ATOM 617 N ALA A 434 -2.076 -5.887 -0.897 1.00 64.32 N ATOM 618 CA ALA A 434 -1.558 -4.480 -1.041 1.00 74.24 C ATOM 619 C ALA A 434 -2.352 -3.390 -0.359 1.00 3.44 C ATOM 620 O ALA A 434 -3.581 -3.446 -0.252 1.00 44.14 O ATOM 621 CB ALA A 434 -1.498 -4.054 -2.475 1.00 4.01 C ATOM 0 H ALA A 434 -3.090 -5.982 -0.946 1.00 64.32 H new ATOM 0 HA ALA A 434 -0.584 -4.564 -0.558 1.00 74.24 H new ATOM 0 HB1 ALA A 434 -1.119 -3.034 -2.536 1.00 4.01 H new ATOM 0 HB2 ALA A 434 -0.834 -4.721 -3.025 1.00 4.01 H new ATOM 0 HB3 ALA A 434 -2.497 -4.097 -2.909 1.00 4.01 H new ATOM 627 N LYS A 435 -1.587 -2.354 0.063 1.00 34.34 N ATOM 628 CA LYS A 435 -2.139 -1.067 0.548 1.00 15.42 C ATOM 629 C LYS A 435 -1.111 0.071 0.407 1.00 62.52 C ATOM 630 O LYS A 435 0.088 -0.168 0.550 1.00 62.14 O ATOM 631 CB LYS A 435 -2.550 -1.141 2.025 1.00 74.23 C ATOM 632 CG LYS A 435 -1.969 -2.314 2.792 1.00 20.03 C ATOM 633 CD LYS A 435 -2.298 -2.226 4.268 1.00 61.14 C ATOM 634 CE LYS A 435 -1.643 -1.024 4.925 1.00 1.14 C ATOM 635 NZ LYS A 435 -0.208 -0.915 4.549 1.00 4.40 N ATOM 0 H LYS A 435 -0.568 -2.388 0.076 1.00 34.34 H new ATOM 0 HA LYS A 435 -3.015 -0.865 -0.069 1.00 15.42 H new ATOM 0 HB2 LYS A 435 -2.247 -0.217 2.518 1.00 74.23 H new ATOM 0 HB3 LYS A 435 -3.637 -1.191 2.082 1.00 74.23 H new ATOM 0 HG2 LYS A 435 -2.360 -3.246 2.385 1.00 20.03 H new ATOM 0 HG3 LYS A 435 -0.887 -2.338 2.659 1.00 20.03 H new ATOM 0 HD2 LYS A 435 -3.379 -2.165 4.396 1.00 61.14 H new ATOM 0 HD3 LYS A 435 -1.969 -3.137 4.768 1.00 61.14 H new ATOM 0 HE2 LYS A 435 -2.168 -0.115 4.630 1.00 1.14 H new ATOM 0 HE3 LYS A 435 -1.732 -1.106 6.008 1.00 1.14 H new ATOM 0 HZ1 LYS A 435 0.275 -0.268 5.205 1.00 4.40 H new ATOM 0 HZ2 LYS A 435 0.236 -1.854 4.599 1.00 4.40 H new ATOM 0 HZ3 LYS A 435 -0.130 -0.546 3.580 1.00 4.40 H new ATOM 649 N VAL A 436 -1.574 1.325 0.166 1.00 35.41 N ATOM 650 CA VAL A 436 -0.695 2.505 0.352 1.00 33.24 C ATOM 651 C VAL A 436 -1.207 3.169 1.607 1.00 21.13 C ATOM 652 O VAL A 436 -2.430 3.225 1.773 1.00 52.50 O ATOM 653 CB VAL A 436 -0.687 3.618 -0.801 1.00 71.24 C ATOM 654 CG1 VAL A 436 0.746 4.063 -1.177 1.00 51.03 C ATOM 655 CG2 VAL A 436 -1.507 3.255 -2.051 1.00 62.40 C ATOM 0 H VAL A 436 -2.520 1.540 -0.148 1.00 35.41 H new ATOM 0 HA VAL A 436 0.329 2.131 0.367 1.00 33.24 H new ATOM 0 HB VAL A 436 -1.201 4.470 -0.356 1.00 71.24 H new ATOM 0 HG11 VAL A 436 0.698 4.818 -1.962 1.00 51.03 H new ATOM 0 HG12 VAL A 436 1.239 4.482 -0.300 1.00 51.03 H new ATOM 0 HG13 VAL A 436 1.312 3.203 -1.535 1.00 51.03 H new ATOM 0 HG21 VAL A 436 -1.443 4.066 -2.776 1.00 62.40 H new ATOM 0 HG22 VAL A 436 -1.111 2.341 -2.493 1.00 62.40 H new ATOM 0 HG23 VAL A 436 -2.549 3.100 -1.770 1.00 62.40 H new ATOM 665 N PHE A 437 -0.346 3.623 2.540 1.00 52.11 N ATOM 666 CA PHE A 437 -0.860 4.522 3.543 1.00 30.43 C ATOM 667 C PHE A 437 -1.125 5.903 2.906 1.00 22.01 C ATOM 668 O PHE A 437 -0.206 6.701 2.694 1.00 52.30 O ATOM 669 CB PHE A 437 0.091 4.587 4.734 1.00 30.23 C ATOM 670 CG PHE A 437 -0.009 3.389 5.647 1.00 0.25 C ATOM 671 CD1 PHE A 437 -1.211 3.116 6.280 1.00 55.14 C ATOM 672 CD2 PHE A 437 1.071 2.540 5.870 1.00 11.52 C ATOM 673 CE1 PHE A 437 -1.346 2.027 7.113 1.00 0.23 C ATOM 674 CE2 PHE A 437 0.939 1.444 6.707 1.00 41.25 C ATOM 675 CZ PHE A 437 -0.269 1.186 7.328 1.00 35.00 C ATOM 0 H PHE A 437 0.645 3.390 2.606 1.00 52.11 H new ATOM 0 HA PHE A 437 -1.811 4.153 3.928 1.00 30.43 H new ATOM 0 HB2 PHE A 437 1.114 4.671 4.368 1.00 30.23 H new ATOM 0 HB3 PHE A 437 -0.118 5.490 5.308 1.00 30.23 H new ATOM 0 HD1 PHE A 437 -2.056 3.768 6.118 1.00 55.14 H new ATOM 0 HD2 PHE A 437 2.017 2.737 5.388 1.00 11.52 H new ATOM 0 HE1 PHE A 437 -2.291 1.830 7.597 1.00 0.23 H new ATOM 0 HE2 PHE A 437 1.782 0.790 6.875 1.00 41.25 H new ATOM 0 HZ PHE A 437 -0.371 0.330 7.979 1.00 35.00 H new ATOM 685 N ILE A 438 -2.397 6.134 2.570 1.00 60.53 N ATOM 686 CA ILE A 438 -2.836 7.409 1.964 1.00 14.02 C ATOM 687 C ILE A 438 -4.110 7.894 2.709 1.00 71.22 C ATOM 688 O ILE A 438 -5.127 7.187 2.691 1.00 23.13 O ATOM 689 CB ILE A 438 -3.100 7.296 0.352 1.00 32.01 C ATOM 690 CG1 ILE A 438 -3.813 8.566 -0.209 1.00 42.45 C ATOM 691 CG2 ILE A 438 -3.894 6.011 -0.055 1.00 40.42 C ATOM 692 CD1 ILE A 438 -4.106 8.536 -1.718 1.00 54.12 C ATOM 0 H ILE A 438 -3.148 5.457 2.705 1.00 60.53 H new ATOM 0 HA ILE A 438 -2.032 8.136 2.076 1.00 14.02 H new ATOM 0 HB ILE A 438 -2.110 7.220 -0.098 1.00 32.01 H new ATOM 0 HG12 ILE A 438 -4.753 8.702 0.325 1.00 42.45 H new ATOM 0 HG13 ILE A 438 -3.194 9.437 0.008 1.00 42.45 H new ATOM 0 HG21 ILE A 438 -4.035 5.997 -1.136 1.00 40.42 H new ATOM 0 HG22 ILE A 438 -3.335 5.126 0.249 1.00 40.42 H new ATOM 0 HG23 ILE A 438 -4.866 6.013 0.438 1.00 40.42 H new ATOM 0 HD11 ILE A 438 -4.602 9.461 -2.011 1.00 54.12 H new ATOM 0 HD12 ILE A 438 -3.170 8.436 -2.268 1.00 54.12 H new ATOM 0 HD13 ILE A 438 -4.754 7.689 -1.946 1.00 54.12 H new ATOM 704 N ASP A 439 -4.066 9.039 3.451 1.00 52.43 N ATOM 705 CA ASP A 439 -5.303 9.701 3.827 1.00 3.04 C ATOM 706 C ASP A 439 -5.928 10.295 2.536 1.00 11.11 C ATOM 707 O ASP A 439 -5.468 11.337 2.056 1.00 3.34 O ATOM 708 CB ASP A 439 -5.004 10.736 4.951 1.00 62.33 C ATOM 709 CG ASP A 439 -4.630 10.022 6.235 1.00 32.52 C ATOM 710 OD1 ASP A 439 -5.541 9.724 7.035 1.00 11.41 O ATOM 711 OD2 ASP A 439 -3.429 9.736 6.432 1.00 62.24 O ATOM 0 H ASP A 439 -3.212 9.491 3.779 1.00 52.43 H new ATOM 0 HA ASP A 439 -6.041 9.020 4.251 1.00 3.04 H new ATOM 0 HB2 ASP A 439 -4.192 11.394 4.643 1.00 62.33 H new ATOM 0 HB3 ASP A 439 -5.878 11.365 5.118 1.00 62.33 H new ATOM 716 N LYS A 440 -6.945 9.558 1.936 1.00 52.31 N ATOM 717 CA LYS A 440 -7.446 9.775 0.541 1.00 14.23 C ATOM 718 C LYS A 440 -8.065 11.174 0.258 1.00 1.30 C ATOM 719 O LYS A 440 -8.481 11.411 -0.876 1.00 70.54 O ATOM 720 CB LYS A 440 -8.471 8.680 0.098 1.00 31.44 C ATOM 721 CG LYS A 440 -7.993 7.213 0.236 1.00 52.42 C ATOM 722 CD LYS A 440 -8.358 6.568 1.584 1.00 14.11 C ATOM 723 CE LYS A 440 -9.814 6.105 1.631 1.00 60.43 C ATOM 724 NZ LYS A 440 -9.986 4.760 1.016 1.00 74.52 N ATOM 0 H LYS A 440 -7.429 8.801 2.419 1.00 52.31 H new ATOM 0 HA LYS A 440 -6.533 9.706 -0.051 1.00 14.23 H new ATOM 0 HB2 LYS A 440 -9.381 8.802 0.685 1.00 31.44 H new ATOM 0 HB3 LYS A 440 -8.737 8.859 -0.944 1.00 31.44 H new ATOM 0 HG2 LYS A 440 -8.428 6.621 -0.569 1.00 52.42 H new ATOM 0 HG3 LYS A 440 -6.911 7.179 0.108 1.00 52.42 H new ATOM 0 HD2 LYS A 440 -7.702 5.716 1.766 1.00 14.11 H new ATOM 0 HD3 LYS A 440 -8.181 7.284 2.387 1.00 14.11 H new ATOM 0 HE2 LYS A 440 -10.154 6.077 2.666 1.00 60.43 H new ATOM 0 HE3 LYS A 440 -10.442 6.827 1.109 1.00 60.43 H new ATOM 0 HZ1 LYS A 440 -10.986 4.480 1.067 1.00 74.52 H new ATOM 0 HZ2 LYS A 440 -9.686 4.792 0.021 1.00 74.52 H new ATOM 0 HZ3 LYS A 440 -9.406 4.066 1.530 1.00 74.52 H new ATOM 738 N GLN A 441 -8.160 12.066 1.275 1.00 63.34 N ATOM 739 CA GLN A 441 -8.675 13.442 1.095 1.00 33.24 C ATOM 740 C GLN A 441 -8.012 14.260 -0.050 1.00 45.42 C ATOM 741 O GLN A 441 -8.724 14.699 -0.956 1.00 5.32 O ATOM 742 CB GLN A 441 -8.586 14.254 2.418 1.00 41.12 C ATOM 743 CG GLN A 441 -9.609 13.889 3.521 1.00 63.13 C ATOM 744 CD GLN A 441 -9.306 14.595 4.835 1.00 43.41 C ATOM 745 OE1 GLN A 441 -8.159 14.923 5.134 1.00 31.33 O ATOM 746 NE2 GLN A 441 -10.334 14.826 5.637 1.00 14.10 N ATOM 0 H GLN A 441 -7.884 11.853 2.234 1.00 63.34 H new ATOM 0 HA GLN A 441 -9.714 13.294 0.800 1.00 33.24 H new ATOM 0 HB2 GLN A 441 -7.584 14.130 2.828 1.00 41.12 H new ATOM 0 HB3 GLN A 441 -8.704 15.311 2.179 1.00 41.12 H new ATOM 0 HG2 GLN A 441 -10.612 14.157 3.188 1.00 63.13 H new ATOM 0 HG3 GLN A 441 -9.603 12.811 3.679 1.00 63.13 H new ATOM 0 HE21 GLN A 441 -11.273 14.541 5.358 1.00 14.10 H new ATOM 0 HE22 GLN A 441 -10.187 15.289 6.534 1.00 14.10 H new ATOM 755 N THR A 442 -6.686 14.475 -0.038 1.00 10.53 N ATOM 756 CA THR A 442 -6.040 15.288 -1.077 1.00 62.35 C ATOM 757 C THR A 442 -4.991 14.502 -1.918 1.00 62.24 C ATOM 758 O THR A 442 -4.225 15.158 -2.642 1.00 15.14 O ATOM 759 CB THR A 442 -5.424 16.618 -0.492 1.00 21.02 C ATOM 760 OG1 THR A 442 -4.761 16.363 0.750 1.00 11.43 O ATOM 761 CG2 THR A 442 -6.495 17.689 -0.276 1.00 51.54 C ATOM 0 H THR A 442 -6.051 14.103 0.668 1.00 10.53 H new ATOM 0 HA THR A 442 -6.839 15.564 -1.766 1.00 62.35 H new ATOM 0 HB THR A 442 -4.705 16.986 -1.224 1.00 21.02 H new ATOM 0 HG1 THR A 442 -4.384 17.198 1.097 1.00 11.43 H new ATOM 0 HG21 THR A 442 -6.033 18.590 0.128 1.00 51.54 H new ATOM 0 HG22 THR A 442 -6.974 17.922 -1.227 1.00 51.54 H new ATOM 0 HG23 THR A 442 -7.243 17.319 0.426 1.00 51.54 H new ATOM 769 N ASN A 443 -4.948 13.110 -1.815 1.00 43.11 N ATOM 770 CA ASN A 443 -4.007 12.258 -2.565 1.00 73.12 C ATOM 771 C ASN A 443 -2.586 12.429 -2.028 1.00 2.22 C ATOM 772 O ASN A 443 -1.600 12.409 -2.777 1.00 51.34 O ATOM 773 CB ASN A 443 -4.095 12.502 -4.086 1.00 50.34 C ATOM 774 CG ASN A 443 -3.701 11.280 -4.927 1.00 44.11 C ATOM 775 OD1 ASN A 443 -2.539 11.113 -5.292 1.00 22.11 O ATOM 776 ND2 ASN A 443 -4.671 10.413 -5.242 1.00 61.05 N ATOM 0 H ASN A 443 -5.573 12.582 -1.206 1.00 43.11 H new ATOM 0 HA ASN A 443 -4.294 11.218 -2.411 1.00 73.12 H new ATOM 0 HB2 ASN A 443 -5.114 12.795 -4.340 1.00 50.34 H new ATOM 0 HB3 ASN A 443 -3.448 13.338 -4.350 1.00 50.34 H new ATOM 0 HD21 ASN A 443 -4.455 9.587 -5.800 1.00 61.05 H new ATOM 0 HD22 ASN A 443 -5.626 10.579 -4.924 1.00 61.05 H new ATOM 783 N LEU A 444 -2.466 12.565 -0.705 1.00 55.42 N ATOM 784 CA LEU A 444 -1.087 12.613 -0.133 1.00 24.15 C ATOM 785 C LEU A 444 -0.681 11.155 0.237 1.00 2.14 C ATOM 786 O LEU A 444 -1.416 10.503 0.987 1.00 22.40 O ATOM 787 CB LEU A 444 -0.900 13.694 1.067 1.00 33.44 C ATOM 788 CG LEU A 444 -1.232 13.362 2.580 1.00 64.22 C ATOM 789 CD1 LEU A 444 -0.210 12.443 3.284 1.00 4.32 C ATOM 790 CD2 LEU A 444 -1.322 14.639 3.435 1.00 21.44 C ATOM 0 H LEU A 444 -3.234 12.640 -0.038 1.00 55.42 H new ATOM 0 HA LEU A 444 -0.394 12.996 -0.882 1.00 24.15 H new ATOM 0 HB2 LEU A 444 0.143 14.010 1.040 1.00 33.44 H new ATOM 0 HB3 LEU A 444 -1.503 14.562 0.800 1.00 33.44 H new ATOM 0 HG LEU A 444 -2.187 12.840 2.514 1.00 64.22 H new ATOM 0 HD11 LEU A 444 -0.523 12.273 4.314 1.00 4.32 H new ATOM 0 HD12 LEU A 444 -0.156 11.489 2.759 1.00 4.32 H new ATOM 0 HD13 LEU A 444 0.771 12.917 3.276 1.00 4.32 H new ATOM 0 HD21 LEU A 444 -1.551 14.371 4.466 1.00 21.44 H new ATOM 0 HD22 LEU A 444 -0.369 15.168 3.401 1.00 21.44 H new ATOM 0 HD23 LEU A 444 -2.109 15.284 3.044 1.00 21.44 H new ATOM 802 N SER A 445 0.434 10.573 -0.336 1.00 1.50 N ATOM 803 CA SER A 445 0.942 9.305 0.198 1.00 71.44 C ATOM 804 C SER A 445 2.015 9.581 1.247 1.00 34.20 C ATOM 805 O SER A 445 2.608 10.665 1.257 1.00 34.12 O ATOM 806 CB SER A 445 1.507 8.419 -0.932 1.00 43.54 C ATOM 807 OG SER A 445 2.453 9.130 -1.722 1.00 10.34 O ATOM 0 H SER A 445 0.956 10.957 -1.124 1.00 1.50 H new ATOM 0 HA SER A 445 0.117 8.767 0.665 1.00 71.44 H new ATOM 0 HB2 SER A 445 1.979 7.535 -0.503 1.00 43.54 H new ATOM 0 HB3 SER A 445 0.691 8.069 -1.565 1.00 43.54 H new ATOM 0 HG SER A 445 2.795 8.544 -2.429 1.00 10.34 H new ATOM 813 N LYS A 446 2.289 8.602 2.130 1.00 15.42 N ATOM 814 CA LYS A 446 3.356 8.743 3.124 1.00 2.33 C ATOM 815 C LYS A 446 4.747 8.523 2.523 1.00 44.11 C ATOM 816 O LYS A 446 5.711 8.388 3.274 1.00 41.21 O ATOM 817 CB LYS A 446 3.138 7.740 4.258 1.00 22.14 C ATOM 818 CG LYS A 446 1.867 7.975 5.059 1.00 74.52 C ATOM 819 CD LYS A 446 1.836 7.128 6.324 1.00 32.43 C ATOM 820 CE LYS A 446 0.571 7.397 7.120 1.00 22.43 C ATOM 821 NZ LYS A 446 0.422 6.456 8.262 1.00 54.11 N ATOM 0 H LYS A 446 1.788 7.714 2.171 1.00 15.42 H new ATOM 0 HA LYS A 446 3.313 9.765 3.500 1.00 2.33 H new ATOM 0 HB2 LYS A 446 3.110 6.734 3.839 1.00 22.14 H new ATOM 0 HB3 LYS A 446 3.993 7.780 4.933 1.00 22.14 H new ATOM 0 HG2 LYS A 446 1.794 9.030 5.325 1.00 74.52 H new ATOM 0 HG3 LYS A 446 0.999 7.741 4.442 1.00 74.52 H new ATOM 0 HD2 LYS A 446 1.888 6.071 6.061 1.00 32.43 H new ATOM 0 HD3 LYS A 446 2.710 7.348 6.936 1.00 32.43 H new ATOM 0 HE2 LYS A 446 0.588 8.421 7.494 1.00 22.43 H new ATOM 0 HE3 LYS A 446 -0.295 7.312 6.464 1.00 22.43 H new ATOM 0 HZ1 LYS A 446 -0.454 6.674 8.779 1.00 54.11 H new ATOM 0 HZ2 LYS A 446 0.380 5.480 7.905 1.00 54.11 H new ATOM 0 HZ3 LYS A 446 1.236 6.555 8.902 1.00 54.11 H new ATOM 835 N CYS A 447 4.823 8.514 1.165 1.00 24.33 N ATOM 836 CA CYS A 447 6.002 8.126 0.378 1.00 70.10 C ATOM 837 C CYS A 447 6.632 6.827 0.892 1.00 13.41 C ATOM 838 O CYS A 447 7.845 6.668 0.863 1.00 51.24 O ATOM 839 CB CYS A 447 7.033 9.284 0.246 1.00 43.23 C ATOM 840 SG CYS A 447 7.856 9.871 1.769 1.00 40.30 S ATOM 0 H CYS A 447 4.034 8.787 0.579 1.00 24.33 H new ATOM 0 HA CYS A 447 5.653 7.919 -0.634 1.00 70.10 H new ATOM 0 HB2 CYS A 447 7.808 8.965 -0.451 1.00 43.23 H new ATOM 0 HB3 CYS A 447 6.525 10.134 -0.209 1.00 43.23 H new ATOM 0 HG CYS A 447 7.210 9.432 2.808 1.00 40.30 H new ATOM 846 N PHE A 448 5.772 5.882 1.307 1.00 24.52 N ATOM 847 CA PHE A 448 6.233 4.621 1.886 1.00 74.43 C ATOM 848 C PHE A 448 5.191 3.506 1.596 1.00 41.03 C ATOM 849 O PHE A 448 4.014 3.626 1.956 1.00 14.31 O ATOM 850 CB PHE A 448 6.537 4.809 3.422 1.00 54.51 C ATOM 851 CG PHE A 448 8.020 4.807 3.780 1.00 44.53 C ATOM 852 CD1 PHE A 448 8.734 3.612 3.840 1.00 44.11 C ATOM 853 CD2 PHE A 448 8.709 5.996 4.037 1.00 4.22 C ATOM 854 CE1 PHE A 448 10.084 3.602 4.147 1.00 0.42 C ATOM 855 CE2 PHE A 448 10.057 5.985 4.334 1.00 52.21 C ATOM 856 CZ PHE A 448 10.746 4.790 4.389 1.00 15.55 C ATOM 0 H PHE A 448 4.758 5.972 1.250 1.00 24.52 H new ATOM 0 HA PHE A 448 7.170 4.309 1.424 1.00 74.43 H new ATOM 0 HB2 PHE A 448 6.098 5.750 3.754 1.00 54.51 H new ATOM 0 HB3 PHE A 448 6.041 4.013 3.977 1.00 54.51 H new ATOM 0 HD1 PHE A 448 8.226 2.679 3.644 1.00 44.11 H new ATOM 0 HD2 PHE A 448 8.179 6.936 4.003 1.00 4.22 H new ATOM 0 HE1 PHE A 448 10.619 2.665 4.197 1.00 0.42 H new ATOM 0 HE2 PHE A 448 10.574 6.914 4.524 1.00 52.21 H new ATOM 0 HZ PHE A 448 11.801 4.784 4.621 1.00 15.55 H new ATOM 866 N GLY A 449 5.655 2.443 0.911 1.00 64.41 N ATOM 867 CA GLY A 449 4.802 1.267 0.526 1.00 55.01 C ATOM 868 C GLY A 449 5.414 -0.088 0.926 1.00 22.34 C ATOM 869 O GLY A 449 6.510 -0.096 1.457 1.00 64.44 O ATOM 0 H GLY A 449 6.624 2.361 0.603 1.00 64.41 H new ATOM 0 HA2 GLY A 449 3.823 1.368 0.995 1.00 55.01 H new ATOM 0 HA3 GLY A 449 4.642 1.281 -0.552 1.00 55.01 H new ATOM 873 N PHE A 450 4.685 -1.228 0.701 1.00 3.40 N ATOM 874 CA PHE A 450 5.253 -2.631 0.914 1.00 65.24 C ATOM 875 C PHE A 450 4.479 -3.662 0.004 1.00 5.54 C ATOM 876 O PHE A 450 3.318 -3.363 -0.305 1.00 3.44 O ATOM 877 CB PHE A 450 5.263 -3.014 2.464 1.00 32.35 C ATOM 878 CG PHE A 450 3.993 -3.616 3.089 1.00 64.35 C ATOM 879 CD1 PHE A 450 3.566 -4.912 2.788 1.00 42.21 C ATOM 880 CD2 PHE A 450 3.239 -2.884 4.009 1.00 70.44 C ATOM 881 CE1 PHE A 450 2.428 -5.440 3.363 1.00 42.14 C ATOM 882 CE2 PHE A 450 2.102 -3.419 4.583 1.00 21.15 C ATOM 883 CZ PHE A 450 1.698 -4.695 4.258 1.00 2.43 C ATOM 0 H PHE A 450 3.718 -1.220 0.377 1.00 3.40 H new ATOM 0 HA PHE A 450 6.297 -2.661 0.603 1.00 65.24 H new ATOM 0 HB2 PHE A 450 6.076 -3.722 2.623 1.00 32.35 H new ATOM 0 HB3 PHE A 450 5.511 -2.113 3.025 1.00 32.35 H new ATOM 0 HD1 PHE A 450 4.136 -5.511 2.093 1.00 42.21 H new ATOM 0 HD2 PHE A 450 3.550 -1.885 4.276 1.00 70.44 H new ATOM 0 HE1 PHE A 450 2.110 -6.441 3.109 1.00 42.14 H new ATOM 0 HE2 PHE A 450 1.529 -2.835 5.288 1.00 21.15 H new ATOM 0 HZ PHE A 450 0.808 -5.110 4.706 1.00 2.43 H new ATOM 893 N VAL A 451 5.048 -4.874 -0.432 1.00 35.21 N ATOM 894 CA VAL A 451 4.179 -5.856 -1.189 1.00 71.34 C ATOM 895 C VAL A 451 4.711 -7.359 -1.162 1.00 44.30 C ATOM 896 O VAL A 451 5.905 -7.577 -0.922 1.00 35.34 O ATOM 897 CB VAL A 451 3.818 -5.279 -2.655 1.00 4.31 C ATOM 898 CG1 VAL A 451 5.051 -5.001 -3.493 1.00 13.20 C ATOM 899 CG2 VAL A 451 2.859 -6.151 -3.476 1.00 41.12 C ATOM 0 H VAL A 451 6.015 -5.161 -0.282 1.00 35.21 H new ATOM 0 HA VAL A 451 3.235 -5.943 -0.651 1.00 71.34 H new ATOM 0 HB VAL A 451 3.301 -4.347 -2.428 1.00 4.31 H new ATOM 0 HG11 VAL A 451 4.750 -4.615 -4.467 1.00 13.20 H new ATOM 0 HG12 VAL A 451 5.675 -4.264 -2.988 1.00 13.20 H new ATOM 0 HG13 VAL A 451 5.616 -5.924 -3.627 1.00 13.20 H new ATOM 0 HG21 VAL A 451 2.677 -5.681 -4.443 1.00 41.12 H new ATOM 0 HG22 VAL A 451 3.302 -7.135 -3.628 1.00 41.12 H new ATOM 0 HG23 VAL A 451 1.915 -6.257 -2.941 1.00 41.12 H new ATOM 909 N SER A 452 3.803 -8.393 -1.387 1.00 73.24 N ATOM 910 CA SER A 452 4.093 -9.814 -1.114 1.00 42.14 C ATOM 911 C SER A 452 4.276 -10.622 -2.458 1.00 72.13 C ATOM 912 O SER A 452 3.346 -10.648 -3.275 1.00 54.14 O ATOM 913 CB SER A 452 2.891 -10.344 -0.255 1.00 23.41 C ATOM 914 OG SER A 452 3.253 -11.509 0.472 1.00 41.34 O ATOM 0 H SER A 452 2.867 -8.235 -1.760 1.00 73.24 H new ATOM 0 HA SER A 452 5.031 -9.940 -0.572 1.00 42.14 H new ATOM 0 HB2 SER A 452 2.565 -9.567 0.437 1.00 23.41 H new ATOM 0 HB3 SER A 452 2.046 -10.567 -0.906 1.00 23.41 H new ATOM 0 HG SER A 452 2.487 -11.817 1.000 1.00 41.34 H new ATOM 920 N TYR A 453 5.475 -11.265 -2.705 1.00 32.13 N ATOM 921 CA TYR A 453 5.762 -11.932 -3.998 1.00 3.12 C ATOM 922 C TYR A 453 6.132 -13.426 -3.713 1.00 50.53 C ATOM 923 O TYR A 453 6.844 -13.638 -2.732 1.00 22.00 O ATOM 924 CB TYR A 453 6.955 -11.100 -4.579 1.00 33.14 C ATOM 925 CG TYR A 453 7.048 -10.704 -6.083 1.00 32.43 C ATOM 926 CD1 TYR A 453 6.059 -9.935 -6.741 1.00 41.34 C ATOM 927 CD2 TYR A 453 8.214 -10.921 -6.798 1.00 64.33 C ATOM 928 CE1 TYR A 453 6.249 -9.449 -8.032 1.00 31.14 C ATOM 929 CE2 TYR A 453 8.387 -10.388 -8.064 1.00 13.02 C ATOM 930 CZ TYR A 453 7.417 -9.676 -8.655 1.00 73.44 C ATOM 931 OH TYR A 453 7.663 -9.115 -9.868 1.00 0.33 O ATOM 0 H TYR A 453 6.234 -11.325 -2.027 1.00 32.13 H new ATOM 0 HA TYR A 453 4.931 -11.959 -4.703 1.00 3.12 H new ATOM 0 HB2 TYR A 453 6.994 -10.171 -4.010 1.00 33.14 H new ATOM 0 HB3 TYR A 453 7.864 -11.655 -4.346 1.00 33.14 H new ATOM 0 HD1 TYR A 453 5.133 -9.719 -6.229 1.00 41.34 H new ATOM 0 HD2 TYR A 453 9.002 -11.516 -6.361 1.00 64.33 H new ATOM 0 HE1 TYR A 453 5.465 -8.895 -8.527 1.00 31.14 H new ATOM 0 HE2 TYR A 453 9.320 -10.549 -8.584 1.00 13.02 H new ATOM 0 HH TYR A 453 7.700 -8.140 -9.776 1.00 0.33 H new ATOM 941 N ASP A 454 5.622 -14.441 -4.533 1.00 15.20 N ATOM 942 CA ASP A 454 5.810 -15.911 -4.248 1.00 13.40 C ATOM 943 C ASP A 454 7.187 -16.332 -3.683 1.00 54.34 C ATOM 944 O ASP A 454 7.321 -16.533 -2.465 1.00 24.23 O ATOM 945 CB ASP A 454 5.515 -16.785 -5.481 1.00 22.41 C ATOM 946 CG ASP A 454 4.046 -16.852 -5.825 1.00 71.42 C ATOM 947 OD1 ASP A 454 3.217 -16.621 -4.930 1.00 54.02 O ATOM 948 OD2 ASP A 454 3.728 -17.170 -6.992 1.00 1.10 O ATOM 0 H ASP A 454 5.087 -14.255 -5.381 1.00 15.20 H new ATOM 0 HA ASP A 454 5.081 -16.081 -3.456 1.00 13.40 H new ATOM 0 HB2 ASP A 454 6.064 -16.392 -6.337 1.00 22.41 H new ATOM 0 HB3 ASP A 454 5.886 -17.794 -5.300 1.00 22.41 H new ATOM 953 N ASN A 455 8.192 -16.483 -4.551 1.00 60.31 N ATOM 954 CA ASN A 455 9.471 -17.078 -4.149 1.00 32.35 C ATOM 955 C ASN A 455 10.665 -16.366 -4.813 1.00 63.14 C ATOM 956 O ASN A 455 10.608 -16.113 -5.995 1.00 74.24 O ATOM 957 CB ASN A 455 9.433 -18.585 -4.486 1.00 52.35 C ATOM 958 CG ASN A 455 10.286 -19.503 -3.581 1.00 62.30 C ATOM 959 OD1 ASN A 455 11.367 -19.141 -3.119 1.00 12.03 O ATOM 960 ND2 ASN A 455 9.783 -20.719 -3.320 1.00 43.23 N ATOM 0 H ASN A 455 8.146 -16.203 -5.531 1.00 60.31 H new ATOM 0 HA ASN A 455 9.612 -16.953 -3.075 1.00 32.35 H new ATOM 0 HB2 ASN A 455 8.397 -18.922 -4.438 1.00 52.35 H new ATOM 0 HB3 ASN A 455 9.764 -18.715 -5.517 1.00 52.35 H new ATOM 0 HD21 ASN A 455 10.299 -21.368 -2.726 1.00 43.23 H new ATOM 0 HD22 ASN A 455 8.884 -20.995 -3.716 1.00 43.23 H new ATOM 967 N PRO A 456 11.722 -15.978 -4.011 1.00 41.35 N ATOM 968 CA PRO A 456 12.972 -15.259 -4.422 1.00 12.30 C ATOM 969 C PRO A 456 13.612 -15.413 -5.856 1.00 71.12 C ATOM 970 O PRO A 456 14.587 -14.725 -6.100 1.00 1.12 O ATOM 971 CB PRO A 456 14.004 -15.675 -3.375 1.00 61.22 C ATOM 972 CG PRO A 456 13.235 -16.127 -2.174 1.00 1.44 C ATOM 973 CD PRO A 456 11.763 -16.127 -2.522 1.00 75.42 C ATOM 0 HA PRO A 456 12.668 -14.214 -4.484 1.00 12.30 H new ATOM 0 HB2 PRO A 456 14.638 -16.477 -3.753 1.00 61.22 H new ATOM 0 HB3 PRO A 456 14.660 -14.841 -3.124 1.00 61.22 H new ATOM 0 HG2 PRO A 456 13.554 -17.125 -1.873 1.00 1.44 H new ATOM 0 HG3 PRO A 456 13.425 -15.464 -1.330 1.00 1.44 H new ATOM 0 HD2 PRO A 456 11.281 -17.051 -2.204 1.00 75.42 H new ATOM 0 HD3 PRO A 456 11.240 -15.308 -2.028 1.00 75.42 H new ATOM 981 N VAL A 457 13.191 -16.323 -6.784 1.00 73.31 N ATOM 982 CA VAL A 457 13.736 -16.253 -8.155 1.00 62.55 C ATOM 983 C VAL A 457 13.167 -15.009 -8.924 1.00 2.34 C ATOM 984 O VAL A 457 13.757 -14.558 -9.906 1.00 32.50 O ATOM 985 CB VAL A 457 13.627 -17.573 -9.014 1.00 4.04 C ATOM 986 CG1 VAL A 457 14.328 -18.758 -8.351 1.00 5.43 C ATOM 987 CG2 VAL A 457 12.208 -17.954 -9.406 1.00 20.05 C ATOM 0 H VAL A 457 12.516 -17.068 -6.615 1.00 73.31 H new ATOM 0 HA VAL A 457 14.810 -16.131 -8.013 1.00 62.55 H new ATOM 0 HB VAL A 457 14.148 -17.329 -9.940 1.00 4.04 H new ATOM 0 HG11 VAL A 457 14.224 -19.641 -8.981 1.00 5.43 H new ATOM 0 HG12 VAL A 457 15.385 -18.528 -8.220 1.00 5.43 H new ATOM 0 HG13 VAL A 457 13.875 -18.951 -7.378 1.00 5.43 H new ATOM 0 HG21 VAL A 457 12.227 -18.872 -9.994 1.00 20.05 H new ATOM 0 HG22 VAL A 457 11.612 -18.111 -8.507 1.00 20.05 H new ATOM 0 HG23 VAL A 457 11.767 -17.153 -9.999 1.00 20.05 H new ATOM 997 N SER A 458 12.020 -14.476 -8.456 1.00 75.24 N ATOM 998 CA SER A 458 11.482 -13.175 -8.862 1.00 11.51 C ATOM 999 C SER A 458 12.071 -11.969 -7.981 1.00 5.53 C ATOM 1000 O SER A 458 11.820 -10.820 -8.361 1.00 14.34 O ATOM 1001 CB SER A 458 9.918 -13.291 -8.905 1.00 71.10 C ATOM 1002 OG SER A 458 9.411 -13.724 -7.641 1.00 74.12 O ATOM 0 H SER A 458 11.434 -14.954 -7.771 1.00 75.24 H new ATOM 0 HA SER A 458 11.813 -12.910 -9.866 1.00 11.51 H new ATOM 0 HB2 SER A 458 9.483 -12.326 -9.166 1.00 71.10 H new ATOM 0 HB3 SER A 458 9.621 -13.995 -9.682 1.00 71.10 H new ATOM 0 HG SER A 458 8.824 -13.033 -7.270 1.00 74.12 H new ATOM 1008 N ALA A 459 12.833 -12.230 -6.790 1.00 20.03 N ATOM 1009 CA ALA A 459 13.558 -11.145 -5.987 1.00 53.34 C ATOM 1010 C ALA A 459 14.370 -10.138 -6.827 1.00 71.52 C ATOM 1011 O ALA A 459 13.963 -8.985 -7.033 1.00 54.35 O ATOM 1012 CB ALA A 459 14.563 -11.743 -4.987 1.00 73.43 C ATOM 0 H ALA A 459 12.942 -13.165 -6.397 1.00 20.03 H new ATOM 0 HA ALA A 459 12.733 -10.627 -5.498 1.00 53.34 H new ATOM 0 HB1 ALA A 459 15.054 -10.938 -4.439 1.00 73.43 H new ATOM 0 HB2 ALA A 459 14.037 -12.391 -4.286 1.00 73.43 H new ATOM 0 HB3 ALA A 459 15.311 -12.324 -5.526 1.00 73.43 H new ATOM 1018 N GLN A 460 15.445 -10.623 -7.407 1.00 45.51 N ATOM 1019 CA GLN A 460 16.429 -9.754 -8.024 1.00 54.15 C ATOM 1020 C GLN A 460 16.109 -9.395 -9.482 1.00 51.41 C ATOM 1021 O GLN A 460 16.668 -8.410 -9.984 1.00 23.33 O ATOM 1022 CB GLN A 460 17.858 -10.328 -7.902 1.00 61.40 C ATOM 1023 CG GLN A 460 18.617 -10.065 -6.579 1.00 63.23 C ATOM 1024 CD GLN A 460 18.166 -10.907 -5.396 1.00 64.34 C ATOM 1025 OE1 GLN A 460 17.417 -10.444 -4.549 1.00 1.54 O ATOM 1026 NE2 GLN A 460 18.575 -12.169 -5.369 1.00 32.43 N ATOM 0 H GLN A 460 15.663 -11.618 -7.466 1.00 45.51 H new ATOM 0 HA GLN A 460 16.381 -8.822 -7.461 1.00 54.15 H new ATOM 0 HB2 GLN A 460 17.802 -11.406 -8.051 1.00 61.40 H new ATOM 0 HB3 GLN A 460 18.455 -9.924 -8.720 1.00 61.40 H new ATOM 0 HG2 GLN A 460 19.679 -10.242 -6.747 1.00 63.23 H new ATOM 0 HG3 GLN A 460 18.507 -9.012 -6.318 1.00 63.23 H new ATOM 0 HE21 GLN A 460 19.201 -12.518 -6.095 1.00 32.43 H new ATOM 0 HE22 GLN A 460 18.264 -12.790 -4.622 1.00 32.43 H new ATOM 1035 N ALA A 461 15.256 -10.191 -10.189 1.00 24.02 N ATOM 1036 CA ALA A 461 14.867 -9.837 -11.552 1.00 32.21 C ATOM 1037 C ALA A 461 14.078 -8.451 -11.678 1.00 34.21 C ATOM 1038 O ALA A 461 14.430 -7.686 -12.562 1.00 51.43 O ATOM 1039 CB ALA A 461 14.180 -11.016 -12.290 1.00 21.05 C ATOM 0 H ALA A 461 14.844 -11.054 -9.835 1.00 24.02 H new ATOM 0 HA ALA A 461 15.801 -9.647 -12.080 1.00 32.21 H new ATOM 0 HB1 ALA A 461 13.909 -10.705 -13.299 1.00 21.05 H new ATOM 0 HB2 ALA A 461 14.866 -11.861 -12.343 1.00 21.05 H new ATOM 0 HB3 ALA A 461 13.282 -11.311 -11.748 1.00 21.05 H new ATOM 1045 N ALA A 462 13.017 -8.100 -10.851 1.00 62.25 N ATOM 1046 CA ALA A 462 12.390 -6.709 -10.902 1.00 25.24 C ATOM 1047 C ALA A 462 13.064 -5.635 -9.981 1.00 72.31 C ATOM 1048 O ALA A 462 13.112 -4.463 -10.393 1.00 55.34 O ATOM 1049 CB ALA A 462 10.873 -6.803 -10.685 1.00 44.31 C ATOM 0 H ALA A 462 12.593 -8.729 -10.169 1.00 62.25 H new ATOM 0 HA ALA A 462 12.584 -6.331 -11.906 1.00 25.24 H new ATOM 0 HB1 ALA A 462 10.437 -5.805 -10.724 1.00 44.31 H new ATOM 0 HB2 ALA A 462 10.431 -7.422 -11.466 1.00 44.31 H new ATOM 0 HB3 ALA A 462 10.672 -7.249 -9.711 1.00 44.31 H new ATOM 1055 N ILE A 463 13.534 -6.013 -8.747 1.00 61.13 N ATOM 1056 CA ILE A 463 14.323 -5.115 -7.833 1.00 71.22 C ATOM 1057 C ILE A 463 15.383 -4.183 -8.567 1.00 61.33 C ATOM 1058 O ILE A 463 15.495 -3.010 -8.189 1.00 34.23 O ATOM 1059 CB ILE A 463 14.955 -5.923 -6.580 1.00 75.32 C ATOM 1060 CG1 ILE A 463 14.019 -5.857 -5.333 1.00 21.33 C ATOM 1061 CG2 ILE A 463 16.393 -5.545 -6.163 1.00 74.20 C ATOM 1062 CD1 ILE A 463 12.612 -6.451 -5.494 1.00 43.12 C ATOM 0 H ILE A 463 13.378 -6.944 -8.360 1.00 61.13 H new ATOM 0 HA ILE A 463 13.592 -4.415 -7.428 1.00 71.22 H new ATOM 0 HB ILE A 463 15.031 -6.941 -6.962 1.00 75.32 H new ATOM 0 HG12 ILE A 463 14.513 -6.372 -4.509 1.00 21.33 H new ATOM 0 HG13 ILE A 463 13.916 -4.812 -5.040 1.00 21.33 H new ATOM 0 HG21 ILE A 463 16.698 -6.157 -5.314 1.00 74.20 H new ATOM 0 HG22 ILE A 463 17.072 -5.718 -6.998 1.00 74.20 H new ATOM 0 HG23 ILE A 463 16.425 -4.492 -5.882 1.00 74.20 H new ATOM 0 HD11 ILE A 463 12.062 -6.343 -4.559 1.00 43.12 H new ATOM 0 HD12 ILE A 463 12.083 -5.924 -6.288 1.00 43.12 H new ATOM 0 HD13 ILE A 463 12.690 -7.508 -5.749 1.00 43.12 H new ATOM 1074 N GLN A 464 16.145 -4.663 -9.612 1.00 24.40 N ATOM 1075 CA GLN A 464 16.985 -3.747 -10.440 1.00 34.32 C ATOM 1076 C GLN A 464 16.304 -3.134 -11.755 1.00 73.44 C ATOM 1077 O GLN A 464 16.604 -1.974 -12.038 1.00 21.43 O ATOM 1078 CB GLN A 464 18.422 -4.343 -10.709 1.00 24.33 C ATOM 1079 CG GLN A 464 19.359 -4.380 -9.478 1.00 3.23 C ATOM 1080 CD GLN A 464 20.714 -4.986 -9.788 1.00 1.51 C ATOM 1081 OE1 GLN A 464 21.250 -4.854 -10.888 1.00 13.32 O ATOM 1082 NE2 GLN A 464 21.266 -5.683 -8.811 1.00 52.22 N ATOM 0 H GLN A 464 16.189 -5.645 -9.886 1.00 24.40 H new ATOM 0 HA GLN A 464 17.097 -2.866 -9.808 1.00 34.32 H new ATOM 0 HB2 GLN A 464 18.312 -5.357 -11.093 1.00 24.33 H new ATOM 0 HB3 GLN A 464 18.901 -3.756 -11.493 1.00 24.33 H new ATOM 0 HG2 GLN A 464 19.497 -3.366 -9.102 1.00 3.23 H new ATOM 0 HG3 GLN A 464 18.883 -4.953 -8.682 1.00 3.23 H new ATOM 0 HE21 GLN A 464 20.789 -5.769 -7.913 1.00 52.22 H new ATOM 0 HE22 GLN A 464 22.169 -6.136 -8.954 1.00 52.22 H new ATOM 1091 N ALA A 465 15.438 -3.869 -12.582 1.00 32.01 N ATOM 1092 CA ALA A 465 14.645 -3.226 -13.727 1.00 2.11 C ATOM 1093 C ALA A 465 13.832 -1.937 -13.358 1.00 12.35 C ATOM 1094 O ALA A 465 13.623 -1.093 -14.229 1.00 10.31 O ATOM 1095 CB ALA A 465 13.712 -4.230 -14.488 1.00 53.14 C ATOM 0 H ALA A 465 15.278 -4.871 -12.479 1.00 32.01 H new ATOM 0 HA ALA A 465 15.446 -2.907 -14.393 1.00 2.11 H new ATOM 0 HB1 ALA A 465 13.184 -3.704 -15.283 1.00 53.14 H new ATOM 0 HB2 ALA A 465 14.313 -5.030 -14.919 1.00 53.14 H new ATOM 0 HB3 ALA A 465 12.989 -4.655 -13.791 1.00 53.14 H new ATOM 1101 N MET A 466 13.444 -1.738 -12.083 1.00 20.04 N ATOM 1102 CA MET A 466 12.576 -0.595 -11.676 1.00 2.52 C ATOM 1103 C MET A 466 13.376 0.482 -10.850 1.00 60.55 C ATOM 1104 O MET A 466 12.805 1.516 -10.486 1.00 41.03 O ATOM 1105 CB MET A 466 11.344 -1.126 -10.858 1.00 62.42 C ATOM 1106 CG MET A 466 9.977 -0.430 -11.107 1.00 13.03 C ATOM 1107 SD MET A 466 8.935 -1.342 -12.275 1.00 73.54 S ATOM 1108 CE MET A 466 9.792 -1.094 -13.825 1.00 3.42 C ATOM 0 H MET A 466 13.713 -2.349 -11.312 1.00 20.04 H new ATOM 0 HA MET A 466 12.218 -0.103 -12.580 1.00 2.52 H new ATOM 0 HB2 MET A 466 11.227 -2.188 -11.073 1.00 62.42 H new ATOM 0 HB3 MET A 466 11.579 -1.040 -9.797 1.00 62.42 H new ATOM 0 HG2 MET A 466 9.449 -0.325 -10.159 1.00 13.03 H new ATOM 0 HG3 MET A 466 10.150 0.576 -11.489 1.00 13.03 H new ATOM 0 HE1 MET A 466 9.161 -1.432 -14.647 1.00 3.42 H new ATOM 0 HE2 MET A 466 10.017 -0.035 -13.951 1.00 3.42 H new ATOM 0 HE3 MET A 466 10.721 -1.664 -13.822 1.00 3.42 H new ATOM 1118 N ASN A 467 14.700 0.247 -10.595 1.00 42.32 N ATOM 1119 CA ASN A 467 15.575 1.151 -9.802 1.00 55.51 C ATOM 1120 C ASN A 467 15.886 2.471 -10.584 1.00 22.02 C ATOM 1121 O ASN A 467 16.586 2.378 -11.599 1.00 0.40 O ATOM 1122 CB ASN A 467 16.910 0.410 -9.521 1.00 64.24 C ATOM 1123 CG ASN A 467 17.690 1.020 -8.351 1.00 14.40 C ATOM 1124 OD1 ASN A 467 17.105 1.594 -7.422 1.00 61.05 O ATOM 1125 ND2 ASN A 467 19.017 0.915 -8.388 1.00 20.35 N ATOM 0 H ASN A 467 15.186 -0.581 -10.939 1.00 42.32 H new ATOM 0 HA ASN A 467 15.064 1.414 -8.876 1.00 55.51 H new ATOM 0 HB2 ASN A 467 16.701 -0.638 -9.306 1.00 64.24 H new ATOM 0 HB3 ASN A 467 17.530 0.434 -10.417 1.00 64.24 H new ATOM 0 HD21 ASN A 467 19.581 1.313 -7.637 1.00 20.35 H new ATOM 0 HD22 ASN A 467 19.469 0.436 -9.167 1.00 20.35 H new ATOM 1132 N GLY A 468 15.391 3.702 -10.193 1.00 24.12 N ATOM 1133 CA GLY A 468 15.873 4.897 -10.915 1.00 34.42 C ATOM 1134 C GLY A 468 15.147 5.219 -12.229 1.00 44.32 C ATOM 1135 O GLY A 468 15.703 5.918 -13.078 1.00 44.35 O ATOM 0 H GLY A 468 14.717 3.867 -9.445 1.00 24.12 H new ATOM 0 HA2 GLY A 468 15.786 5.758 -10.253 1.00 34.42 H new ATOM 0 HA3 GLY A 468 16.934 4.766 -11.130 1.00 34.42 H new ATOM 1139 N PHE A 469 13.932 4.705 -12.417 1.00 61.14 N ATOM 1140 CA PHE A 469 13.314 4.682 -13.743 1.00 65.51 C ATOM 1141 C PHE A 469 12.317 5.852 -13.781 1.00 71.00 C ATOM 1142 O PHE A 469 11.316 5.808 -13.057 1.00 1.50 O ATOM 1143 CB PHE A 469 12.662 3.262 -13.980 1.00 53.01 C ATOM 1144 CG PHE A 469 11.932 3.045 -15.299 1.00 35.24 C ATOM 1145 CD1 PHE A 469 12.502 3.363 -16.532 1.00 22.15 C ATOM 1146 CD2 PHE A 469 10.675 2.456 -15.300 1.00 34.14 C ATOM 1147 CE1 PHE A 469 11.825 3.106 -17.712 1.00 11.32 C ATOM 1148 CE2 PHE A 469 9.999 2.203 -16.471 1.00 62.34 C ATOM 1149 CZ PHE A 469 10.570 2.527 -17.685 1.00 5.41 C ATOM 0 H PHE A 469 13.360 4.302 -11.675 1.00 61.14 H new ATOM 0 HA PHE A 469 14.025 4.818 -14.558 1.00 65.51 H new ATOM 0 HB2 PHE A 469 13.448 2.511 -13.901 1.00 53.01 H new ATOM 0 HB3 PHE A 469 11.959 3.073 -13.169 1.00 53.01 H new ATOM 0 HD1 PHE A 469 13.482 3.815 -16.566 1.00 22.15 H new ATOM 0 HD2 PHE A 469 10.217 2.190 -14.359 1.00 34.14 H new ATOM 0 HE1 PHE A 469 12.280 3.359 -18.658 1.00 11.32 H new ATOM 0 HE2 PHE A 469 9.019 1.750 -16.440 1.00 62.34 H new ATOM 0 HZ PHE A 469 10.041 2.330 -18.606 1.00 5.41 H new ATOM 1159 N GLN A 470 12.601 6.931 -14.565 1.00 11.01 N ATOM 1160 CA GLN A 470 11.757 8.128 -14.506 1.00 31.34 C ATOM 1161 C GLN A 470 10.404 7.928 -15.218 1.00 52.35 C ATOM 1162 O GLN A 470 10.369 7.588 -16.400 1.00 74.15 O ATOM 1163 CB GLN A 470 12.519 9.323 -15.103 1.00 14.24 C ATOM 1164 CG GLN A 470 13.048 10.332 -14.065 1.00 55.24 C ATOM 1165 CD GLN A 470 12.027 11.386 -13.627 1.00 24.33 C ATOM 1166 OE1 GLN A 470 10.735 11.092 -13.729 1.00 54.23 O flip ATOM 1167 NE2 GLN A 470 12.403 12.484 -13.225 1.00 61.12 N flip ATOM 0 H GLN A 470 13.382 6.984 -15.219 1.00 11.01 H new ATOM 0 HA GLN A 470 11.529 8.327 -13.459 1.00 31.34 H new ATOM 0 HB2 GLN A 470 13.360 8.946 -15.685 1.00 14.24 H new ATOM 0 HB3 GLN A 470 11.861 9.847 -15.796 1.00 14.24 H new ATOM 0 HG2 GLN A 470 13.387 9.785 -13.185 1.00 55.24 H new ATOM 0 HG3 GLN A 470 13.919 10.839 -14.481 1.00 55.24 H new ATOM 0 HE21 GLN A 470 13.400 12.687 -13.155 1.00 61.12 H new ATOM 0 HE22 GLN A 470 11.718 13.192 -12.961 1.00 61.12 H new ATOM 1176 N ILE A 471 9.298 8.129 -14.475 1.00 0.25 N ATOM 1177 CA ILE A 471 7.946 8.005 -15.036 1.00 50.41 C ATOM 1178 C ILE A 471 7.141 9.304 -14.657 1.00 25.31 C ATOM 1179 O ILE A 471 6.612 9.381 -13.544 1.00 75.43 O ATOM 1180 CB ILE A 471 7.215 6.652 -14.526 1.00 31.54 C ATOM 1181 CG1 ILE A 471 7.950 5.376 -15.093 1.00 60.13 C ATOM 1182 CG2 ILE A 471 5.704 6.614 -14.860 1.00 11.43 C ATOM 1183 CD1 ILE A 471 7.206 4.039 -14.986 1.00 71.25 C ATOM 0 H ILE A 471 9.318 8.378 -13.486 1.00 0.25 H new ATOM 0 HA ILE A 471 7.995 7.919 -16.121 1.00 50.41 H new ATOM 0 HB ILE A 471 7.287 6.650 -13.438 1.00 31.54 H new ATOM 0 HG12 ILE A 471 8.176 5.555 -16.144 1.00 60.13 H new ATOM 0 HG13 ILE A 471 8.903 5.276 -14.574 1.00 60.13 H new ATOM 0 HG21 ILE A 471 5.273 5.683 -14.492 1.00 11.43 H new ATOM 0 HG22 ILE A 471 5.205 7.458 -14.384 1.00 11.43 H new ATOM 0 HG23 ILE A 471 5.568 6.675 -15.940 1.00 11.43 H new ATOM 0 HD11 ILE A 471 7.820 3.246 -15.411 1.00 71.25 H new ATOM 0 HD12 ILE A 471 7.003 3.818 -13.938 1.00 71.25 H new ATOM 0 HD13 ILE A 471 6.265 4.102 -15.532 1.00 71.25 H new ATOM 1195 N GLY A 472 7.119 10.382 -15.529 1.00 13.44 N ATOM 1196 CA GLY A 472 6.286 11.554 -15.227 1.00 65.21 C ATOM 1197 C GLY A 472 6.946 12.528 -14.271 1.00 5.12 C ATOM 1198 O GLY A 472 8.154 12.762 -14.333 1.00 34.24 O ATOM 0 H GLY A 472 7.650 10.439 -16.398 1.00 13.44 H new ATOM 0 HA2 GLY A 472 6.049 12.072 -16.156 1.00 65.21 H new ATOM 0 HA3 GLY A 472 5.341 11.219 -14.799 1.00 65.21 H new ATOM 1202 N MET A 473 6.125 13.079 -13.376 1.00 31.20 N ATOM 1203 CA MET A 473 6.582 14.059 -12.369 1.00 44.03 C ATOM 1204 C MET A 473 7.024 13.387 -11.035 1.00 1.35 C ATOM 1205 O MET A 473 7.195 14.069 -10.020 1.00 52.34 O ATOM 1206 CB MET A 473 5.493 15.156 -12.120 1.00 44.13 C ATOM 1207 CG MET A 473 4.079 14.616 -11.868 1.00 55.13 C ATOM 1208 SD MET A 473 3.401 15.096 -10.266 1.00 20.52 S ATOM 1209 CE MET A 473 2.859 16.774 -10.599 1.00 73.41 C ATOM 0 H MET A 473 5.129 12.865 -13.322 1.00 31.20 H new ATOM 0 HA MET A 473 7.468 14.543 -12.779 1.00 44.03 H new ATOM 0 HB2 MET A 473 5.794 15.759 -11.263 1.00 44.13 H new ATOM 0 HB3 MET A 473 5.464 15.821 -12.983 1.00 44.13 H new ATOM 0 HG2 MET A 473 3.416 14.973 -12.656 1.00 55.13 H new ATOM 0 HG3 MET A 473 4.097 13.528 -11.935 1.00 55.13 H new ATOM 0 HE1 MET A 473 2.418 17.199 -9.698 1.00 73.41 H new ATOM 0 HE2 MET A 473 3.713 17.378 -10.905 1.00 73.41 H new ATOM 0 HE3 MET A 473 2.116 16.765 -11.397 1.00 73.41 H new ATOM 1219 N LYS A 474 7.224 12.051 -11.050 1.00 52.32 N ATOM 1220 CA LYS A 474 7.709 11.300 -9.841 1.00 50.53 C ATOM 1221 C LYS A 474 8.761 10.226 -10.274 1.00 2.03 C ATOM 1222 O LYS A 474 8.889 9.939 -11.468 1.00 15.43 O ATOM 1223 CB LYS A 474 6.553 10.590 -9.039 1.00 11.21 C ATOM 1224 CG LYS A 474 5.303 11.415 -8.580 1.00 31.12 C ATOM 1225 CD LYS A 474 5.508 12.372 -7.376 1.00 62.41 C ATOM 1226 CE LYS A 474 4.361 12.235 -6.354 1.00 12.12 C ATOM 1227 NZ LYS A 474 4.384 13.330 -5.343 1.00 72.52 N ATOM 0 H LYS A 474 7.063 11.464 -11.869 1.00 52.32 H new ATOM 0 HA LYS A 474 8.155 12.040 -9.177 1.00 50.53 H new ATOM 0 HB2 LYS A 474 6.191 9.765 -9.653 1.00 11.21 H new ATOM 0 HB3 LYS A 474 6.999 10.151 -8.146 1.00 11.21 H new ATOM 0 HG2 LYS A 474 4.953 12.004 -9.428 1.00 31.12 H new ATOM 0 HG3 LYS A 474 4.506 10.715 -8.327 1.00 31.12 H new ATOM 0 HD2 LYS A 474 6.459 12.152 -6.891 1.00 62.41 H new ATOM 0 HD3 LYS A 474 5.562 13.401 -7.731 1.00 62.41 H new ATOM 0 HE2 LYS A 474 3.405 12.244 -6.878 1.00 12.12 H new ATOM 0 HE3 LYS A 474 4.438 11.272 -5.848 1.00 12.12 H new ATOM 0 HZ1 LYS A 474 3.598 13.202 -4.675 1.00 72.52 H new ATOM 0 HZ2 LYS A 474 5.286 13.306 -4.825 1.00 72.52 H new ATOM 0 HZ3 LYS A 474 4.285 14.247 -5.823 1.00 72.52 H new ATOM 1241 N ARG A 475 9.509 9.623 -9.304 1.00 52.43 N ATOM 1242 CA ARG A 475 10.564 8.609 -9.623 1.00 0.40 C ATOM 1243 C ARG A 475 10.453 7.371 -8.704 1.00 41.52 C ATOM 1244 O ARG A 475 10.083 7.511 -7.533 1.00 62.04 O ATOM 1245 CB ARG A 475 12.006 9.244 -9.507 1.00 63.01 C ATOM 1246 CG ARG A 475 12.651 9.470 -8.071 1.00 31.41 C ATOM 1247 CD ARG A 475 12.005 10.569 -7.164 1.00 70.42 C ATOM 1248 NE ARG A 475 12.885 11.017 -6.093 1.00 61.02 N ATOM 1249 CZ ARG A 475 12.568 12.016 -5.269 1.00 63.42 C ATOM 1250 NH1 ARG A 475 11.398 12.640 -5.402 1.00 5.13 N ATOM 1251 NH2 ARG A 475 13.442 12.446 -4.369 1.00 1.23 N ATOM 0 H ARG A 475 9.405 9.817 -8.308 1.00 52.43 H new ATOM 0 HA ARG A 475 10.405 8.284 -10.651 1.00 0.40 H new ATOM 0 HB2 ARG A 475 12.688 8.611 -10.075 1.00 63.01 H new ATOM 0 HB3 ARG A 475 11.978 10.212 -10.008 1.00 63.01 H new ATOM 0 HG2 ARG A 475 12.616 8.523 -7.532 1.00 31.41 H new ATOM 0 HG3 ARG A 475 13.703 9.720 -8.208 1.00 31.41 H new ATOM 0 HD2 ARG A 475 11.729 11.424 -7.781 1.00 70.42 H new ATOM 0 HD3 ARG A 475 11.084 10.178 -6.730 1.00 70.42 H new ATOM 0 HE ARG A 475 13.781 10.547 -5.968 1.00 61.02 H new ATOM 0 HH11 ARG A 475 10.747 12.353 -6.133 1.00 5.13 H new ATOM 0 HH12 ARG A 475 11.153 13.405 -4.773 1.00 5.13 H new ATOM 0 HH21 ARG A 475 14.363 12.012 -4.304 1.00 1.23 H new ATOM 0 HH22 ARG A 475 13.193 13.211 -3.741 1.00 1.23 H new ATOM 1265 N LEU A 476 10.798 6.168 -9.228 1.00 61.32 N ATOM 1266 CA LEU A 476 10.707 4.904 -8.404 1.00 52.34 C ATOM 1267 C LEU A 476 12.162 4.451 -7.948 1.00 0.20 C ATOM 1268 O LEU A 476 12.964 4.149 -8.825 1.00 2.23 O ATOM 1269 CB LEU A 476 10.022 3.699 -9.219 1.00 31.21 C ATOM 1270 CG LEU A 476 8.515 3.759 -9.758 1.00 71.43 C ATOM 1271 CD1 LEU A 476 7.483 4.126 -8.703 1.00 62.20 C ATOM 1272 CD2 LEU A 476 8.364 4.666 -10.980 1.00 43.42 C ATOM 0 H LEU A 476 11.132 6.032 -10.182 1.00 61.32 H new ATOM 0 HA LEU A 476 10.085 5.128 -7.537 1.00 52.34 H new ATOM 0 HB2 LEU A 476 10.654 3.513 -10.087 1.00 31.21 H new ATOM 0 HB3 LEU A 476 10.088 2.817 -8.582 1.00 31.21 H new ATOM 0 HG LEU A 476 8.304 2.732 -10.056 1.00 71.43 H new ATOM 0 HD11 LEU A 476 6.491 4.143 -9.155 1.00 62.20 H new ATOM 0 HD12 LEU A 476 7.504 3.388 -7.901 1.00 62.20 H new ATOM 0 HD13 LEU A 476 7.713 5.110 -8.296 1.00 62.20 H new ATOM 0 HD21 LEU A 476 7.323 4.670 -11.304 1.00 43.42 H new ATOM 0 HD22 LEU A 476 8.667 5.680 -10.720 1.00 43.42 H new ATOM 0 HD23 LEU A 476 8.994 4.295 -11.788 1.00 43.42 H new ATOM 1284 N LYS A 477 12.547 4.455 -6.601 1.00 23.35 N ATOM 1285 CA LYS A 477 13.824 3.751 -6.141 1.00 61.32 C ATOM 1286 C LYS A 477 13.530 2.547 -5.196 1.00 45.22 C ATOM 1287 O LYS A 477 12.866 2.751 -4.182 1.00 44.11 O ATOM 1288 CB LYS A 477 14.766 4.716 -5.370 1.00 54.24 C ATOM 1289 CG LYS A 477 15.809 5.484 -6.207 1.00 42.24 C ATOM 1290 CD LYS A 477 15.217 6.675 -6.952 1.00 62.31 C ATOM 1291 CE LYS A 477 16.246 7.336 -7.874 1.00 42.34 C ATOM 1292 NZ LYS A 477 17.490 7.758 -7.160 1.00 43.30 N ATOM 0 H LYS A 477 12.021 4.912 -5.856 1.00 23.35 H new ATOM 0 HA LYS A 477 14.300 3.398 -7.056 1.00 61.32 H new ATOM 0 HB2 LYS A 477 14.149 5.445 -4.844 1.00 54.24 H new ATOM 0 HB3 LYS A 477 15.296 4.140 -4.612 1.00 54.24 H new ATOM 0 HG2 LYS A 477 16.607 5.833 -5.551 1.00 42.24 H new ATOM 0 HG3 LYS A 477 16.263 4.802 -6.926 1.00 42.24 H new ATOM 0 HD2 LYS A 477 14.360 6.347 -7.540 1.00 62.31 H new ATOM 0 HD3 LYS A 477 14.849 7.407 -6.233 1.00 62.31 H new ATOM 0 HE2 LYS A 477 16.510 6.641 -8.671 1.00 42.34 H new ATOM 0 HE3 LYS A 477 15.793 8.207 -8.348 1.00 42.34 H new ATOM 0 HZ1 LYS A 477 18.110 8.273 -7.817 1.00 43.30 H new ATOM 0 HZ2 LYS A 477 17.240 8.378 -6.363 1.00 43.30 H new ATOM 0 HZ3 LYS A 477 17.987 6.917 -6.802 1.00 43.30 H new ATOM 1306 N VAL A 478 14.033 1.300 -5.489 1.00 71.45 N ATOM 1307 CA VAL A 478 13.514 0.085 -4.812 1.00 5.24 C ATOM 1308 C VAL A 478 14.632 -0.989 -4.513 1.00 62.22 C ATOM 1309 O VAL A 478 15.589 -1.117 -5.280 1.00 43.43 O ATOM 1310 CB VAL A 478 12.295 -0.440 -5.640 1.00 63.34 C ATOM 1311 CG1 VAL A 478 12.124 -1.954 -5.636 1.00 65.23 C ATOM 1312 CG2 VAL A 478 11.002 0.199 -5.153 1.00 72.50 C ATOM 0 H VAL A 478 14.773 1.125 -6.169 1.00 71.45 H new ATOM 0 HA VAL A 478 13.164 0.333 -3.810 1.00 5.24 H new ATOM 0 HB VAL A 478 12.515 -0.152 -6.668 1.00 63.34 H new ATOM 0 HG11 VAL A 478 11.254 -2.224 -6.235 1.00 65.23 H new ATOM 0 HG12 VAL A 478 13.014 -2.422 -6.057 1.00 65.23 H new ATOM 0 HG13 VAL A 478 11.981 -2.301 -4.613 1.00 65.23 H new ATOM 0 HG21 VAL A 478 10.166 -0.179 -5.741 1.00 72.50 H new ATOM 0 HG22 VAL A 478 10.848 -0.047 -4.102 1.00 72.50 H new ATOM 0 HG23 VAL A 478 11.066 1.281 -5.266 1.00 72.50 H new ATOM 1322 N GLN A 479 14.465 -1.768 -3.401 1.00 55.24 N ATOM 1323 CA GLN A 479 15.549 -2.592 -2.807 1.00 3.32 C ATOM 1324 C GLN A 479 15.054 -3.793 -1.946 1.00 35.12 C ATOM 1325 O GLN A 479 13.846 -3.935 -1.736 1.00 31.02 O ATOM 1326 CB GLN A 479 16.474 -1.699 -2.000 1.00 32.41 C ATOM 1327 CG GLN A 479 17.904 -1.830 -2.449 1.00 22.00 C ATOM 1328 CD GLN A 479 18.844 -0.958 -1.664 1.00 42.00 C ATOM 1329 OE1 GLN A 479 18.617 -0.642 -0.497 1.00 34.15 O ATOM 1330 NE2 GLN A 479 19.913 -0.569 -2.309 1.00 23.14 N ATOM 0 H GLN A 479 13.579 -1.838 -2.900 1.00 55.24 H new ATOM 0 HA GLN A 479 16.083 -3.046 -3.642 1.00 3.32 H new ATOM 0 HB2 GLN A 479 16.155 -0.661 -2.098 1.00 32.41 H new ATOM 0 HB3 GLN A 479 16.399 -1.957 -0.944 1.00 32.41 H new ATOM 0 HG2 GLN A 479 18.216 -2.870 -2.354 1.00 22.00 H new ATOM 0 HG3 GLN A 479 17.973 -1.572 -3.506 1.00 22.00 H new ATOM 0 HE21 GLN A 479 20.058 -0.857 -3.277 1.00 23.14 H new ATOM 0 HE22 GLN A 479 20.602 0.022 -1.844 1.00 23.14 H new ATOM 1339 N LEU A 480 16.011 -4.674 -1.469 1.00 41.03 N ATOM 1340 CA LEU A 480 15.639 -5.850 -0.559 1.00 52.21 C ATOM 1341 C LEU A 480 15.472 -5.195 0.859 1.00 22.02 C ATOM 1342 O LEU A 480 16.095 -4.145 1.061 1.00 42.42 O ATOM 1343 CB LEU A 480 16.718 -7.064 -0.480 1.00 24.42 C ATOM 1344 CG LEU A 480 16.976 -8.131 -1.666 1.00 34.42 C ATOM 1345 CD1 LEU A 480 17.138 -7.447 -3.012 1.00 2.41 C ATOM 1346 CD2 LEU A 480 18.283 -8.858 -1.348 1.00 23.31 C ATOM 0 H LEU A 480 17.006 -4.605 -1.683 1.00 41.03 H new ATOM 0 HA LEU A 480 14.749 -6.337 -0.957 1.00 52.21 H new ATOM 0 HB2 LEU A 480 17.683 -6.599 -0.275 1.00 24.42 H new ATOM 0 HB3 LEU A 480 16.453 -7.648 0.401 1.00 24.42 H new ATOM 0 HG LEU A 480 16.123 -8.807 -1.725 1.00 34.42 H new ATOM 0 HD11 LEU A 480 17.310 -8.198 -3.783 1.00 2.41 H new ATOM 0 HD12 LEU A 480 16.233 -6.886 -3.246 1.00 2.41 H new ATOM 0 HD13 LEU A 480 17.988 -6.765 -2.974 1.00 2.41 H new ATOM 0 HD21 LEU A 480 18.492 -9.589 -2.129 1.00 23.31 H new ATOM 0 HD22 LEU A 480 19.098 -8.136 -1.299 1.00 23.31 H new ATOM 0 HD23 LEU A 480 18.192 -9.368 -0.389 1.00 23.31 H new ATOM 1358 N LYS A 481 14.681 -5.784 1.828 1.00 20.44 N ATOM 1359 CA LYS A 481 14.174 -5.079 3.028 1.00 40.24 C ATOM 1360 C LYS A 481 15.271 -4.411 3.846 1.00 45.54 C ATOM 1361 O LYS A 481 16.086 -5.045 4.527 1.00 4.40 O ATOM 1362 CB LYS A 481 13.363 -6.138 3.849 1.00 74.12 C ATOM 1363 CG LYS A 481 13.163 -6.061 5.423 1.00 43.34 C ATOM 1364 CD LYS A 481 12.762 -4.675 5.998 1.00 62.43 C ATOM 1365 CE LYS A 481 12.183 -4.776 7.430 1.00 64.52 C ATOM 1366 NZ LYS A 481 13.156 -5.391 8.374 1.00 2.32 N ATOM 0 H LYS A 481 14.388 -6.760 1.781 1.00 20.44 H new ATOM 0 HA LYS A 481 13.537 -4.245 2.734 1.00 40.24 H new ATOM 0 HB2 LYS A 481 12.364 -6.164 3.414 1.00 74.12 H new ATOM 0 HB3 LYS A 481 13.825 -7.104 3.645 1.00 74.12 H new ATOM 0 HG2 LYS A 481 12.398 -6.784 5.707 1.00 43.34 H new ATOM 0 HG3 LYS A 481 14.091 -6.375 5.902 1.00 43.34 H new ATOM 0 HD2 LYS A 481 13.635 -4.022 6.007 1.00 62.43 H new ATOM 0 HD3 LYS A 481 12.024 -4.212 5.342 1.00 62.43 H new ATOM 0 HE2 LYS A 481 11.911 -3.782 7.784 1.00 64.52 H new ATOM 0 HE3 LYS A 481 11.269 -5.369 7.412 1.00 64.52 H new ATOM 0 HZ1 LYS A 481 12.768 -5.365 9.338 1.00 2.32 H new ATOM 0 HZ2 LYS A 481 13.331 -6.378 8.098 1.00 2.32 H new ATOM 0 HZ3 LYS A 481 14.050 -4.860 8.346 1.00 2.32 H new ATOM 1380 N ARG A 482 15.292 -3.099 3.676 1.00 3.34 N ATOM 1381 CA ARG A 482 16.092 -2.200 4.445 1.00 15.30 C ATOM 1382 C ARG A 482 15.160 -1.479 5.446 1.00 62.11 C ATOM 1383 O ARG A 482 13.964 -1.316 5.136 1.00 62.13 O ATOM 1384 CB ARG A 482 16.748 -1.240 3.386 1.00 11.35 C ATOM 1385 CG ARG A 482 15.711 -0.378 2.606 1.00 40.12 C ATOM 1386 CD ARG A 482 16.292 0.655 1.602 1.00 5.33 C ATOM 1387 NE ARG A 482 15.263 1.610 1.168 1.00 62.53 N ATOM 1388 CZ ARG A 482 15.534 2.798 0.608 1.00 20.33 C ATOM 1389 NH1 ARG A 482 16.785 3.168 0.381 1.00 62.14 N ATOM 1390 NH2 ARG A 482 14.547 3.612 0.261 1.00 24.40 N ATOM 0 H ARG A 482 14.727 -2.628 2.969 1.00 3.34 H new ATOM 0 HA ARG A 482 16.876 -2.670 5.038 1.00 15.30 H new ATOM 0 HB2 ARG A 482 17.451 -0.579 3.892 1.00 11.35 H new ATOM 0 HB3 ARG A 482 17.323 -1.834 2.676 1.00 11.35 H new ATOM 0 HG2 ARG A 482 15.048 -1.050 2.061 1.00 40.12 H new ATOM 0 HG3 ARG A 482 15.097 0.157 3.330 1.00 40.12 H new ATOM 0 HD2 ARG A 482 17.118 1.193 2.067 1.00 5.33 H new ATOM 0 HD3 ARG A 482 16.698 0.135 0.735 1.00 5.33 H new ATOM 0 HE ARG A 482 14.285 1.354 1.301 1.00 62.53 H new ATOM 0 HH11 ARG A 482 17.554 2.547 0.633 1.00 62.14 H new ATOM 0 HH12 ARG A 482 16.979 4.074 -0.046 1.00 62.14 H new ATOM 0 HH21 ARG A 482 13.578 3.335 0.420 1.00 24.40 H new ATOM 0 HH22 ARG A 482 14.756 4.515 -0.165 1.00 24.40 H new ATOM 1404 N SER A 483 15.663 -1.144 6.662 1.00 62.44 N ATOM 1405 CA SER A 483 14.964 -0.213 7.596 1.00 12.51 C ATOM 1406 C SER A 483 13.643 -0.818 8.177 1.00 71.50 C ATOM 1407 O SER A 483 13.380 -1.995 7.964 1.00 0.01 O ATOM 1408 CB SER A 483 14.699 1.151 6.891 1.00 10.52 C ATOM 1409 OG SER A 483 15.903 1.737 6.419 1.00 13.45 O ATOM 0 H SER A 483 16.548 -1.502 7.021 1.00 62.44 H new ATOM 0 HA SER A 483 15.623 -0.050 8.449 1.00 12.51 H new ATOM 0 HB2 SER A 483 14.014 1.003 6.056 1.00 10.52 H new ATOM 0 HB3 SER A 483 14.210 1.832 7.587 1.00 10.52 H new ATOM 0 HG SER A 483 15.702 2.590 5.981 1.00 13.45 H new ATOM 1415 N LYS A 484 12.850 -0.020 8.937 1.00 31.42 N ATOM 1416 CA LYS A 484 11.498 -0.440 9.429 1.00 71.24 C ATOM 1417 C LYS A 484 10.838 0.762 10.169 1.00 53.20 C ATOM 1418 O LYS A 484 10.741 0.774 11.402 1.00 73.51 O ATOM 1419 CB LYS A 484 11.547 -1.690 10.376 1.00 54.21 C ATOM 1420 CG LYS A 484 10.166 -2.344 10.708 1.00 55.31 C ATOM 1421 CD LYS A 484 9.421 -2.848 9.454 1.00 2.21 C ATOM 1422 CE LYS A 484 7.966 -3.261 9.744 1.00 2.43 C ATOM 1423 NZ LYS A 484 7.176 -2.142 10.312 1.00 32.22 N ATOM 0 H LYS A 484 13.118 0.921 9.227 1.00 31.42 H new ATOM 0 HA LYS A 484 10.908 -0.735 8.561 1.00 71.24 H new ATOM 0 HB2 LYS A 484 12.185 -2.445 9.917 1.00 54.21 H new ATOM 0 HB3 LYS A 484 12.023 -1.396 11.311 1.00 54.21 H new ATOM 0 HG2 LYS A 484 10.320 -3.178 11.392 1.00 55.31 H new ATOM 0 HG3 LYS A 484 9.541 -1.617 11.227 1.00 55.31 H new ATOM 0 HD2 LYS A 484 9.426 -2.065 8.696 1.00 2.21 H new ATOM 0 HD3 LYS A 484 9.958 -3.700 9.037 1.00 2.21 H new ATOM 0 HE2 LYS A 484 7.496 -3.606 8.823 1.00 2.43 H new ATOM 0 HE3 LYS A 484 7.959 -4.100 10.439 1.00 2.43 H new ATOM 0 HZ1 LYS A 484 6.161 -2.347 10.211 1.00 32.22 H new ATOM 0 HZ2 LYS A 484 7.408 -2.030 11.320 1.00 32.22 H new ATOM 0 HZ3 LYS A 484 7.404 -1.263 9.804 1.00 32.22 H new ATOM 1437 N ASN A 485 10.431 1.789 9.402 1.00 72.00 N ATOM 1438 CA ASN A 485 9.960 3.082 9.959 1.00 32.14 C ATOM 1439 C ASN A 485 9.224 3.897 8.862 1.00 54.44 C ATOM 1440 O ASN A 485 9.867 4.373 7.923 1.00 53.52 O ATOM 1441 CB ASN A 485 11.204 3.859 10.516 1.00 35.05 C ATOM 1442 CG ASN A 485 10.817 5.041 11.399 1.00 64.13 C ATOM 1443 OD1 ASN A 485 10.657 6.165 10.926 1.00 71.12 O ATOM 1444 ND2 ASN A 485 10.656 4.785 12.699 1.00 20.24 N ATOM 0 H ASN A 485 10.417 1.753 8.383 1.00 72.00 H new ATOM 0 HA ASN A 485 9.251 2.915 10.770 1.00 32.14 H new ATOM 0 HB2 ASN A 485 11.828 3.173 11.088 1.00 35.05 H new ATOM 0 HB3 ASN A 485 11.806 4.217 9.681 1.00 35.05 H new ATOM 0 HD21 ASN A 485 10.391 5.535 13.338 1.00 20.24 H new ATOM 0 HD22 ASN A 485 10.798 3.839 13.054 1.00 20.24 H new ATOM 1451 N ASP A 486 7.870 4.037 8.949 1.00 44.22 N ATOM 1452 CA ASP A 486 7.133 4.798 7.910 1.00 24.35 C ATOM 1453 C ASP A 486 6.210 5.837 8.554 1.00 22.31 C ATOM 1454 O ASP A 486 5.632 5.595 9.623 1.00 50.41 O ATOM 1455 CB ASP A 486 6.324 3.865 6.936 1.00 63.02 C ATOM 1456 CG ASP A 486 5.179 3.109 7.603 1.00 71.22 C ATOM 1457 OD1 ASP A 486 5.443 2.101 8.301 1.00 62.52 O ATOM 1458 OD2 ASP A 486 4.006 3.510 7.417 1.00 62.02 O ATOM 0 H ASP A 486 7.292 3.650 9.695 1.00 44.22 H new ATOM 0 HA ASP A 486 7.880 5.313 7.306 1.00 24.35 H new ATOM 0 HB2 ASP A 486 5.921 4.469 6.123 1.00 63.02 H new ATOM 0 HB3 ASP A 486 7.009 3.144 6.489 1.00 63.02 H new ATOM 1463 N SER A 487 6.110 7.011 7.909 1.00 63.21 N ATOM 1464 CA SER A 487 5.249 8.104 8.379 1.00 61.42 C ATOM 1465 C SER A 487 4.979 9.092 7.228 1.00 31.00 C ATOM 1466 O SER A 487 5.640 9.039 6.190 1.00 15.05 O ATOM 1467 CB SER A 487 5.899 8.834 9.579 1.00 61.13 C ATOM 1468 OG SER A 487 4.923 9.502 10.368 1.00 20.44 O ATOM 0 H SER A 487 6.621 7.226 7.053 1.00 63.21 H new ATOM 0 HA SER A 487 4.300 7.683 8.712 1.00 61.42 H new ATOM 0 HB2 SER A 487 6.438 8.115 10.196 1.00 61.13 H new ATOM 0 HB3 SER A 487 6.631 9.555 9.215 1.00 61.13 H new ATOM 0 HG SER A 487 5.362 9.953 11.119 1.00 20.44 H new ATOM 1474 N LYS A 488 4.002 9.991 7.434 1.00 71.44 N ATOM 1475 CA LYS A 488 3.566 10.971 6.418 1.00 71.01 C ATOM 1476 C LYS A 488 4.521 12.184 6.380 1.00 54.31 C ATOM 1477 O LYS A 488 5.251 12.408 7.351 1.00 1.45 O ATOM 1478 CB LYS A 488 2.122 11.438 6.717 1.00 64.22 C ATOM 1479 CG LYS A 488 1.896 11.885 8.151 1.00 51.20 C ATOM 1480 CD LYS A 488 0.588 12.645 8.291 1.00 12.25 C ATOM 1481 CE LYS A 488 0.264 12.925 9.748 1.00 54.43 C ATOM 1482 NZ LYS A 488 -0.747 14.003 9.893 1.00 74.00 N ATOM 0 H LYS A 488 3.489 10.061 8.313 1.00 71.44 H new ATOM 0 HA LYS A 488 3.589 10.487 5.441 1.00 71.01 H new ATOM 0 HB2 LYS A 488 1.873 12.262 6.048 1.00 64.22 H new ATOM 0 HB3 LYS A 488 1.434 10.623 6.490 1.00 64.22 H new ATOM 0 HG2 LYS A 488 1.886 11.016 8.808 1.00 51.20 H new ATOM 0 HG3 LYS A 488 2.723 12.518 8.472 1.00 51.20 H new ATOM 0 HD2 LYS A 488 0.651 13.585 7.743 1.00 12.25 H new ATOM 0 HD3 LYS A 488 -0.220 12.068 7.841 1.00 12.25 H new ATOM 0 HE2 LYS A 488 -0.106 12.014 10.219 1.00 54.43 H new ATOM 0 HE3 LYS A 488 1.175 13.209 10.275 1.00 54.43 H new ATOM 0 HZ1 LYS A 488 -1.091 14.027 10.874 1.00 74.00 H new ATOM 0 HZ2 LYS A 488 -0.315 14.919 9.655 1.00 74.00 H new ATOM 0 HZ3 LYS A 488 -1.545 13.819 9.251 1.00 74.00 H new ATOM 1496 N PRO A 489 4.549 12.991 5.271 1.00 74.14 N ATOM 1497 CA PRO A 489 5.406 14.192 5.195 1.00 33.24 C ATOM 1498 C PRO A 489 4.826 15.448 5.887 1.00 73.34 C ATOM 1499 O PRO A 489 5.325 16.552 5.647 1.00 52.13 O ATOM 1500 CB PRO A 489 5.536 14.450 3.676 1.00 44.41 C ATOM 1501 CG PRO A 489 4.821 13.331 2.980 1.00 50.31 C ATOM 1502 CD PRO A 489 3.841 12.784 3.986 1.00 44.53 C ATOM 0 HA PRO A 489 6.346 14.013 5.717 1.00 33.24 H new ATOM 0 HB2 PRO A 489 5.099 15.412 3.409 1.00 44.41 H new ATOM 0 HB3 PRO A 489 6.584 14.482 3.378 1.00 44.41 H new ATOM 0 HG2 PRO A 489 4.307 13.690 2.088 1.00 50.31 H new ATOM 0 HG3 PRO A 489 5.521 12.561 2.657 1.00 50.31 H new ATOM 0 HD2 PRO A 489 2.890 13.316 3.957 1.00 44.53 H new ATOM 0 HD3 PRO A 489 3.623 11.731 3.808 1.00 44.53 H new ATOM 1510 N TYR A 490 3.784 15.289 6.736 1.00 4.30 N ATOM 1511 CA TYR A 490 3.099 16.448 7.361 1.00 13.14 C ATOM 1512 C TYR A 490 2.651 16.133 8.809 1.00 50.04 C ATOM 1513 O TYR A 490 3.523 16.077 9.701 1.00 32.14 O ATOM 1514 CB TYR A 490 1.878 16.893 6.512 1.00 44.31 C ATOM 1515 CG TYR A 490 2.223 17.429 5.124 1.00 73.14 C ATOM 1516 CD1 TYR A 490 2.813 18.682 4.967 1.00 4.52 C ATOM 1517 CD2 TYR A 490 1.964 16.683 3.973 1.00 31.30 C ATOM 1518 CE1 TYR A 490 3.132 19.171 3.708 1.00 0.44 C ATOM 1519 CE2 TYR A 490 2.279 17.172 2.720 1.00 73.01 C ATOM 1520 CZ TYR A 490 2.861 18.414 2.594 1.00 42.44 C ATOM 1521 OH TYR A 490 3.173 18.901 1.344 1.00 31.53 O ATOM 1522 OXT TYR A 490 1.429 15.971 9.051 1.00 38.10 O ATOM 0 H TYR A 490 3.402 14.382 7.002 1.00 4.30 H new ATOM 0 HA TYR A 490 3.819 17.265 7.399 1.00 13.14 H new ATOM 0 HB2 TYR A 490 1.202 16.045 6.401 1.00 44.31 H new ATOM 0 HB3 TYR A 490 1.335 17.664 7.059 1.00 44.31 H new ATOM 0 HD1 TYR A 490 3.025 19.282 5.839 1.00 4.52 H new ATOM 0 HD2 TYR A 490 1.510 15.707 4.064 1.00 31.30 H new ATOM 0 HE1 TYR A 490 3.592 20.143 3.604 1.00 0.44 H new ATOM 0 HE2 TYR A 490 2.069 16.581 1.841 1.00 73.01 H new ATOM 0 HH TYR A 490 2.919 18.243 0.664 1.00 31.53 H new TER 1532 TYR A 490