USER MOD reduce.3.24.130724 H: found=0, std=0, add=764, rem=0, adj=18 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 Set 1.1: A 433 SER OG : rot -72:sc= 0.514 USER MOD Set 1.2: A 452 SER OG : rot -136:sc= 0.534 USER MOD Set 2.1: A 419 GLN : amide:sc= -0.856 K(o=-2.2,f=-0.28) USER MOD Set 2.2: A 423 GLN : amide:sc= -1.31 K(o=-2.2,f=-0.28) USER MOD Single : A 0 MET CE :methyl -122:sc= 0 (180deg=-0.00645) USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=-0.049) USER MOD Single : A -2 SER OG : rot -120:sc= -0.311 USER MOD Single : A -3 GLY N :NH3+ 149:sc= 0.00196 (180deg=0) USER MOD Single : A 398 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 399 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 406 ASN : amide:sc= 0 K(o=0,f=1.7) USER MOD Single : A 410 TYR OH : rot 180:sc= 0 USER MOD Single : A 411 HIS : no HD1:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 414 GLN : amide:sc= -2.21! C(o=-2.2!,f=-2.8!) USER MOD Single : A 424 MET CE :methyl -158:sc= 0 (180deg=-0.07) USER MOD Single : A 426 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 435 LYS NZ :NH3+ 175:sc= -0.0182 (180deg=-0.0705) USER MOD Single : A 440 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 442 THR OG1 : rot 180:sc= 0 USER MOD Single : A 443 ASN : amide:sc= -0.033 X(o=-0.033,f=0) USER MOD Single : A 445 SER OG : rot 180:sc= -0.0416 USER MOD Single : A 446 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 447 CYS SG : rot 180:sc= 0 USER MOD Single : A 453 TYR OH : rot 25:sc= 0.73 USER MOD Single : A 455 ASN : amide:sc= -1.03 K(o=-1,f=0) USER MOD Single : A 458 SER OG : rot 180:sc= 0.0159 USER MOD Single : A 460 GLN : amide:sc= -0.302 X(o=-0.3,f=-0.3) USER MOD Single : A 464 GLN : amide:sc= -0.904 K(o=-0.9,f=-0.23) USER MOD Single : A 466 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 467 ASN : amide:sc= 0.354 K(o=0.35,f=-0.19) USER MOD Single : A 470 GLN : amide:sc= -1.25 K(o=-1.2,f=0) USER MOD Single : A 473 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 474 LYS NZ :NH3+ 152:sc= 0.589 (180deg=0.221) USER MOD Single : A 477 LYS NZ :NH3+ -165:sc= 0.0831 (180deg=0.0454) USER MOD Single : A 479 GLN : amide:sc= -0.539 X(o=-0.54,f=-0.37) USER MOD Single : A 481 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 483 SER OG : rot -160:sc= -0.329 USER MOD Single : A 484 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 485 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 487 SER OG : rot 2:sc= 0.33 USER MOD Single : A 488 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 490 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 12.124 9.207 3.531 1.00 73.10 N ATOM 2 CA GLY A -3 11.847 8.634 4.882 1.00 20.03 C ATOM 3 C GLY A -3 10.364 8.549 5.184 1.00 31.33 C ATOM 4 O GLY A -3 9.617 9.466 4.843 1.00 24.23 O ATOM 0 H1 GLY A -3 13.028 9.721 3.551 1.00 73.10 H new ATOM 0 H2 GLY A -3 12.178 8.439 2.832 1.00 73.10 H new ATOM 0 H3 GLY A -3 11.359 9.861 3.268 1.00 73.10 H new ATOM 0 HA2 GLY A -3 12.285 7.638 4.948 1.00 20.03 H new ATOM 0 HA3 GLY A -3 12.334 9.247 5.640 1.00 20.03 H new ATOM 10 N SER A -2 9.932 7.459 5.820 1.00 0.20 N ATOM 11 CA SER A -2 8.522 7.279 6.158 1.00 44.11 C ATOM 12 C SER A -2 8.375 6.345 7.373 1.00 64.44 C ATOM 13 O SER A -2 9.239 5.485 7.577 1.00 42.35 O ATOM 14 CB SER A -2 7.756 6.696 4.949 1.00 4.11 C ATOM 15 OG SER A -2 6.397 6.482 5.267 1.00 52.22 O ATOM 0 H SER A -2 10.537 6.691 6.110 1.00 0.20 H new ATOM 0 HA SER A -2 8.100 8.251 6.412 1.00 44.11 H new ATOM 0 HB2 SER A -2 7.832 7.378 4.102 1.00 4.11 H new ATOM 0 HB3 SER A -2 8.214 5.756 4.643 1.00 4.11 H new ATOM 0 HG SER A -2 6.181 5.532 5.159 1.00 52.22 H new ATOM 21 N HIS A -1 7.313 6.514 8.202 1.00 70.43 N ATOM 22 CA HIS A -1 6.996 5.512 9.213 1.00 23.31 C ATOM 23 C HIS A -1 5.475 5.310 9.351 1.00 5.30 C ATOM 24 O HIS A -1 5.046 4.401 10.068 1.00 32.13 O ATOM 25 CB HIS A -1 7.626 5.868 10.598 1.00 62.30 C ATOM 26 CG HIS A -1 7.044 7.088 11.302 1.00 31.14 C ATOM 27 ND1 HIS A -1 6.082 7.001 12.296 1.00 23.42 N ATOM 28 CD2 HIS A -1 7.297 8.415 11.153 1.00 63.13 C ATOM 29 CE1 HIS A -1 5.774 8.215 12.719 1.00 41.31 C ATOM 30 NE2 HIS A -1 6.494 9.087 12.042 1.00 40.52 N ATOM 0 H HIS A -1 6.685 7.318 8.181 1.00 70.43 H new ATOM 0 HA HIS A -1 7.435 4.574 8.875 1.00 23.31 H new ATOM 0 HB2 HIS A -1 7.517 5.006 11.257 1.00 62.30 H new ATOM 0 HB3 HIS A -1 8.695 6.029 10.458 1.00 62.30 H new ATOM 0 HD2 HIS A -1 7.999 8.859 10.463 1.00 63.13 H new ATOM 0 HE1 HIS A -1 5.054 8.452 13.489 1.00 41.31 H new ATOM 0 HE2 HIS A -1 6.460 10.100 12.160 1.00 40.52 H new ATOM 39 N MET A 0 4.654 6.153 8.670 1.00 73.12 N ATOM 40 CA MET A 0 3.196 6.170 8.927 1.00 63.31 C ATOM 41 C MET A 0 2.402 6.881 7.788 1.00 74.43 C ATOM 42 O MET A 0 3.007 7.588 6.982 1.00 3.13 O ATOM 43 CB MET A 0 2.925 6.914 10.255 1.00 40.34 C ATOM 44 CG MET A 0 2.307 6.062 11.370 1.00 4.45 C ATOM 45 SD MET A 0 0.723 5.331 10.900 1.00 53.22 S ATOM 46 CE MET A 0 -0.368 6.740 11.086 1.00 12.51 C ATOM 0 H MET A 0 4.969 6.812 7.958 1.00 73.12 H new ATOM 0 HA MET A 0 2.860 5.134 8.977 1.00 63.31 H new ATOM 0 HB2 MET A 0 3.865 7.330 10.617 1.00 40.34 H new ATOM 0 HB3 MET A 0 2.261 7.754 10.052 1.00 40.34 H new ATOM 0 HG2 MET A 0 3.002 5.267 11.641 1.00 4.45 H new ATOM 0 HG3 MET A 0 2.167 6.679 12.257 1.00 4.45 H new ATOM 0 HE1 MET A 0 -1.156 6.498 11.799 1.00 12.51 H new ATOM 0 HE2 MET A 0 0.201 7.595 11.450 1.00 12.51 H new ATOM 0 HE3 MET A 0 -0.814 6.985 10.122 1.00 12.51 H new ATOM 56 N GLN A 398 1.045 6.718 7.748 1.00 24.34 N ATOM 57 CA GLN A 398 0.186 7.471 6.807 1.00 25.10 C ATOM 58 C GLN A 398 -0.195 8.852 7.414 1.00 33.52 C ATOM 59 O GLN A 398 -0.871 8.914 8.442 1.00 3.21 O ATOM 60 CB GLN A 398 -1.057 6.604 6.379 1.00 53.44 C ATOM 61 CG GLN A 398 -2.248 7.316 5.625 1.00 62.14 C ATOM 62 CD GLN A 398 -1.862 8.247 4.449 1.00 33.22 C ATOM 63 OE1 GLN A 398 -0.834 8.052 3.808 1.00 40.52 O ATOM 64 NE2 GLN A 398 -2.717 9.240 4.113 1.00 5.44 N ATOM 0 H GLN A 398 0.535 6.076 8.355 1.00 24.34 H new ATOM 0 HA GLN A 398 0.738 7.680 5.890 1.00 25.10 H new ATOM 0 HB2 GLN A 398 -0.695 5.798 5.741 1.00 53.44 H new ATOM 0 HB3 GLN A 398 -1.463 6.141 7.278 1.00 53.44 H new ATOM 0 HG2 GLN A 398 -2.920 6.547 5.245 1.00 62.14 H new ATOM 0 HG3 GLN A 398 -2.812 7.900 6.352 1.00 62.14 H new ATOM 0 HE21 GLN A 398 -3.567 9.387 4.657 1.00 5.44 H new ATOM 0 HE22 GLN A 398 -2.512 9.841 3.315 1.00 5.44 H new ATOM 73 N LYS A 399 0.253 9.955 6.751 1.00 65.33 N ATOM 74 CA LYS A 399 0.045 11.334 7.185 1.00 21.23 C ATOM 75 C LYS A 399 0.348 12.307 5.993 1.00 34.52 C ATOM 76 O LYS A 399 1.487 12.708 5.750 1.00 23.10 O ATOM 77 CB LYS A 399 0.741 11.750 8.547 1.00 10.01 C ATOM 78 CG LYS A 399 2.150 11.193 8.938 1.00 60.55 C ATOM 79 CD LYS A 399 3.225 11.550 7.948 1.00 2.41 C ATOM 80 CE LYS A 399 4.635 11.118 8.384 1.00 13.34 C ATOM 81 NZ LYS A 399 5.457 12.306 8.717 1.00 15.32 N ATOM 0 H LYS A 399 0.780 9.890 5.880 1.00 65.33 H new ATOM 0 HA LYS A 399 -1.008 11.417 7.454 1.00 21.23 H new ATOM 0 HB2 LYS A 399 0.817 12.837 8.547 1.00 10.01 H new ATOM 0 HB3 LYS A 399 0.057 11.478 9.351 1.00 10.01 H new ATOM 0 HG2 LYS A 399 2.426 11.579 9.919 1.00 60.55 H new ATOM 0 HG3 LYS A 399 2.093 10.108 9.027 1.00 60.55 H new ATOM 0 HD2 LYS A 399 2.993 11.086 6.990 1.00 2.41 H new ATOM 0 HD3 LYS A 399 3.218 12.628 7.790 1.00 2.41 H new ATOM 0 HE2 LYS A 399 4.569 10.459 9.249 1.00 13.34 H new ATOM 0 HE3 LYS A 399 5.112 10.550 7.585 1.00 13.34 H new ATOM 0 HZ1 LYS A 399 6.407 12.000 9.010 1.00 15.32 H new ATOM 0 HZ2 LYS A 399 5.534 12.920 7.881 1.00 15.32 H new ATOM 0 HZ3 LYS A 399 5.008 12.832 9.494 1.00 15.32 H new ATOM 95 N GLU A 400 -0.714 12.626 5.221 1.00 55.24 N ATOM 96 CA GLU A 400 -0.625 13.487 3.988 1.00 35.42 C ATOM 97 C GLU A 400 -0.391 14.993 4.320 1.00 10.45 C ATOM 98 O GLU A 400 -0.493 15.394 5.479 1.00 25.12 O ATOM 99 CB GLU A 400 -1.809 13.292 2.958 1.00 33.54 C ATOM 100 CG GLU A 400 -3.233 13.491 3.500 1.00 53.41 C ATOM 101 CD GLU A 400 -3.798 14.891 3.321 1.00 53.22 C ATOM 102 OE1 GLU A 400 -3.574 15.754 4.195 1.00 5.01 O ATOM 103 OE2 GLU A 400 -4.509 15.108 2.313 1.00 1.22 O ATOM 0 H GLU A 400 -1.660 12.303 5.421 1.00 55.24 H new ATOM 0 HA GLU A 400 0.264 13.121 3.474 1.00 35.42 H new ATOM 0 HB2 GLU A 400 -1.659 13.986 2.131 1.00 33.54 H new ATOM 0 HB3 GLU A 400 -1.739 12.286 2.545 1.00 33.54 H new ATOM 0 HG2 GLU A 400 -3.896 12.782 3.005 1.00 53.41 H new ATOM 0 HG3 GLU A 400 -3.239 13.246 4.562 1.00 53.41 H new ATOM 110 N GLY A 401 -0.044 15.812 3.300 1.00 34.12 N ATOM 111 CA GLY A 401 0.431 17.196 3.535 1.00 73.51 C ATOM 112 C GLY A 401 -0.582 18.228 3.046 1.00 72.00 C ATOM 113 O GLY A 401 -1.486 18.551 3.817 1.00 73.11 O ATOM 0 H GLY A 401 -0.083 15.543 2.317 1.00 34.12 H new ATOM 0 HA2 GLY A 401 0.615 17.342 4.599 1.00 73.51 H new ATOM 0 HA3 GLY A 401 1.381 17.347 3.023 1.00 73.51 H new ATOM 117 N PRO A 402 -0.502 18.812 1.799 1.00 20.22 N ATOM 118 CA PRO A 402 -1.526 19.753 1.386 1.00 72.14 C ATOM 119 C PRO A 402 -2.687 19.095 0.630 1.00 62.42 C ATOM 120 O PRO A 402 -2.515 18.053 -0.031 1.00 25.41 O ATOM 121 CB PRO A 402 -0.728 20.699 0.482 1.00 14.14 C ATOM 122 CG PRO A 402 0.139 19.793 -0.273 1.00 42.22 C ATOM 123 CD PRO A 402 0.565 18.715 0.728 1.00 51.33 C ATOM 0 HA PRO A 402 -2.021 20.238 2.227 1.00 72.14 H new ATOM 0 HB2 PRO A 402 -1.381 21.272 -0.176 1.00 14.14 H new ATOM 0 HB3 PRO A 402 -0.150 21.418 1.063 1.00 14.14 H new ATOM 0 HG2 PRO A 402 -0.390 19.356 -1.120 1.00 42.22 H new ATOM 0 HG3 PRO A 402 1.004 20.320 -0.675 1.00 42.22 H new ATOM 0 HD2 PRO A 402 0.591 17.726 0.271 1.00 51.33 H new ATOM 0 HD3 PRO A 402 1.560 18.906 1.130 1.00 51.33 H new ATOM 131 N GLU A 403 -3.891 19.641 0.853 1.00 70.25 N ATOM 132 CA GLU A 403 -4.961 19.599 -0.129 1.00 51.44 C ATOM 133 C GLU A 403 -4.321 19.884 -1.542 1.00 64.23 C ATOM 134 O GLU A 403 -3.783 20.968 -1.809 1.00 72.23 O ATOM 135 CB GLU A 403 -6.069 20.616 0.330 1.00 70.31 C ATOM 136 CG GLU A 403 -5.925 22.089 -0.068 1.00 11.31 C ATOM 137 CD GLU A 403 -7.216 22.620 -0.651 1.00 45.32 C ATOM 138 OE1 GLU A 403 -7.598 22.191 -1.753 1.00 75.01 O ATOM 139 OE2 GLU A 403 -7.876 23.435 0.023 1.00 64.22 O ATOM 0 H GLU A 403 -4.141 20.120 1.718 1.00 70.25 H new ATOM 0 HA GLU A 403 -5.456 18.631 -0.210 1.00 51.44 H new ATOM 0 HB2 GLU A 403 -7.024 20.261 -0.056 1.00 70.31 H new ATOM 0 HB3 GLU A 403 -6.129 20.572 1.417 1.00 70.31 H new ATOM 0 HG2 GLU A 403 -5.645 22.680 0.804 1.00 11.31 H new ATOM 0 HG3 GLU A 403 -5.121 22.196 -0.797 1.00 11.31 H new ATOM 146 N GLY A 404 -4.276 18.866 -2.405 1.00 4.54 N ATOM 147 CA GLY A 404 -3.408 18.938 -3.536 1.00 62.30 C ATOM 148 C GLY A 404 -2.917 17.568 -4.047 1.00 33.14 C ATOM 149 O GLY A 404 -3.291 17.154 -5.150 1.00 11.20 O ATOM 0 H GLY A 404 -4.825 18.009 -2.329 1.00 4.54 H new ATOM 0 HA2 GLY A 404 -3.927 19.450 -4.346 1.00 62.30 H new ATOM 0 HA3 GLY A 404 -2.542 19.548 -3.277 1.00 62.30 H new ATOM 153 N ALA A 405 -2.078 16.864 -3.249 1.00 55.21 N ATOM 154 CA ALA A 405 -1.517 15.557 -3.628 1.00 21.43 C ATOM 155 C ALA A 405 -2.051 14.442 -2.702 1.00 50.51 C ATOM 156 O ALA A 405 -1.822 14.504 -1.487 1.00 73.10 O ATOM 157 CB ALA A 405 -0.025 15.613 -3.380 1.00 71.15 C ATOM 0 H ALA A 405 -1.776 17.189 -2.331 1.00 55.21 H new ATOM 0 HA ALA A 405 -1.780 15.351 -4.665 1.00 21.43 H new ATOM 0 HB1 ALA A 405 0.425 14.658 -3.651 1.00 71.15 H new ATOM 0 HB2 ALA A 405 0.415 16.406 -3.985 1.00 71.15 H new ATOM 0 HB3 ALA A 405 0.161 15.816 -2.325 1.00 71.15 H new ATOM 163 N ASN A 406 -2.795 13.462 -3.254 1.00 21.20 N ATOM 164 CA ASN A 406 -2.942 12.060 -2.664 1.00 23.23 C ATOM 165 C ASN A 406 -3.321 10.967 -3.761 1.00 32.33 C ATOM 166 O ASN A 406 -4.343 11.109 -4.433 1.00 72.32 O ATOM 167 CB ASN A 406 -3.928 12.161 -1.427 1.00 2.21 C ATOM 168 CG ASN A 406 -5.155 13.015 -1.663 1.00 11.12 C ATOM 169 OD1 ASN A 406 -5.777 12.942 -2.716 1.00 4.40 O ATOM 170 ND2 ASN A 406 -5.479 13.889 -0.703 1.00 3.32 N ATOM 0 H ASN A 406 -3.320 13.591 -4.119 1.00 21.20 H new ATOM 0 HA ASN A 406 -1.985 11.690 -2.296 1.00 23.23 H new ATOM 0 HB2 ASN A 406 -4.249 11.156 -1.153 1.00 2.21 H new ATOM 0 HB3 ASN A 406 -3.380 12.564 -0.575 1.00 2.21 H new ATOM 0 HD21 ASN A 406 -6.267 14.523 -0.835 1.00 3.32 H new ATOM 0 HD22 ASN A 406 -4.938 13.921 0.161 1.00 3.32 H new ATOM 177 N LEU A 407 -2.460 9.893 -3.996 1.00 12.40 N ATOM 178 CA LEU A 407 -2.720 8.836 -5.017 1.00 63.34 C ATOM 179 C LEU A 407 -3.045 7.426 -4.349 1.00 65.42 C ATOM 180 O LEU A 407 -2.191 6.950 -3.589 1.00 1.23 O ATOM 181 CB LEU A 407 -1.387 8.692 -5.809 1.00 63.32 C ATOM 182 CG LEU A 407 -0.982 9.796 -6.797 1.00 3.22 C ATOM 183 CD1 LEU A 407 -2.180 10.391 -7.510 1.00 71.30 C ATOM 184 CD2 LEU A 407 -0.160 10.860 -6.113 1.00 2.22 C ATOM 0 H LEU A 407 -1.589 9.757 -3.482 1.00 12.40 H new ATOM 0 HA LEU A 407 -3.575 9.114 -5.633 1.00 63.34 H new ATOM 0 HB2 LEU A 407 -0.582 8.591 -5.081 1.00 63.32 H new ATOM 0 HB3 LEU A 407 -1.434 7.755 -6.364 1.00 63.32 H new ATOM 0 HG LEU A 407 -0.360 9.333 -7.563 1.00 3.22 H new ATOM 0 HD11 LEU A 407 -1.845 11.167 -8.198 1.00 71.30 H new ATOM 0 HD12 LEU A 407 -2.697 9.610 -8.068 1.00 71.30 H new ATOM 0 HD13 LEU A 407 -2.861 10.825 -6.778 1.00 71.30 H new ATOM 0 HD21 LEU A 407 0.113 11.629 -6.835 1.00 2.22 H new ATOM 0 HD22 LEU A 407 -0.742 11.308 -5.308 1.00 2.22 H new ATOM 0 HD23 LEU A 407 0.744 10.412 -5.700 1.00 2.22 H new ATOM 196 N PHE A 408 -4.235 6.736 -4.585 1.00 24.34 N ATOM 197 CA PHE A 408 -4.389 5.302 -4.086 1.00 72.45 C ATOM 198 C PHE A 408 -4.511 4.259 -5.253 1.00 4.14 C ATOM 199 O PHE A 408 -4.865 4.620 -6.377 1.00 2.13 O ATOM 200 CB PHE A 408 -5.517 5.085 -3.006 1.00 74.34 C ATOM 201 CG PHE A 408 -5.519 6.070 -1.843 1.00 54.23 C ATOM 202 CD1 PHE A 408 -4.354 6.350 -1.121 1.00 42.23 C ATOM 203 CD2 PHE A 408 -6.694 6.702 -1.462 1.00 62.54 C ATOM 204 CE1 PHE A 408 -4.358 7.241 -0.065 1.00 63.04 C ATOM 205 CE2 PHE A 408 -6.712 7.590 -0.404 1.00 64.45 C ATOM 206 CZ PHE A 408 -5.545 7.861 0.298 1.00 24.52 C ATOM 0 H PHE A 408 -5.043 7.116 -5.079 1.00 24.34 H new ATOM 0 HA PHE A 408 -3.451 5.115 -3.564 1.00 72.45 H new ATOM 0 HB2 PHE A 408 -6.485 5.137 -3.504 1.00 74.34 H new ATOM 0 HB3 PHE A 408 -5.420 4.077 -2.604 1.00 74.34 H new ATOM 0 HD1 PHE A 408 -3.432 5.859 -1.395 1.00 42.23 H new ATOM 0 HD2 PHE A 408 -7.608 6.497 -2.000 1.00 62.54 H new ATOM 0 HE1 PHE A 408 -3.446 7.453 0.473 1.00 63.04 H new ATOM 0 HE2 PHE A 408 -7.635 8.074 -0.122 1.00 64.45 H new ATOM 0 HZ PHE A 408 -5.561 8.554 1.126 1.00 24.52 H new ATOM 216 N ILE A 409 -4.192 2.949 -4.972 1.00 3.12 N ATOM 217 CA ILE A 409 -3.940 1.897 -6.068 1.00 73.33 C ATOM 218 C ILE A 409 -5.063 0.771 -5.994 1.00 63.34 C ATOM 219 O ILE A 409 -5.112 0.071 -4.978 1.00 44.24 O ATOM 220 CB ILE A 409 -2.454 1.202 -6.013 1.00 53.05 C ATOM 221 CG1 ILE A 409 -1.216 2.153 -6.363 1.00 53.22 C ATOM 222 CG2 ILE A 409 -2.306 -0.026 -6.981 1.00 34.12 C ATOM 223 CD1 ILE A 409 -1.066 3.587 -5.815 1.00 51.11 C ATOM 0 H ILE A 409 -4.101 2.586 -4.023 1.00 3.12 H new ATOM 0 HA ILE A 409 -3.983 2.433 -7.016 1.00 73.33 H new ATOM 0 HB ILE A 409 -2.409 0.916 -4.962 1.00 53.05 H new ATOM 0 HG12 ILE A 409 -0.319 1.613 -6.061 1.00 53.22 H new ATOM 0 HG13 ILE A 409 -1.189 2.235 -7.450 1.00 53.22 H new ATOM 0 HG21 ILE A 409 -1.301 -0.438 -6.895 1.00 34.12 H new ATOM 0 HG22 ILE A 409 -3.036 -0.790 -6.713 1.00 34.12 H new ATOM 0 HG23 ILE A 409 -2.479 0.297 -8.008 1.00 34.12 H new ATOM 0 HD11 ILE A 409 -0.144 4.027 -6.195 1.00 51.11 H new ATOM 0 HD12 ILE A 409 -1.916 4.190 -6.136 1.00 51.11 H new ATOM 0 HD13 ILE A 409 -1.032 3.559 -4.726 1.00 51.11 H new ATOM 235 N TYR A 410 -5.981 0.589 -7.025 1.00 42.01 N ATOM 236 CA TYR A 410 -6.868 -0.622 -7.079 1.00 62.44 C ATOM 237 C TYR A 410 -6.210 -1.654 -8.009 1.00 32.13 C ATOM 238 O TYR A 410 -5.564 -1.251 -8.985 1.00 42.01 O ATOM 239 CB TYR A 410 -8.299 -0.297 -7.637 1.00 23.21 C ATOM 240 CG TYR A 410 -9.362 0.428 -6.801 1.00 10.22 C ATOM 241 CD1 TYR A 410 -9.140 1.193 -5.642 1.00 22.24 C ATOM 242 CD2 TYR A 410 -10.676 0.322 -7.251 1.00 60.51 C ATOM 243 CE1 TYR A 410 -10.199 1.808 -4.995 1.00 31.14 C ATOM 244 CE2 TYR A 410 -11.719 0.935 -6.608 1.00 3.53 C ATOM 245 CZ TYR A 410 -11.483 1.674 -5.477 1.00 31.31 C ATOM 246 OH TYR A 410 -12.525 2.294 -4.820 1.00 25.42 O ATOM 0 H TYR A 410 -6.113 1.245 -7.795 1.00 42.01 H new ATOM 0 HA TYR A 410 -6.986 -0.998 -6.063 1.00 62.44 H new ATOM 0 HB2 TYR A 410 -8.155 0.295 -8.541 1.00 23.21 H new ATOM 0 HB3 TYR A 410 -8.737 -1.246 -7.945 1.00 23.21 H new ATOM 0 HD1 TYR A 410 -8.138 1.302 -5.254 1.00 22.24 H new ATOM 0 HD2 TYR A 410 -10.879 -0.263 -8.136 1.00 60.51 H new ATOM 0 HE1 TYR A 410 -10.017 2.396 -4.108 1.00 31.14 H new ATOM 0 HE2 TYR A 410 -12.724 0.837 -6.991 1.00 3.53 H new ATOM 0 HH TYR A 410 -13.366 2.103 -5.286 1.00 25.42 H new ATOM 256 N HIS A 411 -6.366 -2.986 -7.685 1.00 32.30 N ATOM 257 CA HIS A 411 -5.710 -4.101 -8.448 1.00 2.43 C ATOM 258 C HIS A 411 -4.180 -4.117 -8.309 1.00 22.52 C ATOM 259 O HIS A 411 -3.463 -3.825 -9.273 1.00 11.12 O ATOM 260 CB HIS A 411 -6.057 -4.104 -9.931 1.00 25.41 C ATOM 261 CG HIS A 411 -7.506 -4.292 -10.257 1.00 11.12 C ATOM 262 ND1 HIS A 411 -8.418 -4.934 -9.442 1.00 72.03 N ATOM 263 CD2 HIS A 411 -8.198 -3.874 -11.326 1.00 22.40 C ATOM 264 CE1 HIS A 411 -9.609 -4.900 -10.014 1.00 44.22 C ATOM 265 NE2 HIS A 411 -9.505 -4.261 -11.159 1.00 60.00 N ATOM 0 H HIS A 411 -6.938 -3.306 -6.904 1.00 32.30 H new ATOM 0 HA HIS A 411 -6.118 -5.000 -7.986 1.00 2.43 H new ATOM 0 HB2 HIS A 411 -5.725 -3.161 -10.365 1.00 25.41 H new ATOM 0 HB3 HIS A 411 -5.488 -4.897 -10.417 1.00 25.41 H new ATOM 0 HD2 HIS A 411 -7.799 -3.330 -12.169 1.00 22.40 H new ATOM 0 HE1 HIS A 411 -10.515 -5.325 -9.609 1.00 44.22 H new ATOM 0 HE2 HIS A 411 -10.267 -4.083 -11.813 1.00 60.00 H new ATOM 274 N LEU A 412 -3.685 -4.424 -7.113 1.00 31.32 N ATOM 275 CA LEU A 412 -2.251 -4.385 -6.834 1.00 54.30 C ATOM 276 C LEU A 412 -1.619 -5.649 -7.448 1.00 43.11 C ATOM 277 O LEU A 412 -2.090 -6.751 -7.136 1.00 64.23 O ATOM 278 CB LEU A 412 -1.960 -4.246 -5.293 1.00 4.41 C ATOM 279 CG LEU A 412 -0.596 -4.789 -4.777 1.00 5.13 C ATOM 280 CD1 LEU A 412 0.081 -3.811 -3.834 1.00 1.41 C ATOM 281 CD2 LEU A 412 -0.707 -6.147 -4.061 1.00 32.42 C ATOM 0 H LEU A 412 -4.259 -4.704 -6.317 1.00 31.32 H new ATOM 0 HA LEU A 412 -1.801 -3.502 -7.287 1.00 54.30 H new ATOM 0 HB2 LEU A 412 -2.025 -3.190 -5.031 1.00 4.41 H new ATOM 0 HB3 LEU A 412 -2.755 -4.759 -4.751 1.00 4.41 H new ATOM 0 HG LEU A 412 0.004 -4.921 -5.678 1.00 5.13 H new ATOM 0 HD11 LEU A 412 1.030 -4.228 -3.497 1.00 1.41 H new ATOM 0 HD12 LEU A 412 0.263 -2.870 -4.354 1.00 1.41 H new ATOM 0 HD13 LEU A 412 -0.563 -3.631 -2.973 1.00 1.41 H new ATOM 0 HD21 LEU A 412 0.281 -6.465 -3.728 1.00 32.42 H new ATOM 0 HD22 LEU A 412 -1.367 -6.051 -3.199 1.00 32.42 H new ATOM 0 HD23 LEU A 412 -1.114 -6.889 -4.748 1.00 32.42 H new ATOM 293 N PRO A 413 -0.619 -5.552 -8.387 1.00 51.12 N ATOM 294 CA PRO A 413 -0.004 -6.749 -8.982 1.00 4.23 C ATOM 295 C PRO A 413 0.907 -7.612 -8.063 1.00 62.14 C ATOM 296 O PRO A 413 1.133 -7.288 -6.898 1.00 11.31 O ATOM 297 CB PRO A 413 0.651 -6.262 -10.236 1.00 30.01 C ATOM 298 CG PRO A 413 0.977 -4.845 -10.018 1.00 22.05 C ATOM 299 CD PRO A 413 -0.014 -4.302 -9.016 1.00 74.01 C ATOM 0 HA PRO A 413 -0.775 -7.493 -9.182 1.00 4.23 H new ATOM 0 HB2 PRO A 413 1.551 -6.838 -10.451 1.00 30.01 H new ATOM 0 HB3 PRO A 413 -0.015 -6.379 -11.091 1.00 30.01 H new ATOM 0 HG2 PRO A 413 1.996 -4.739 -9.646 1.00 22.05 H new ATOM 0 HG3 PRO A 413 0.920 -4.290 -10.954 1.00 22.05 H new ATOM 0 HD2 PRO A 413 0.475 -3.675 -8.270 1.00 74.01 H new ATOM 0 HD3 PRO A 413 -0.775 -3.689 -9.498 1.00 74.01 H new ATOM 307 N GLN A 414 1.433 -8.699 -8.670 1.00 41.20 N ATOM 308 CA GLN A 414 1.698 -10.039 -8.088 1.00 21.42 C ATOM 309 C GLN A 414 2.034 -10.235 -6.540 1.00 33.03 C ATOM 310 O GLN A 414 1.213 -10.817 -5.839 1.00 75.31 O ATOM 311 CB GLN A 414 2.927 -10.520 -8.939 1.00 71.42 C ATOM 312 CG GLN A 414 3.968 -9.412 -9.345 1.00 23.14 C ATOM 313 CD GLN A 414 5.144 -9.258 -8.375 1.00 61.41 C ATOM 314 OE1 GLN A 414 5.583 -10.223 -7.760 1.00 34.12 O ATOM 315 NE2 GLN A 414 5.631 -8.032 -8.205 1.00 2.52 N ATOM 0 H GLN A 414 1.704 -8.663 -9.653 1.00 41.20 H new ATOM 0 HA GLN A 414 0.756 -10.586 -8.130 1.00 21.42 H new ATOM 0 HB2 GLN A 414 3.451 -11.293 -8.377 1.00 71.42 H new ATOM 0 HB3 GLN A 414 2.551 -10.987 -9.849 1.00 71.42 H new ATOM 0 HG2 GLN A 414 4.359 -9.644 -10.336 1.00 23.14 H new ATOM 0 HG3 GLN A 414 3.450 -8.456 -9.423 1.00 23.14 H new ATOM 0 HE21 GLN A 414 5.242 -7.251 -8.733 1.00 2.52 H new ATOM 0 HE22 GLN A 414 6.393 -7.873 -7.546 1.00 2.52 H new ATOM 324 N GLU A 415 3.157 -9.749 -5.992 1.00 61.20 N ATOM 325 CA GLU A 415 3.408 -9.823 -4.519 1.00 72.22 C ATOM 326 C GLU A 415 3.397 -8.436 -3.824 1.00 61.42 C ATOM 327 O GLU A 415 3.412 -8.377 -2.592 1.00 12.41 O ATOM 328 CB GLU A 415 4.740 -10.655 -4.238 1.00 52.42 C ATOM 329 CG GLU A 415 5.474 -10.411 -2.898 1.00 23.41 C ATOM 330 CD GLU A 415 6.842 -11.067 -2.817 1.00 13.21 C ATOM 331 OE1 GLU A 415 7.687 -10.821 -3.703 1.00 42.51 O ATOM 332 OE2 GLU A 415 7.086 -11.799 -1.836 1.00 22.10 O ATOM 0 H GLU A 415 3.904 -9.304 -6.525 1.00 61.20 H new ATOM 0 HA GLU A 415 2.574 -10.356 -4.063 1.00 72.22 H new ATOM 0 HB2 GLU A 415 4.491 -11.715 -4.295 1.00 52.42 H new ATOM 0 HB3 GLU A 415 5.441 -10.448 -5.046 1.00 52.42 H new ATOM 0 HG2 GLU A 415 5.587 -9.337 -2.747 1.00 23.41 H new ATOM 0 HG3 GLU A 415 4.854 -10.784 -2.082 1.00 23.41 H new ATOM 339 N PHE A 416 3.099 -7.363 -4.572 1.00 44.32 N ATOM 340 CA PHE A 416 3.836 -6.062 -4.389 1.00 14.22 C ATOM 341 C PHE A 416 3.789 -5.569 -2.897 1.00 21.43 C ATOM 342 O PHE A 416 2.761 -5.072 -2.434 1.00 54.11 O ATOM 343 CB PHE A 416 3.255 -4.904 -5.291 1.00 12.15 C ATOM 344 CG PHE A 416 3.974 -4.409 -6.519 1.00 25.22 C ATOM 345 CD1 PHE A 416 4.941 -5.106 -7.253 1.00 64.12 C ATOM 346 CD2 PHE A 416 3.618 -3.127 -6.929 1.00 44.11 C ATOM 347 CE1 PHE A 416 5.510 -4.531 -8.375 1.00 50.13 C ATOM 348 CE2 PHE A 416 4.186 -2.548 -8.037 1.00 42.14 C ATOM 349 CZ PHE A 416 5.137 -3.246 -8.768 1.00 63.44 C ATOM 0 H PHE A 416 2.378 -7.348 -5.294 1.00 44.32 H new ATOM 0 HA PHE A 416 4.863 -6.274 -4.686 1.00 14.22 H new ATOM 0 HB2 PHE A 416 2.265 -5.225 -5.615 1.00 12.15 H new ATOM 0 HB3 PHE A 416 3.113 -4.041 -4.641 1.00 12.15 H new ATOM 0 HD1 PHE A 416 5.244 -6.095 -6.942 1.00 64.12 H new ATOM 0 HD2 PHE A 416 2.880 -2.577 -6.364 1.00 44.11 H new ATOM 0 HE1 PHE A 416 6.244 -5.078 -8.948 1.00 50.13 H new ATOM 0 HE2 PHE A 416 3.894 -1.553 -8.339 1.00 42.14 H new ATOM 0 HZ PHE A 416 5.587 -2.795 -9.640 1.00 63.44 H new ATOM 359 N GLY A 417 4.898 -5.762 -2.126 1.00 45.41 N ATOM 360 CA GLY A 417 4.934 -5.366 -0.710 1.00 74.24 C ATOM 361 C GLY A 417 5.732 -4.058 -0.432 1.00 63.43 C ATOM 362 O GLY A 417 6.077 -3.354 -1.385 1.00 61.31 O ATOM 0 H GLY A 417 5.762 -6.184 -2.467 1.00 45.41 H new ATOM 0 HA2 GLY A 417 3.912 -5.237 -0.355 1.00 74.24 H new ATOM 0 HA3 GLY A 417 5.374 -6.177 -0.129 1.00 74.24 H new ATOM 366 N ASP A 418 5.990 -3.746 0.882 1.00 43.40 N ATOM 367 CA ASP A 418 6.614 -2.434 1.342 1.00 64.53 C ATOM 368 C ASP A 418 7.857 -2.013 0.528 1.00 31.04 C ATOM 369 O ASP A 418 7.955 -0.858 0.084 1.00 44.41 O ATOM 370 CB ASP A 418 6.956 -2.388 2.903 1.00 22.24 C ATOM 371 CG ASP A 418 7.796 -1.183 3.311 1.00 23.10 C ATOM 372 OD1 ASP A 418 7.229 -0.084 3.470 1.00 53.21 O ATOM 373 OD2 ASP A 418 9.024 -1.349 3.496 1.00 21.45 O ATOM 0 H ASP A 418 5.778 -4.382 1.651 1.00 43.40 H new ATOM 0 HA ASP A 418 5.824 -1.708 1.151 1.00 64.53 H new ATOM 0 HB2 ASP A 418 6.025 -2.379 3.470 1.00 22.24 H new ATOM 0 HB3 ASP A 418 7.487 -3.300 3.177 1.00 22.24 H new ATOM 378 N GLN A 419 8.783 -2.949 0.323 1.00 25.02 N ATOM 379 CA GLN A 419 10.069 -2.635 -0.282 1.00 51.04 C ATOM 380 C GLN A 419 9.962 -2.204 -1.755 1.00 54.13 C ATOM 381 O GLN A 419 10.695 -1.291 -2.153 1.00 35.04 O ATOM 382 CB GLN A 419 11.099 -3.779 -0.117 1.00 64.53 C ATOM 383 CG GLN A 419 10.823 -5.050 -0.985 1.00 73.50 C ATOM 384 CD GLN A 419 11.907 -5.372 -2.020 1.00 14.51 C ATOM 385 OE1 GLN A 419 12.091 -6.542 -2.359 1.00 63.02 O ATOM 386 NE2 GLN A 419 12.636 -4.380 -2.534 1.00 62.52 N ATOM 0 H GLN A 419 8.663 -3.932 0.569 1.00 25.02 H new ATOM 0 HA GLN A 419 10.437 -1.773 0.274 1.00 51.04 H new ATOM 0 HB2 GLN A 419 12.088 -3.395 -0.367 1.00 64.53 H new ATOM 0 HB3 GLN A 419 11.127 -4.073 0.932 1.00 64.53 H new ATOM 0 HG2 GLN A 419 10.708 -5.907 -0.322 1.00 73.50 H new ATOM 0 HG3 GLN A 419 9.873 -4.919 -1.504 1.00 73.50 H new ATOM 0 HE21 GLN A 419 12.468 -3.418 -2.240 1.00 62.52 H new ATOM 0 HE22 GLN A 419 13.362 -4.584 -3.221 1.00 62.52 H new ATOM 395 N ASP A 420 9.075 -2.838 -2.559 1.00 30.40 N ATOM 396 CA ASP A 420 8.952 -2.460 -3.984 1.00 20.21 C ATOM 397 C ASP A 420 8.454 -1.017 -4.157 1.00 70.43 C ATOM 398 O ASP A 420 9.064 -0.247 -4.919 1.00 72.22 O ATOM 399 CB ASP A 420 8.092 -3.434 -4.851 1.00 64.21 C ATOM 400 CG ASP A 420 6.946 -2.759 -5.557 1.00 51.04 C ATOM 401 OD1 ASP A 420 5.868 -2.679 -4.938 1.00 14.33 O ATOM 402 OD2 ASP A 420 7.144 -2.274 -6.687 1.00 5.11 O ATOM 0 H ASP A 420 8.454 -3.589 -2.257 1.00 30.40 H new ATOM 0 HA ASP A 420 9.971 -2.537 -4.364 1.00 20.21 H new ATOM 0 HB2 ASP A 420 8.734 -3.911 -5.592 1.00 64.21 H new ATOM 0 HB3 ASP A 420 7.699 -4.225 -4.212 1.00 64.21 H new ATOM 407 N ILE A 421 7.348 -0.671 -3.446 1.00 11.51 N ATOM 408 CA ILE A 421 6.638 0.608 -3.628 1.00 73.43 C ATOM 409 C ILE A 421 7.541 1.842 -3.328 1.00 42.22 C ATOM 410 O ILE A 421 7.246 2.962 -3.784 1.00 60.41 O ATOM 411 CB ILE A 421 5.266 0.655 -2.754 1.00 30.00 C ATOM 412 CG1 ILE A 421 3.981 0.943 -3.622 1.00 12.13 C ATOM 413 CG2 ILE A 421 5.301 1.599 -1.529 1.00 30.51 C ATOM 414 CD1 ILE A 421 2.791 1.615 -2.926 1.00 31.11 C ATOM 0 H ILE A 421 6.931 -1.273 -2.736 1.00 11.51 H new ATOM 0 HA ILE A 421 6.368 0.666 -4.683 1.00 73.43 H new ATOM 0 HB ILE A 421 5.198 -0.360 -2.362 1.00 30.00 H new ATOM 0 HG12 ILE A 421 4.277 1.571 -4.463 1.00 12.13 H new ATOM 0 HG13 ILE A 421 3.637 -0.004 -4.037 1.00 12.13 H new ATOM 0 HG21 ILE A 421 4.342 1.560 -1.012 1.00 30.51 H new ATOM 0 HG22 ILE A 421 6.092 1.284 -0.849 1.00 30.51 H new ATOM 0 HG23 ILE A 421 5.493 2.619 -1.861 1.00 30.51 H new ATOM 0 HD11 ILE A 421 1.980 1.751 -3.642 1.00 31.11 H new ATOM 0 HD12 ILE A 421 2.448 0.986 -2.104 1.00 31.11 H new ATOM 0 HD13 ILE A 421 3.098 2.586 -2.536 1.00 31.11 H new ATOM 426 N LEU A 422 8.668 1.627 -2.610 1.00 5.45 N ATOM 427 CA LEU A 422 9.464 2.709 -2.146 1.00 0.42 C ATOM 428 C LEU A 422 10.510 3.076 -3.238 1.00 31.40 C ATOM 429 O LEU A 422 10.876 4.240 -3.393 1.00 1.03 O ATOM 430 CB LEU A 422 10.112 2.404 -0.726 1.00 72.51 C ATOM 431 CG LEU A 422 11.148 3.465 -0.168 1.00 20.51 C ATOM 432 CD1 LEU A 422 10.532 4.854 0.149 1.00 60.01 C ATOM 433 CD2 LEU A 422 11.877 3.007 1.102 1.00 4.34 C ATOM 0 H LEU A 422 9.018 0.703 -2.357 1.00 5.45 H new ATOM 0 HA LEU A 422 8.832 3.582 -1.981 1.00 0.42 H new ATOM 0 HB2 LEU A 422 9.305 2.303 0.000 1.00 72.51 H new ATOM 0 HB3 LEU A 422 10.613 1.438 -0.782 1.00 72.51 H new ATOM 0 HG LEU A 422 11.850 3.554 -0.997 1.00 20.51 H new ATOM 0 HD11 LEU A 422 11.309 5.519 0.526 1.00 60.01 H new ATOM 0 HD12 LEU A 422 10.101 5.277 -0.759 1.00 60.01 H new ATOM 0 HD13 LEU A 422 9.753 4.743 0.903 1.00 60.01 H new ATOM 0 HD21 LEU A 422 12.569 3.785 1.425 1.00 4.34 H new ATOM 0 HD22 LEU A 422 11.149 2.819 1.891 1.00 4.34 H new ATOM 0 HD23 LEU A 422 12.431 2.092 0.893 1.00 4.34 H new ATOM 445 N GLN A 423 10.968 2.051 -4.000 1.00 74.20 N ATOM 446 CA GLN A 423 11.915 2.262 -5.163 1.00 11.14 C ATOM 447 C GLN A 423 11.198 2.613 -6.477 1.00 34.33 C ATOM 448 O GLN A 423 11.496 3.651 -7.069 1.00 23.30 O ATOM 449 CB GLN A 423 12.784 1.011 -5.528 1.00 34.25 C ATOM 450 CG GLN A 423 13.853 0.533 -4.540 1.00 25.01 C ATOM 451 CD GLN A 423 13.811 -0.986 -4.270 1.00 14.35 C ATOM 452 OE1 GLN A 423 14.858 -1.562 -3.968 1.00 73.10 O ATOM 453 NE2 GLN A 423 12.648 -1.690 -4.373 1.00 54.33 N ATOM 0 H GLN A 423 10.710 1.076 -3.846 1.00 74.20 H new ATOM 0 HA GLN A 423 12.534 3.080 -4.794 1.00 11.14 H new ATOM 0 HB2 GLN A 423 12.103 0.178 -5.704 1.00 34.25 H new ATOM 0 HB3 GLN A 423 13.282 1.221 -6.475 1.00 34.25 H new ATOM 0 HG2 GLN A 423 14.837 0.798 -4.927 1.00 25.01 H new ATOM 0 HG3 GLN A 423 13.728 1.065 -3.597 1.00 25.01 H new ATOM 0 HE21 GLN A 423 11.783 -1.211 -4.623 1.00 54.33 H new ATOM 0 HE22 GLN A 423 12.643 -2.695 -4.200 1.00 54.33 H new ATOM 462 N MET A 424 10.313 1.719 -6.959 1.00 52.31 N ATOM 463 CA MET A 424 9.700 1.869 -8.320 1.00 12.42 C ATOM 464 C MET A 424 8.767 3.139 -8.445 1.00 54.31 C ATOM 465 O MET A 424 8.532 3.617 -9.562 1.00 44.25 O ATOM 466 CB MET A 424 9.002 0.529 -8.825 1.00 11.13 C ATOM 467 CG MET A 424 8.580 0.489 -10.332 1.00 3.52 C ATOM 468 SD MET A 424 9.901 1.052 -11.427 1.00 52.51 S ATOM 469 CE MET A 424 8.988 2.137 -12.531 1.00 43.21 C ATOM 0 H MET A 424 10.002 0.894 -6.446 1.00 52.31 H new ATOM 0 HA MET A 424 10.529 2.053 -9.004 1.00 12.42 H new ATOM 0 HB2 MET A 424 9.683 -0.302 -8.639 1.00 11.13 H new ATOM 0 HB3 MET A 424 8.114 0.356 -8.217 1.00 11.13 H new ATOM 0 HG2 MET A 424 8.297 -0.529 -10.601 1.00 3.52 H new ATOM 0 HG3 MET A 424 7.699 1.114 -10.477 1.00 3.52 H new ATOM 0 HE1 MET A 424 9.538 2.251 -13.465 1.00 43.21 H new ATOM 0 HE2 MET A 424 8.008 1.706 -12.737 1.00 43.21 H new ATOM 0 HE3 MET A 424 8.864 3.113 -12.061 1.00 43.21 H new ATOM 479 N PHE A 425 8.286 3.745 -7.324 1.00 31.32 N ATOM 480 CA PHE A 425 7.460 4.960 -7.420 1.00 32.22 C ATOM 481 C PHE A 425 8.313 6.253 -7.132 1.00 73.35 C ATOM 482 O PHE A 425 7.790 7.355 -7.180 1.00 71.45 O ATOM 483 CB PHE A 425 6.215 4.721 -6.530 1.00 4.40 C ATOM 484 CG PHE A 425 4.880 4.548 -7.267 1.00 61.34 C ATOM 485 CD1 PHE A 425 4.527 3.290 -7.776 1.00 1.33 C ATOM 486 CD2 PHE A 425 3.961 5.602 -7.461 1.00 71.55 C ATOM 487 CE1 PHE A 425 3.329 3.091 -8.436 1.00 62.43 C ATOM 488 CE2 PHE A 425 2.776 5.369 -8.114 1.00 12.10 C ATOM 489 CZ PHE A 425 2.465 4.132 -8.596 1.00 63.53 C ATOM 0 H PHE A 425 8.455 3.416 -6.373 1.00 31.32 H new ATOM 0 HA PHE A 425 7.094 5.155 -8.428 1.00 32.22 H new ATOM 0 HB2 PHE A 425 6.391 3.831 -5.926 1.00 4.40 H new ATOM 0 HB3 PHE A 425 6.120 5.560 -5.841 1.00 4.40 H new ATOM 0 HD1 PHE A 425 5.205 2.459 -7.650 1.00 1.33 H new ATOM 0 HD2 PHE A 425 4.190 6.592 -7.096 1.00 71.55 H new ATOM 0 HE1 PHE A 425 3.079 2.114 -8.823 1.00 62.43 H new ATOM 0 HE2 PHE A 425 2.077 6.181 -8.248 1.00 12.10 H new ATOM 0 HZ PHE A 425 1.527 3.976 -9.108 1.00 63.53 H new ATOM 499 N MET A 426 9.651 6.106 -6.880 1.00 53.31 N ATOM 500 CA MET A 426 10.536 7.201 -6.406 1.00 23.24 C ATOM 501 C MET A 426 10.931 8.283 -7.473 1.00 23.34 C ATOM 502 O MET A 426 10.836 9.449 -7.129 1.00 5.25 O ATOM 503 CB MET A 426 11.862 6.635 -5.841 1.00 62.34 C ATOM 504 CG MET A 426 12.280 7.183 -4.473 1.00 11.45 C ATOM 505 SD MET A 426 12.335 8.986 -4.378 1.00 21.45 S ATOM 506 CE MET A 426 12.962 9.226 -2.717 1.00 44.23 C ATOM 0 H MET A 426 10.140 5.219 -7.003 1.00 53.31 H new ATOM 0 HA MET A 426 9.925 7.694 -5.650 1.00 23.24 H new ATOM 0 HB2 MET A 426 11.773 5.551 -5.767 1.00 62.34 H new ATOM 0 HB3 MET A 426 12.659 6.841 -6.555 1.00 62.34 H new ATOM 0 HG2 MET A 426 11.586 6.812 -3.719 1.00 11.45 H new ATOM 0 HG3 MET A 426 13.264 6.788 -4.222 1.00 11.45 H new ATOM 0 HE1 MET A 426 13.050 10.293 -2.512 1.00 44.23 H new ATOM 0 HE2 MET A 426 12.276 8.775 -2.000 1.00 44.23 H new ATOM 0 HE3 MET A 426 13.942 8.757 -2.627 1.00 44.23 H new ATOM 516 N PRO A 427 11.436 7.930 -8.747 1.00 35.44 N ATOM 517 CA PRO A 427 12.179 8.863 -9.698 1.00 1.42 C ATOM 518 C PRO A 427 11.535 10.255 -10.090 1.00 63.22 C ATOM 519 O PRO A 427 12.143 11.000 -10.865 1.00 62.14 O ATOM 520 CB PRO A 427 12.380 7.939 -10.950 1.00 53.14 C ATOM 521 CG PRO A 427 11.269 6.980 -10.832 1.00 74.55 C ATOM 522 CD PRO A 427 11.364 6.597 -9.399 1.00 73.05 C ATOM 0 HA PRO A 427 13.075 9.239 -9.204 1.00 1.42 H new ATOM 0 HB2 PRO A 427 12.329 8.503 -11.881 1.00 53.14 H new ATOM 0 HB3 PRO A 427 13.349 7.439 -10.932 1.00 53.14 H new ATOM 0 HG2 PRO A 427 10.308 7.433 -11.073 1.00 74.55 H new ATOM 0 HG3 PRO A 427 11.393 6.124 -11.495 1.00 74.55 H new ATOM 0 HD2 PRO A 427 10.498 6.024 -9.068 1.00 73.05 H new ATOM 0 HD3 PRO A 427 12.246 5.990 -9.193 1.00 73.05 H new ATOM 530 N PHE A 428 10.347 10.609 -9.568 1.00 23.42 N ATOM 531 CA PHE A 428 9.776 11.984 -9.683 1.00 33.32 C ATOM 532 C PHE A 428 9.660 12.781 -8.321 1.00 12.34 C ATOM 533 O PHE A 428 8.902 13.756 -8.250 1.00 23.11 O ATOM 534 CB PHE A 428 8.412 12.042 -10.463 1.00 22.04 C ATOM 535 CG PHE A 428 7.857 10.771 -11.120 1.00 62.45 C ATOM 536 CD1 PHE A 428 7.018 9.895 -10.424 1.00 74.42 C ATOM 537 CD2 PHE A 428 8.111 10.499 -12.468 1.00 73.14 C ATOM 538 CE1 PHE A 428 6.468 8.777 -11.054 1.00 44.40 C ATOM 539 CE2 PHE A 428 7.555 9.388 -13.095 1.00 13.20 C ATOM 540 CZ PHE A 428 6.737 8.533 -12.385 1.00 24.15 C ATOM 0 H PHE A 428 9.750 9.961 -9.055 1.00 23.42 H new ATOM 0 HA PHE A 428 10.530 12.497 -10.279 1.00 33.32 H new ATOM 0 HB2 PHE A 428 7.655 12.407 -9.769 1.00 22.04 H new ATOM 0 HB3 PHE A 428 8.516 12.794 -11.245 1.00 22.04 H new ATOM 0 HD1 PHE A 428 6.792 10.086 -9.385 1.00 74.42 H new ATOM 0 HD2 PHE A 428 8.750 11.163 -13.032 1.00 73.14 H new ATOM 0 HE1 PHE A 428 5.832 8.103 -10.499 1.00 44.40 H new ATOM 0 HE2 PHE A 428 7.764 9.195 -14.137 1.00 13.20 H new ATOM 0 HZ PHE A 428 6.306 7.671 -12.872 1.00 24.15 H new ATOM 550 N GLY A 429 10.409 12.390 -7.256 1.00 41.40 N ATOM 551 CA GLY A 429 10.621 13.265 -6.079 1.00 21.35 C ATOM 552 C GLY A 429 10.228 12.635 -4.699 1.00 74.12 C ATOM 553 O GLY A 429 9.973 11.431 -4.637 1.00 64.43 O ATOM 0 H GLY A 429 10.871 11.483 -7.191 1.00 41.40 H new ATOM 0 HA2 GLY A 429 11.672 13.551 -6.044 1.00 21.35 H new ATOM 0 HA3 GLY A 429 10.046 14.181 -6.219 1.00 21.35 H new ATOM 557 N ASN A 430 10.162 13.446 -3.588 1.00 40.32 N ATOM 558 CA ASN A 430 10.271 12.886 -2.206 1.00 13.31 C ATOM 559 C ASN A 430 8.902 12.411 -1.604 1.00 61.25 C ATOM 560 O ASN A 430 7.894 13.120 -1.693 1.00 12.44 O ATOM 561 CB ASN A 430 11.040 13.860 -1.237 1.00 34.11 C ATOM 562 CG ASN A 430 10.360 15.149 -0.813 1.00 14.13 C ATOM 563 OD1 ASN A 430 9.564 15.747 -1.537 1.00 54.13 O ATOM 564 ND2 ASN A 430 10.736 15.598 0.391 1.00 51.34 N ATOM 0 H ASN A 430 10.038 14.458 -3.626 1.00 40.32 H new ATOM 0 HA ASN A 430 10.870 11.981 -2.304 1.00 13.31 H new ATOM 0 HB2 ASN A 430 11.285 13.302 -0.333 1.00 34.11 H new ATOM 0 HB3 ASN A 430 11.984 14.125 -1.714 1.00 34.11 H new ATOM 0 HD21 ASN A 430 10.359 16.476 0.749 1.00 51.34 H new ATOM 0 HD22 ASN A 430 11.399 15.062 0.951 1.00 51.34 H new ATOM 571 N VAL A 431 8.875 11.175 -1.029 1.00 11.45 N ATOM 572 CA VAL A 431 7.622 10.519 -0.552 1.00 63.20 C ATOM 573 C VAL A 431 7.509 10.467 1.030 1.00 75.24 C ATOM 574 O VAL A 431 8.522 10.243 1.702 1.00 73.51 O ATOM 575 CB VAL A 431 7.480 9.076 -1.227 1.00 1.30 C ATOM 576 CG1 VAL A 431 8.813 8.470 -1.566 1.00 1.01 C ATOM 577 CG2 VAL A 431 6.732 8.031 -0.396 1.00 42.44 C ATOM 0 H VAL A 431 9.712 10.610 -0.884 1.00 11.45 H new ATOM 0 HA VAL A 431 6.779 11.134 -0.869 1.00 63.20 H new ATOM 0 HB VAL A 431 6.893 9.298 -2.118 1.00 1.30 H new ATOM 0 HG11 VAL A 431 8.662 7.491 -2.022 1.00 1.01 H new ATOM 0 HG12 VAL A 431 9.340 9.119 -2.266 1.00 1.01 H new ATOM 0 HG13 VAL A 431 9.404 8.360 -0.657 1.00 1.01 H new ATOM 0 HG21 VAL A 431 6.692 7.090 -0.945 1.00 42.44 H new ATOM 0 HG22 VAL A 431 7.252 7.878 0.550 1.00 42.44 H new ATOM 0 HG23 VAL A 431 5.718 8.380 -0.200 1.00 42.44 H new ATOM 587 N ILE A 432 6.287 10.689 1.632 1.00 33.45 N ATOM 588 CA ILE A 432 6.148 10.736 3.120 1.00 11.22 C ATOM 589 C ILE A 432 5.438 9.469 3.757 1.00 11.02 C ATOM 590 O ILE A 432 5.592 9.237 4.959 1.00 52.13 O ATOM 591 CB ILE A 432 5.390 12.025 3.651 1.00 75.50 C ATOM 592 CG1 ILE A 432 5.347 13.183 2.650 1.00 12.44 C ATOM 593 CG2 ILE A 432 6.061 12.576 4.885 1.00 61.25 C ATOM 594 CD1 ILE A 432 4.664 14.473 3.155 1.00 52.22 C ATOM 0 H ILE A 432 5.416 10.833 1.121 1.00 33.45 H new ATOM 0 HA ILE A 432 7.189 10.759 3.444 1.00 11.22 H new ATOM 0 HB ILE A 432 4.376 11.675 3.844 1.00 75.50 H new ATOM 0 HG12 ILE A 432 6.368 13.425 2.356 1.00 12.44 H new ATOM 0 HG13 ILE A 432 4.829 12.846 1.753 1.00 12.44 H new ATOM 0 HG21 ILE A 432 5.522 13.459 5.229 1.00 61.25 H new ATOM 0 HG22 ILE A 432 6.057 11.820 5.670 1.00 61.25 H new ATOM 0 HG23 ILE A 432 7.090 12.848 4.649 1.00 61.25 H new ATOM 0 HD11 ILE A 432 4.688 15.229 2.370 1.00 52.22 H new ATOM 0 HD12 ILE A 432 3.629 14.257 3.420 1.00 52.22 H new ATOM 0 HD13 ILE A 432 5.193 14.845 4.033 1.00 52.22 H new ATOM 606 N SER A 433 4.668 8.665 2.971 1.00 11.05 N ATOM 607 CA SER A 433 3.853 7.498 3.482 1.00 31.25 C ATOM 608 C SER A 433 3.928 6.262 2.515 1.00 61.42 C ATOM 609 O SER A 433 3.712 6.423 1.313 1.00 14.25 O ATOM 610 CB SER A 433 2.351 7.922 3.682 1.00 63.42 C ATOM 611 OG SER A 433 2.245 9.240 4.210 1.00 21.10 O ATOM 0 H SER A 433 4.587 8.798 1.963 1.00 11.05 H new ATOM 0 HA SER A 433 4.280 7.203 4.441 1.00 31.25 H new ATOM 0 HB2 SER A 433 1.827 7.868 2.728 1.00 63.42 H new ATOM 0 HB3 SER A 433 1.860 7.219 4.355 1.00 63.42 H new ATOM 0 HG SER A 433 2.516 9.238 5.152 1.00 21.10 H new ATOM 617 N ALA A 434 4.239 5.038 3.066 1.00 51.12 N ATOM 618 CA ALA A 434 4.152 3.719 2.315 1.00 45.43 C ATOM 619 C ALA A 434 3.584 2.553 3.260 1.00 42.15 C ATOM 620 O ALA A 434 4.235 2.260 4.263 1.00 43.43 O ATOM 621 CB ALA A 434 5.539 3.313 1.749 1.00 64.15 C ATOM 0 H ALA A 434 4.554 4.932 4.030 1.00 51.12 H new ATOM 0 HA ALA A 434 3.461 3.859 1.484 1.00 45.43 H new ATOM 0 HB1 ALA A 434 5.451 2.366 1.216 1.00 64.15 H new ATOM 0 HB2 ALA A 434 5.892 4.084 1.064 1.00 64.15 H new ATOM 0 HB3 ALA A 434 6.249 3.203 2.569 1.00 64.15 H new ATOM 627 N LYS A 435 2.376 1.899 2.982 1.00 0.44 N ATOM 628 CA LYS A 435 1.858 0.724 3.779 1.00 14.22 C ATOM 629 C LYS A 435 0.914 -0.194 2.874 1.00 4.35 C ATOM 630 O LYS A 435 0.174 0.360 2.055 1.00 11.34 O ATOM 631 CB LYS A 435 1.152 1.154 5.154 1.00 71.41 C ATOM 632 CG LYS A 435 -0.149 2.022 5.183 1.00 11.23 C ATOM 633 CD LYS A 435 -1.405 1.240 4.725 1.00 25.32 C ATOM 634 CE LYS A 435 -2.791 1.836 5.098 1.00 11.33 C ATOM 635 NZ LYS A 435 -2.763 3.174 5.742 1.00 71.44 N ATOM 0 H LYS A 435 1.760 2.174 2.217 1.00 0.44 H new ATOM 0 HA LYS A 435 2.723 0.132 4.077 1.00 14.22 H new ATOM 0 HB2 LYS A 435 0.928 0.234 5.693 1.00 71.41 H new ATOM 0 HB3 LYS A 435 1.901 1.690 5.737 1.00 71.41 H new ATOM 0 HG2 LYS A 435 -0.308 2.395 6.195 1.00 11.23 H new ATOM 0 HG3 LYS A 435 -0.014 2.892 4.540 1.00 11.23 H new ATOM 0 HD2 LYS A 435 -1.362 1.138 3.641 1.00 25.32 H new ATOM 0 HD3 LYS A 435 -1.347 0.235 5.142 1.00 25.32 H new ATOM 0 HE2 LYS A 435 -3.394 1.901 4.192 1.00 11.33 H new ATOM 0 HE3 LYS A 435 -3.297 1.141 5.768 1.00 11.33 H new ATOM 0 HZ1 LYS A 435 -3.736 3.517 5.872 1.00 71.44 H new ATOM 0 HZ2 LYS A 435 -2.294 3.104 6.667 1.00 71.44 H new ATOM 0 HZ3 LYS A 435 -2.240 3.839 5.138 1.00 71.44 H new ATOM 649 N VAL A 436 0.951 -1.573 2.970 1.00 43.55 N ATOM 650 CA VAL A 436 -0.152 -2.436 2.370 1.00 13.23 C ATOM 651 C VAL A 436 -1.002 -3.074 3.546 1.00 21.44 C ATOM 652 O VAL A 436 -0.706 -4.161 4.053 1.00 14.21 O ATOM 653 CB VAL A 436 0.460 -3.552 1.339 1.00 14.24 C ATOM 654 CG1 VAL A 436 -0.462 -4.742 1.003 1.00 12.54 C ATOM 655 CG2 VAL A 436 0.908 -3.005 -0.039 1.00 24.40 C ATOM 0 H VAL A 436 1.694 -2.095 3.434 1.00 43.55 H new ATOM 0 HA VAL A 436 -0.820 -1.820 1.768 1.00 13.23 H new ATOM 0 HB VAL A 436 1.311 -3.880 1.936 1.00 14.24 H new ATOM 0 HG11 VAL A 436 0.048 -5.414 0.313 1.00 12.54 H new ATOM 0 HG12 VAL A 436 -0.709 -5.280 1.918 1.00 12.54 H new ATOM 0 HG13 VAL A 436 -1.377 -4.374 0.540 1.00 12.54 H new ATOM 0 HG21 VAL A 436 1.297 -3.822 -0.646 1.00 24.40 H new ATOM 0 HG22 VAL A 436 0.056 -2.551 -0.545 1.00 24.40 H new ATOM 0 HG23 VAL A 436 1.687 -2.256 0.103 1.00 24.40 H new ATOM 665 N PHE A 437 -1.979 -2.257 4.065 1.00 25.30 N ATOM 666 CA PHE A 437 -3.199 -2.666 4.838 1.00 21.42 C ATOM 667 C PHE A 437 -4.519 -2.119 4.216 1.00 51.31 C ATOM 668 O PHE A 437 -4.491 -1.102 3.526 1.00 12.42 O ATOM 669 CB PHE A 437 -3.148 -2.302 6.347 1.00 34.44 C ATOM 670 CG PHE A 437 -2.679 -3.412 7.280 1.00 75.44 C ATOM 671 CD1 PHE A 437 -3.553 -4.410 7.732 1.00 71.12 C ATOM 672 CD2 PHE A 437 -1.376 -3.429 7.749 1.00 75.02 C ATOM 673 CE1 PHE A 437 -3.120 -5.387 8.618 1.00 40.32 C ATOM 674 CE2 PHE A 437 -0.946 -4.407 8.625 1.00 41.22 C ATOM 675 CZ PHE A 437 -1.817 -5.382 9.061 1.00 32.32 C ATOM 0 H PHE A 437 -1.931 -1.245 3.948 1.00 25.30 H new ATOM 0 HA PHE A 437 -3.197 -3.754 4.765 1.00 21.42 H new ATOM 0 HB2 PHE A 437 -2.488 -1.444 6.473 1.00 34.44 H new ATOM 0 HB3 PHE A 437 -4.143 -1.987 6.659 1.00 34.44 H new ATOM 0 HD1 PHE A 437 -4.576 -4.419 7.387 1.00 71.12 H new ATOM 0 HD2 PHE A 437 -0.685 -2.665 7.425 1.00 75.02 H new ATOM 0 HE1 PHE A 437 -3.804 -6.150 8.959 1.00 40.32 H new ATOM 0 HE2 PHE A 437 0.078 -4.407 8.970 1.00 41.22 H new ATOM 0 HZ PHE A 437 -1.477 -6.141 9.750 1.00 32.32 H new ATOM 685 N ILE A 438 -5.666 -2.795 4.479 1.00 63.42 N ATOM 686 CA ILE A 438 -7.037 -2.246 4.135 1.00 35.53 C ATOM 687 C ILE A 438 -7.496 -1.300 5.283 1.00 41.13 C ATOM 688 O ILE A 438 -7.574 -1.756 6.425 1.00 62.42 O ATOM 689 CB ILE A 438 -8.153 -3.391 3.951 1.00 74.50 C ATOM 690 CG1 ILE A 438 -7.594 -4.655 3.246 1.00 30.43 C ATOM 691 CG2 ILE A 438 -9.447 -2.941 3.207 1.00 11.31 C ATOM 692 CD1 ILE A 438 -7.221 -5.793 4.188 1.00 11.11 C ATOM 0 H ILE A 438 -5.688 -3.713 4.923 1.00 63.42 H new ATOM 0 HA ILE A 438 -6.943 -1.724 3.183 1.00 35.53 H new ATOM 0 HB ILE A 438 -8.434 -3.624 4.978 1.00 74.50 H new ATOM 0 HG12 ILE A 438 -8.337 -5.017 2.536 1.00 30.43 H new ATOM 0 HG13 ILE A 438 -6.713 -4.374 2.670 1.00 30.43 H new ATOM 0 HG21 ILE A 438 -10.136 -3.783 3.134 1.00 11.31 H new ATOM 0 HG22 ILE A 438 -9.922 -2.131 3.760 1.00 11.31 H new ATOM 0 HG23 ILE A 438 -9.189 -2.595 2.206 1.00 11.31 H new ATOM 0 HD11 ILE A 438 -6.840 -6.634 3.609 1.00 11.11 H new ATOM 0 HD12 ILE A 438 -6.453 -5.453 4.883 1.00 11.11 H new ATOM 0 HD13 ILE A 438 -8.103 -6.107 4.747 1.00 11.11 H new ATOM 704 N ASP A 439 -7.750 0.033 5.000 1.00 5.52 N ATOM 705 CA ASP A 439 -8.190 0.995 6.049 1.00 22.22 C ATOM 706 C ASP A 439 -9.552 0.608 6.714 1.00 53.42 C ATOM 707 O ASP A 439 -10.621 0.824 6.130 1.00 14.03 O ATOM 708 CB ASP A 439 -8.270 2.454 5.529 1.00 24.20 C ATOM 709 CG ASP A 439 -6.966 3.207 5.740 1.00 41.10 C ATOM 710 OD1 ASP A 439 -5.898 2.564 5.889 1.00 43.32 O ATOM 711 OD2 ASP A 439 -7.007 4.450 5.778 1.00 63.00 O ATOM 0 H ASP A 439 -7.655 0.442 4.071 1.00 5.52 H new ATOM 0 HA ASP A 439 -7.413 0.936 6.811 1.00 22.22 H new ATOM 0 HB2 ASP A 439 -8.517 2.447 4.467 1.00 24.20 H new ATOM 0 HB3 ASP A 439 -9.078 2.977 6.041 1.00 24.20 H new ATOM 716 N LYS A 440 -9.488 0.015 7.937 1.00 20.42 N ATOM 717 CA LYS A 440 -10.677 -0.473 8.706 1.00 61.44 C ATOM 718 C LYS A 440 -11.693 0.631 9.216 1.00 64.41 C ATOM 719 O LYS A 440 -12.739 0.272 9.755 1.00 53.35 O ATOM 720 CB LYS A 440 -10.212 -1.388 9.890 1.00 12.34 C ATOM 721 CG LYS A 440 -8.712 -1.843 9.852 1.00 3.35 C ATOM 722 CD LYS A 440 -7.713 -0.884 10.582 1.00 63.53 C ATOM 723 CE LYS A 440 -6.257 -0.968 10.030 1.00 34.34 C ATOM 724 NZ LYS A 440 -5.275 -0.291 10.915 1.00 15.21 N ATOM 0 H LYS A 440 -8.606 -0.141 8.424 1.00 20.42 H new ATOM 0 HA LYS A 440 -11.257 -1.039 7.978 1.00 61.44 H new ATOM 0 HB2 LYS A 440 -10.387 -0.857 10.825 1.00 12.34 H new ATOM 0 HB3 LYS A 440 -10.842 -2.278 9.906 1.00 12.34 H new ATOM 0 HG2 LYS A 440 -8.636 -2.833 10.302 1.00 3.35 H new ATOM 0 HG3 LYS A 440 -8.404 -1.941 8.811 1.00 3.35 H new ATOM 0 HD2 LYS A 440 -8.071 0.141 10.487 1.00 63.53 H new ATOM 0 HD3 LYS A 440 -7.704 -1.122 11.646 1.00 63.53 H new ATOM 0 HE2 LYS A 440 -5.976 -2.015 9.913 1.00 34.34 H new ATOM 0 HE3 LYS A 440 -6.221 -0.516 9.039 1.00 34.34 H new ATOM 0 HZ1 LYS A 440 -4.323 -0.375 10.505 1.00 15.21 H new ATOM 0 HZ2 LYS A 440 -5.526 0.714 11.007 1.00 15.21 H new ATOM 0 HZ3 LYS A 440 -5.288 -0.738 11.854 1.00 15.21 H new ATOM 738 N GLN A 441 -11.403 1.948 9.048 1.00 30.34 N ATOM 739 CA GLN A 441 -12.268 3.047 9.521 1.00 4.41 C ATOM 740 C GLN A 441 -13.373 3.498 8.509 1.00 54.55 C ATOM 741 O GLN A 441 -14.501 3.735 8.944 1.00 74.35 O ATOM 742 CB GLN A 441 -11.389 4.228 10.033 1.00 33.31 C ATOM 743 CG GLN A 441 -10.060 4.473 9.277 1.00 70.43 C ATOM 744 CD GLN A 441 -9.371 5.755 9.717 1.00 24.30 C ATOM 745 OE1 GLN A 441 -9.605 6.829 9.162 1.00 11.50 O ATOM 746 NE2 GLN A 441 -8.499 5.640 10.713 1.00 73.10 N ATOM 0 H GLN A 441 -10.558 2.272 8.578 1.00 30.34 H new ATOM 0 HA GLN A 441 -12.848 2.653 10.356 1.00 4.41 H new ATOM 0 HB2 GLN A 441 -11.982 5.141 9.986 1.00 33.31 H new ATOM 0 HB3 GLN A 441 -11.157 4.052 11.083 1.00 33.31 H new ATOM 0 HG2 GLN A 441 -9.390 3.629 9.442 1.00 70.43 H new ATOM 0 HG3 GLN A 441 -10.257 4.519 8.206 1.00 70.43 H new ATOM 0 HE21 GLN A 441 -8.335 4.731 11.145 1.00 73.10 H new ATOM 0 HE22 GLN A 441 -7.993 6.461 11.046 1.00 73.10 H new ATOM 755 N THR A 442 -13.098 3.615 7.188 1.00 44.12 N ATOM 756 CA THR A 442 -14.191 3.878 6.198 1.00 41.33 C ATOM 757 C THR A 442 -14.361 2.720 5.186 1.00 33.13 C ATOM 758 O THR A 442 -15.049 2.914 4.179 1.00 3.42 O ATOM 759 CB THR A 442 -14.036 5.254 5.414 1.00 4.03 C ATOM 760 OG1 THR A 442 -12.692 5.383 4.923 1.00 45.42 O ATOM 761 CG2 THR A 442 -14.395 6.516 6.227 1.00 23.44 C ATOM 0 H THR A 442 -12.165 3.536 6.784 1.00 44.12 H new ATOM 0 HA THR A 442 -15.091 3.952 6.808 1.00 41.33 H new ATOM 0 HB THR A 442 -14.761 5.203 4.602 1.00 4.03 H new ATOM 0 HG1 THR A 442 -12.600 6.230 4.439 1.00 45.42 H new ATOM 0 HG21 THR A 442 -14.257 7.401 5.605 1.00 23.44 H new ATOM 0 HG22 THR A 442 -15.435 6.458 6.549 1.00 23.44 H new ATOM 0 HG23 THR A 442 -13.747 6.582 7.101 1.00 23.44 H new ATOM 769 N ASN A 443 -13.806 1.505 5.521 1.00 55.31 N ATOM 770 CA ASN A 443 -13.829 0.266 4.672 1.00 22.52 C ATOM 771 C ASN A 443 -13.705 0.541 3.150 1.00 43.24 C ATOM 772 O ASN A 443 -14.585 0.161 2.371 1.00 51.54 O ATOM 773 CB ASN A 443 -15.091 -0.585 4.983 1.00 12.11 C ATOM 774 CG ASN A 443 -15.531 -0.601 6.455 1.00 63.24 C ATOM 775 OD1 ASN A 443 -16.724 -0.572 6.743 1.00 60.15 O ATOM 776 ND2 ASN A 443 -14.592 -0.716 7.395 1.00 30.04 N ATOM 0 H ASN A 443 -13.322 1.361 6.407 1.00 55.31 H new ATOM 0 HA ASN A 443 -12.937 -0.299 4.940 1.00 22.52 H new ATOM 0 HB2 ASN A 443 -15.918 -0.212 4.379 1.00 12.11 H new ATOM 0 HB3 ASN A 443 -14.903 -1.611 4.667 1.00 12.11 H new ATOM 0 HD21 ASN A 443 -14.859 -0.782 8.377 1.00 30.04 H new ATOM 0 HD22 ASN A 443 -13.607 -0.738 7.132 1.00 30.04 H new ATOM 783 N LEU A 444 -12.621 1.211 2.727 1.00 41.14 N ATOM 784 CA LEU A 444 -12.380 1.424 1.293 1.00 62.32 C ATOM 785 C LEU A 444 -11.535 0.246 0.695 1.00 32.43 C ATOM 786 O LEU A 444 -11.036 -0.572 1.469 1.00 42.54 O ATOM 787 CB LEU A 444 -11.926 2.910 0.984 1.00 12.34 C ATOM 788 CG LEU A 444 -10.929 3.653 1.923 1.00 33.25 C ATOM 789 CD1 LEU A 444 -9.518 3.131 1.853 1.00 44.41 C ATOM 790 CD2 LEU A 444 -10.891 5.144 1.577 1.00 72.35 C ATOM 0 H LEU A 444 -11.911 1.607 3.344 1.00 41.14 H new ATOM 0 HA LEU A 444 -13.312 1.365 0.730 1.00 62.32 H new ATOM 0 HB2 LEU A 444 -11.486 2.909 -0.013 1.00 12.34 H new ATOM 0 HB3 LEU A 444 -12.830 3.517 0.933 1.00 12.34 H new ATOM 0 HG LEU A 444 -11.300 3.479 2.933 1.00 33.25 H new ATOM 0 HD11 LEU A 444 -8.886 3.699 2.535 1.00 44.41 H new ATOM 0 HD12 LEU A 444 -9.505 2.079 2.138 1.00 44.41 H new ATOM 0 HD13 LEU A 444 -9.141 3.236 0.836 1.00 44.41 H new ATOM 0 HD21 LEU A 444 -10.191 5.653 2.239 1.00 72.35 H new ATOM 0 HD22 LEU A 444 -10.569 5.270 0.543 1.00 72.35 H new ATOM 0 HD23 LEU A 444 -11.886 5.572 1.702 1.00 72.35 H new ATOM 802 N SER A 445 -11.382 0.183 -0.667 1.00 13.23 N ATOM 803 CA SER A 445 -11.343 -1.112 -1.483 1.00 22.03 C ATOM 804 C SER A 445 -10.270 -2.140 -1.026 1.00 64.40 C ATOM 805 O SER A 445 -9.302 -1.794 -0.373 1.00 35.21 O ATOM 806 CB SER A 445 -11.227 -0.845 -3.041 1.00 2.13 C ATOM 807 OG SER A 445 -11.087 -2.044 -3.797 1.00 3.41 O ATOM 0 H SER A 445 -11.281 1.018 -1.243 1.00 13.23 H new ATOM 0 HA SER A 445 -12.309 -1.574 -1.279 1.00 22.03 H new ATOM 0 HB2 SER A 445 -12.113 -0.308 -3.380 1.00 2.13 H new ATOM 0 HB3 SER A 445 -10.370 -0.198 -3.232 1.00 2.13 H new ATOM 0 HG SER A 445 -11.021 -1.824 -4.750 1.00 3.41 H new ATOM 813 N LYS A 446 -10.474 -3.430 -1.355 1.00 1.34 N ATOM 814 CA LYS A 446 -9.587 -4.491 -0.865 1.00 52.21 C ATOM 815 C LYS A 446 -8.450 -4.781 -1.864 1.00 45.14 C ATOM 816 O LYS A 446 -8.601 -4.482 -3.057 1.00 33.43 O ATOM 817 CB LYS A 446 -10.420 -5.750 -0.573 1.00 63.31 C ATOM 818 CG LYS A 446 -10.945 -6.476 -1.825 1.00 44.04 C ATOM 819 CD LYS A 446 -12.223 -7.268 -1.567 1.00 64.55 C ATOM 820 CE LYS A 446 -13.446 -6.356 -1.528 1.00 5.22 C ATOM 821 NZ LYS A 446 -14.724 -7.114 -1.449 1.00 21.35 N ATOM 0 H LYS A 446 -11.236 -3.755 -1.950 1.00 1.34 H new ATOM 0 HA LYS A 446 -9.111 -4.160 0.058 1.00 52.21 H new ATOM 0 HB2 LYS A 446 -9.812 -6.445 0.006 1.00 63.31 H new ATOM 0 HB3 LYS A 446 -11.269 -5.471 0.052 1.00 63.31 H new ATOM 0 HG2 LYS A 446 -11.131 -5.744 -2.611 1.00 44.04 H new ATOM 0 HG3 LYS A 446 -10.174 -7.152 -2.195 1.00 44.04 H new ATOM 0 HD2 LYS A 446 -12.352 -8.018 -2.347 1.00 64.55 H new ATOM 0 HD3 LYS A 446 -12.136 -7.803 -0.621 1.00 64.55 H new ATOM 0 HE2 LYS A 446 -13.370 -5.689 -0.669 1.00 5.22 H new ATOM 0 HE3 LYS A 446 -13.455 -5.728 -2.419 1.00 5.22 H new ATOM 0 HZ1 LYS A 446 -15.522 -6.448 -1.425 1.00 21.35 H new ATOM 0 HZ2 LYS A 446 -14.813 -7.732 -2.281 1.00 21.35 H new ATOM 0 HZ3 LYS A 446 -14.731 -7.694 -0.585 1.00 21.35 H new ATOM 835 N CYS A 447 -7.342 -5.393 -1.349 1.00 10.22 N ATOM 836 CA CYS A 447 -6.088 -5.670 -2.111 1.00 61.24 C ATOM 837 C CYS A 447 -5.580 -4.425 -2.856 1.00 60.22 C ATOM 838 O CYS A 447 -5.724 -4.301 -4.083 1.00 32.30 O ATOM 839 CB CYS A 447 -6.276 -6.857 -3.068 1.00 74.31 C ATOM 840 SG CYS A 447 -6.772 -8.387 -2.242 1.00 31.25 S ATOM 0 H CYS A 447 -7.296 -5.711 -0.381 1.00 10.22 H new ATOM 0 HA CYS A 447 -5.321 -5.941 -1.386 1.00 61.24 H new ATOM 0 HB2 CYS A 447 -7.028 -6.596 -3.812 1.00 74.31 H new ATOM 0 HB3 CYS A 447 -5.343 -7.030 -3.605 1.00 74.31 H new ATOM 0 HG CYS A 447 -6.909 -9.332 -3.124 1.00 31.25 H new ATOM 846 N PHE A 448 -4.962 -3.519 -2.098 1.00 1.02 N ATOM 847 CA PHE A 448 -4.867 -2.116 -2.497 1.00 43.51 C ATOM 848 C PHE A 448 -3.704 -1.398 -1.729 1.00 52.10 C ATOM 849 O PHE A 448 -3.131 -2.000 -0.809 1.00 3.51 O ATOM 850 CB PHE A 448 -6.294 -1.526 -2.284 1.00 70.14 C ATOM 851 CG PHE A 448 -6.558 -0.668 -1.119 1.00 33.11 C ATOM 852 CD1 PHE A 448 -6.190 -1.016 0.150 1.00 60.41 C ATOM 853 CD2 PHE A 448 -7.270 0.477 -1.331 1.00 34.11 C ATOM 854 CE1 PHE A 448 -6.532 -0.228 1.193 1.00 44.31 C ATOM 855 CE2 PHE A 448 -7.607 1.275 -0.289 1.00 32.14 C ATOM 856 CZ PHE A 448 -7.242 0.913 0.983 1.00 62.30 C ATOM 0 H PHE A 448 -4.520 -3.732 -1.204 1.00 1.02 H new ATOM 0 HA PHE A 448 -4.590 -1.973 -3.541 1.00 43.51 H new ATOM 0 HB2 PHE A 448 -6.546 -0.952 -3.176 1.00 70.14 H new ATOM 0 HB3 PHE A 448 -6.990 -2.364 -2.237 1.00 70.14 H new ATOM 0 HD1 PHE A 448 -5.626 -1.921 0.319 1.00 60.41 H new ATOM 0 HD2 PHE A 448 -7.566 0.748 -2.334 1.00 34.11 H new ATOM 0 HE1 PHE A 448 -6.241 -0.505 2.196 1.00 44.31 H new ATOM 0 HE2 PHE A 448 -8.158 2.188 -0.458 1.00 32.14 H new ATOM 0 HZ PHE A 448 -7.519 1.536 1.820 1.00 62.30 H new ATOM 866 N GLY A 449 -3.350 -0.138 -2.098 1.00 70.33 N ATOM 867 CA GLY A 449 -2.339 0.617 -1.280 1.00 4.13 C ATOM 868 C GLY A 449 -2.228 2.131 -1.402 1.00 44.12 C ATOM 869 O GLY A 449 -2.841 2.771 -2.258 1.00 13.32 O ATOM 0 H GLY A 449 -3.720 0.361 -2.907 1.00 70.33 H new ATOM 0 HA2 GLY A 449 -2.538 0.391 -0.232 1.00 4.13 H new ATOM 0 HA3 GLY A 449 -1.359 0.202 -1.515 1.00 4.13 H new ATOM 873 N PHE A 450 -1.417 2.682 -0.443 1.00 2.45 N ATOM 874 CA PHE A 450 -1.334 4.159 -0.147 1.00 61.15 C ATOM 875 C PHE A 450 0.065 4.812 -0.540 1.00 71.25 C ATOM 876 O PHE A 450 1.066 4.427 0.072 1.00 42.20 O ATOM 877 CB PHE A 450 -1.602 4.293 1.409 1.00 31.13 C ATOM 878 CG PHE A 450 -3.013 4.132 1.865 1.00 5.12 C ATOM 879 CD1 PHE A 450 -3.659 2.940 1.722 1.00 53.34 C ATOM 880 CD2 PHE A 450 -3.673 5.182 2.472 1.00 55.41 C ATOM 881 CE1 PHE A 450 -4.926 2.777 2.150 1.00 4.41 C ATOM 882 CE2 PHE A 450 -4.966 5.033 2.910 1.00 53.54 C ATOM 883 CZ PHE A 450 -5.601 3.827 2.740 1.00 42.32 C ATOM 0 H PHE A 450 -0.803 2.120 0.146 1.00 2.45 H new ATOM 0 HA PHE A 450 -2.064 4.700 -0.749 1.00 61.15 H new ATOM 0 HB2 PHE A 450 -0.992 3.551 1.924 1.00 31.13 H new ATOM 0 HB3 PHE A 450 -1.251 5.273 1.731 1.00 31.13 H new ATOM 0 HD1 PHE A 450 -3.146 2.111 1.257 1.00 53.34 H new ATOM 0 HD2 PHE A 450 -3.168 6.128 2.603 1.00 55.41 H new ATOM 0 HE1 PHE A 450 -5.415 1.822 2.031 1.00 4.41 H new ATOM 0 HE2 PHE A 450 -5.479 5.857 3.384 1.00 53.54 H new ATOM 0 HZ PHE A 450 -6.623 3.701 3.066 1.00 42.32 H new ATOM 893 N VAL A 451 0.172 5.790 -1.554 1.00 3.30 N ATOM 894 CA VAL A 451 1.456 6.587 -1.745 1.00 40.13 C ATOM 895 C VAL A 451 1.175 8.153 -1.699 1.00 72.23 C ATOM 896 O VAL A 451 0.467 8.662 -2.575 1.00 32.25 O ATOM 897 CB VAL A 451 2.203 6.307 -3.125 1.00 43.13 C ATOM 898 CG1 VAL A 451 3.706 6.226 -2.917 1.00 62.45 C ATOM 899 CG2 VAL A 451 1.686 5.103 -3.896 1.00 3.13 C ATOM 0 H VAL A 451 -0.576 6.024 -2.207 1.00 3.30 H new ATOM 0 HA VAL A 451 2.092 6.258 -0.923 1.00 40.13 H new ATOM 0 HB VAL A 451 1.972 7.163 -3.759 1.00 43.13 H new ATOM 0 HG11 VAL A 451 4.196 6.034 -3.872 1.00 62.45 H new ATOM 0 HG12 VAL A 451 4.068 7.169 -2.506 1.00 62.45 H new ATOM 0 HG13 VAL A 451 3.934 5.417 -2.223 1.00 62.45 H new ATOM 0 HG21 VAL A 451 2.254 4.991 -4.820 1.00 3.13 H new ATOM 0 HG22 VAL A 451 1.801 4.205 -3.289 1.00 3.13 H new ATOM 0 HG23 VAL A 451 0.632 5.248 -4.133 1.00 3.13 H new ATOM 909 N SER A 452 1.705 8.924 -0.684 1.00 11.03 N ATOM 910 CA SER A 452 1.579 10.404 -0.626 1.00 13.35 C ATOM 911 C SER A 452 2.920 11.158 -1.140 1.00 42.24 C ATOM 912 O SER A 452 4.023 10.743 -0.762 1.00 41.30 O ATOM 913 CB SER A 452 1.280 10.700 0.874 1.00 34.14 C ATOM 914 OG SER A 452 2.458 10.754 1.663 1.00 32.51 O ATOM 0 H SER A 452 2.223 8.529 0.101 1.00 11.03 H new ATOM 0 HA SER A 452 0.796 10.775 -1.287 1.00 13.35 H new ATOM 0 HB2 SER A 452 0.749 11.648 0.955 1.00 34.14 H new ATOM 0 HB3 SER A 452 0.618 9.929 1.268 1.00 34.14 H new ATOM 0 HG SER A 452 2.313 10.266 2.500 1.00 32.51 H new ATOM 920 N TYR A 453 2.832 12.256 -1.998 1.00 53.12 N ATOM 921 CA TYR A 453 4.015 13.134 -2.368 1.00 14.41 C ATOM 922 C TYR A 453 3.853 14.576 -1.740 1.00 10.24 C ATOM 923 O TYR A 453 2.808 14.842 -1.139 1.00 3.14 O ATOM 924 CB TYR A 453 4.067 13.331 -3.912 1.00 2.32 C ATOM 925 CG TYR A 453 4.523 12.168 -4.812 1.00 11.34 C ATOM 926 CD1 TYR A 453 5.854 11.715 -4.898 1.00 33.23 C ATOM 927 CD2 TYR A 453 3.592 11.557 -5.646 1.00 75.13 C ATOM 928 CE1 TYR A 453 6.196 10.684 -5.761 1.00 62.13 C ATOM 929 CE2 TYR A 453 3.931 10.538 -6.493 1.00 42.35 C ATOM 930 CZ TYR A 453 5.225 10.106 -6.561 1.00 24.41 C ATOM 931 OH TYR A 453 5.542 9.099 -7.432 1.00 12.15 O ATOM 0 H TYR A 453 1.959 12.546 -2.439 1.00 53.12 H new ATOM 0 HA TYR A 453 4.915 12.645 -1.996 1.00 14.41 H new ATOM 0 HB2 TYR A 453 3.069 13.623 -4.237 1.00 2.32 H new ATOM 0 HB3 TYR A 453 4.727 14.175 -4.111 1.00 2.32 H new ATOM 0 HD1 TYR A 453 6.616 12.175 -4.286 1.00 33.23 H new ATOM 0 HD2 TYR A 453 2.568 11.899 -5.624 1.00 75.13 H new ATOM 0 HE1 TYR A 453 7.216 10.333 -5.809 1.00 62.13 H new ATOM 0 HE2 TYR A 453 3.175 10.074 -7.109 1.00 42.35 H new ATOM 0 HH TYR A 453 6.348 8.637 -7.119 1.00 12.15 H new ATOM 941 N ASP A 454 4.873 15.518 -1.877 1.00 35.35 N ATOM 942 CA ASP A 454 4.780 16.860 -1.223 1.00 25.41 C ATOM 943 C ASP A 454 4.081 18.003 -2.056 1.00 71.25 C ATOM 944 O ASP A 454 3.490 18.895 -1.432 1.00 73.35 O ATOM 945 CB ASP A 454 6.179 17.375 -0.769 1.00 34.23 C ATOM 946 CG ASP A 454 6.120 18.597 0.156 1.00 54.10 C ATOM 947 OD1 ASP A 454 5.762 18.433 1.341 1.00 70.31 O ATOM 948 OD2 ASP A 454 6.454 19.721 -0.301 1.00 72.12 O ATOM 0 H ASP A 454 5.726 15.365 -2.414 1.00 35.35 H new ATOM 0 HA ASP A 454 4.128 16.661 -0.373 1.00 25.41 H new ATOM 0 HB2 ASP A 454 6.704 16.569 -0.257 1.00 34.23 H new ATOM 0 HB3 ASP A 454 6.767 17.627 -1.652 1.00 34.23 H new ATOM 953 N ASN A 455 4.059 18.001 -3.428 1.00 41.25 N ATOM 954 CA ASN A 455 3.488 19.182 -4.142 1.00 53.43 C ATOM 955 C ASN A 455 2.747 18.854 -5.471 1.00 30.11 C ATOM 956 O ASN A 455 3.244 18.023 -6.227 1.00 55.24 O ATOM 957 CB ASN A 455 4.495 20.369 -4.299 1.00 54.45 C ATOM 958 CG ASN A 455 5.789 20.133 -5.094 1.00 2.54 C ATOM 959 OD1 ASN A 455 6.239 21.033 -5.800 1.00 12.21 O ATOM 960 ND2 ASN A 455 6.418 18.965 -4.981 1.00 35.14 N ATOM 0 H ASN A 455 4.405 17.248 -4.023 1.00 41.25 H new ATOM 0 HA ASN A 455 2.706 19.527 -3.465 1.00 53.43 H new ATOM 0 HB2 ASN A 455 3.963 21.195 -4.770 1.00 54.45 H new ATOM 0 HB3 ASN A 455 4.776 20.700 -3.299 1.00 54.45 H new ATOM 0 HD21 ASN A 455 7.290 18.804 -5.485 1.00 35.14 H new ATOM 0 HD22 ASN A 455 6.028 18.231 -4.390 1.00 35.14 H new ATOM 967 N PRO A 456 1.492 19.477 -5.763 1.00 60.11 N ATOM 968 CA PRO A 456 0.617 19.127 -6.932 1.00 13.01 C ATOM 969 C PRO A 456 1.236 19.091 -8.400 1.00 12.44 C ATOM 970 O PRO A 456 0.533 18.669 -9.327 1.00 54.32 O ATOM 971 CB PRO A 456 -0.545 20.142 -6.837 1.00 1.10 C ATOM 972 CG PRO A 456 -0.165 21.150 -5.831 1.00 63.42 C ATOM 973 CD PRO A 456 0.695 20.398 -4.894 1.00 10.31 C ATOM 0 HA PRO A 456 0.351 18.075 -6.833 1.00 13.01 H new ATOM 0 HB2 PRO A 456 -0.724 20.612 -7.804 1.00 1.10 H new ATOM 0 HB3 PRO A 456 -1.470 19.642 -6.550 1.00 1.10 H new ATOM 0 HG2 PRO A 456 0.369 21.986 -6.283 1.00 63.42 H new ATOM 0 HG3 PRO A 456 -1.039 21.564 -5.329 1.00 63.42 H new ATOM 0 HD2 PRO A 456 1.343 21.067 -4.328 1.00 10.31 H new ATOM 0 HD3 PRO A 456 0.100 19.842 -4.170 1.00 10.31 H new ATOM 981 N VAL A 457 2.520 19.513 -8.633 1.00 42.12 N ATOM 982 CA VAL A 457 3.190 19.334 -9.975 1.00 21.31 C ATOM 983 C VAL A 457 3.633 17.833 -10.185 1.00 61.43 C ATOM 984 O VAL A 457 3.492 17.321 -11.299 1.00 20.10 O ATOM 985 CB VAL A 457 4.419 20.354 -10.232 1.00 12.22 C ATOM 986 CG1 VAL A 457 5.149 20.125 -11.573 1.00 62.31 C ATOM 987 CG2 VAL A 457 4.012 21.842 -10.244 1.00 22.32 C ATOM 0 H VAL A 457 3.103 19.969 -7.931 1.00 42.12 H new ATOM 0 HA VAL A 457 2.440 19.587 -10.725 1.00 21.31 H new ATOM 0 HB VAL A 457 5.069 20.135 -9.385 1.00 12.22 H new ATOM 0 HG11 VAL A 457 5.960 20.846 -11.674 1.00 62.31 H new ATOM 0 HG12 VAL A 457 5.557 19.115 -11.597 1.00 62.31 H new ATOM 0 HG13 VAL A 457 4.446 20.252 -12.396 1.00 62.31 H new ATOM 0 HG21 VAL A 457 4.893 22.459 -10.422 1.00 22.32 H new ATOM 0 HG22 VAL A 457 3.283 22.013 -11.036 1.00 22.32 H new ATOM 0 HG23 VAL A 457 3.572 22.107 -9.282 1.00 22.32 H new ATOM 997 N SER A 458 4.107 17.100 -9.125 1.00 32.42 N ATOM 998 CA SER A 458 4.600 15.699 -9.310 1.00 62.21 C ATOM 999 C SER A 458 3.482 14.616 -9.521 1.00 2.25 C ATOM 1000 O SER A 458 3.759 13.569 -10.109 1.00 3.23 O ATOM 1001 CB SER A 458 5.608 15.283 -8.193 1.00 45.05 C ATOM 1002 OG SER A 458 5.296 15.877 -6.945 1.00 12.31 O ATOM 0 H SER A 458 4.156 17.445 -8.166 1.00 32.42 H new ATOM 0 HA SER A 458 5.133 15.726 -10.260 1.00 62.21 H new ATOM 0 HB2 SER A 458 5.605 14.198 -8.088 1.00 45.05 H new ATOM 0 HB3 SER A 458 6.616 15.572 -8.489 1.00 45.05 H new ATOM 0 HG SER A 458 5.950 15.590 -6.274 1.00 12.31 H new ATOM 1008 N ALA A 459 2.225 14.872 -9.070 1.00 21.23 N ATOM 1009 CA ALA A 459 1.069 13.934 -9.313 1.00 1.21 C ATOM 1010 C ALA A 459 0.701 13.762 -10.818 1.00 14.04 C ATOM 1011 O ALA A 459 0.351 12.650 -11.233 1.00 10.40 O ATOM 1012 CB ALA A 459 -0.199 14.275 -8.525 1.00 74.02 C ATOM 0 H ALA A 459 1.976 15.708 -8.541 1.00 21.23 H new ATOM 0 HA ALA A 459 1.454 12.985 -8.939 1.00 1.21 H new ATOM 0 HB1 ALA A 459 -0.979 13.551 -8.759 1.00 74.02 H new ATOM 0 HB2 ALA A 459 0.017 14.243 -7.457 1.00 74.02 H new ATOM 0 HB3 ALA A 459 -0.539 15.274 -8.797 1.00 74.02 H new ATOM 1018 N GLN A 460 0.796 14.852 -11.637 1.00 11.13 N ATOM 1019 CA GLN A 460 0.338 14.827 -13.045 1.00 21.14 C ATOM 1020 C GLN A 460 1.256 13.954 -13.930 1.00 3.22 C ATOM 1021 O GLN A 460 0.764 13.253 -14.826 1.00 43.21 O ATOM 1022 CB GLN A 460 0.146 16.251 -13.650 1.00 73.02 C ATOM 1023 CG GLN A 460 -0.915 17.129 -12.927 1.00 64.23 C ATOM 1024 CD GLN A 460 -2.122 16.371 -12.384 1.00 74.42 C ATOM 1025 OE1 GLN A 460 -3.079 16.099 -13.104 1.00 65.11 O ATOM 1026 NE2 GLN A 460 -2.115 16.122 -11.078 1.00 42.15 N ATOM 0 H GLN A 460 1.184 15.748 -11.341 1.00 11.13 H new ATOM 0 HA GLN A 460 -0.649 14.365 -13.032 1.00 21.14 H new ATOM 0 HB2 GLN A 460 1.103 16.772 -13.629 1.00 73.02 H new ATOM 0 HB3 GLN A 460 -0.139 16.150 -14.697 1.00 73.02 H new ATOM 0 HG2 GLN A 460 -0.431 17.650 -12.101 1.00 64.23 H new ATOM 0 HG3 GLN A 460 -1.267 17.892 -13.622 1.00 64.23 H new ATOM 0 HE21 GLN A 460 -1.298 16.364 -10.517 1.00 42.15 H new ATOM 0 HE22 GLN A 460 -2.926 15.689 -10.637 1.00 42.15 H new ATOM 1035 N ALA A 461 2.580 13.962 -13.660 1.00 3.13 N ATOM 1036 CA ALA A 461 3.512 13.081 -14.393 1.00 30.40 C ATOM 1037 C ALA A 461 3.365 11.575 -14.022 1.00 23.11 C ATOM 1038 O ALA A 461 3.537 10.726 -14.905 1.00 2.10 O ATOM 1039 CB ALA A 461 4.974 13.555 -14.294 1.00 2.42 C ATOM 0 H ALA A 461 3.019 14.555 -12.956 1.00 3.13 H new ATOM 0 HA ALA A 461 3.218 13.163 -15.440 1.00 30.40 H new ATOM 0 HB1 ALA A 461 5.616 12.872 -14.850 1.00 2.42 H new ATOM 0 HB2 ALA A 461 5.061 14.557 -14.713 1.00 2.42 H new ATOM 0 HB3 ALA A 461 5.281 13.571 -13.248 1.00 2.42 H new ATOM 1045 N ALA A 462 3.046 11.214 -12.745 1.00 62.22 N ATOM 1046 CA ALA A 462 2.787 9.803 -12.405 1.00 14.12 C ATOM 1047 C ALA A 462 1.475 9.228 -13.006 1.00 1.44 C ATOM 1048 O ALA A 462 1.501 8.088 -13.438 1.00 73.10 O ATOM 1049 CB ALA A 462 2.870 9.515 -10.893 1.00 45.40 C ATOM 0 H ALA A 462 2.966 11.865 -11.964 1.00 62.22 H new ATOM 0 HA ALA A 462 3.606 9.270 -12.889 1.00 14.12 H new ATOM 0 HB1 ALA A 462 2.669 8.459 -10.712 1.00 45.40 H new ATOM 0 HB2 ALA A 462 3.868 9.762 -10.530 1.00 45.40 H new ATOM 0 HB3 ALA A 462 2.132 10.120 -10.366 1.00 45.40 H new ATOM 1055 N ILE A 463 0.345 9.999 -13.071 1.00 74.42 N ATOM 1056 CA ILE A 463 -0.926 9.504 -13.637 1.00 24.03 C ATOM 1057 C ILE A 463 -0.750 9.029 -15.121 1.00 25.23 C ATOM 1058 O ILE A 463 -1.322 8.012 -15.459 1.00 33.24 O ATOM 1059 CB ILE A 463 -2.127 10.562 -13.426 1.00 2.13 C ATOM 1060 CG1 ILE A 463 -2.432 10.716 -11.862 1.00 3.35 C ATOM 1061 CG2 ILE A 463 -3.429 10.243 -14.239 1.00 21.44 C ATOM 1062 CD1 ILE A 463 -3.592 11.619 -11.450 1.00 44.01 C ATOM 0 H ILE A 463 0.302 10.961 -12.736 1.00 74.42 H new ATOM 0 HA ILE A 463 -1.222 8.616 -13.079 1.00 24.03 H new ATOM 0 HB ILE A 463 -1.782 11.512 -13.834 1.00 2.13 H new ATOM 0 HG12 ILE A 463 -2.621 9.722 -11.458 1.00 3.35 H new ATOM 0 HG13 ILE A 463 -1.529 11.089 -11.379 1.00 3.35 H new ATOM 0 HG21 ILE A 463 -4.181 11.006 -14.036 1.00 21.44 H new ATOM 0 HG22 ILE A 463 -3.200 10.235 -15.305 1.00 21.44 H new ATOM 0 HG23 ILE A 463 -3.813 9.267 -13.943 1.00 21.44 H new ATOM 0 HD11 ILE A 463 -3.679 11.626 -10.364 1.00 44.01 H new ATOM 0 HD12 ILE A 463 -3.408 12.633 -11.806 1.00 44.01 H new ATOM 0 HD13 ILE A 463 -4.518 11.244 -11.886 1.00 44.01 H new ATOM 1074 N GLN A 464 0.098 9.678 -15.993 1.00 2.42 N ATOM 1075 CA GLN A 464 0.318 9.119 -17.380 1.00 71.45 C ATOM 1076 C GLN A 464 1.193 7.813 -17.446 1.00 43.34 C ATOM 1077 O GLN A 464 0.820 6.885 -18.172 1.00 63.13 O ATOM 1078 CB GLN A 464 0.847 10.192 -18.386 1.00 24.11 C ATOM 1079 CG GLN A 464 0.228 10.090 -19.784 1.00 22.43 C ATOM 1080 CD GLN A 464 -0.426 11.400 -20.258 1.00 73.21 C ATOM 1081 OE1 GLN A 464 -0.467 11.660 -21.455 1.00 42.30 O ATOM 1082 NE2 GLN A 464 -0.955 12.230 -19.340 1.00 71.30 N ATOM 0 H GLN A 464 0.611 10.534 -15.781 1.00 2.42 H new ATOM 0 HA GLN A 464 -0.682 8.817 -17.690 1.00 71.45 H new ATOM 0 HB2 GLN A 464 0.647 11.184 -17.982 1.00 24.11 H new ATOM 0 HB3 GLN A 464 1.929 10.094 -18.470 1.00 24.11 H new ATOM 0 HG2 GLN A 464 1.001 9.800 -20.496 1.00 22.43 H new ATOM 0 HG3 GLN A 464 -0.520 9.297 -19.785 1.00 22.43 H new ATOM 0 HE21 GLN A 464 -0.908 11.991 -18.349 1.00 71.30 H new ATOM 0 HE22 GLN A 464 -1.403 13.098 -19.635 1.00 71.30 H new ATOM 1091 N ALA A 465 2.340 7.708 -16.736 1.00 12.35 N ATOM 1092 CA ALA A 465 3.154 6.432 -16.763 1.00 1.54 C ATOM 1093 C ALA A 465 2.605 5.284 -15.812 1.00 5.32 C ATOM 1094 O ALA A 465 3.133 4.170 -15.809 1.00 30.21 O ATOM 1095 CB ALA A 465 4.661 6.724 -16.517 1.00 11.23 C ATOM 0 H ALA A 465 2.727 8.450 -16.153 1.00 12.35 H new ATOM 0 HA ALA A 465 3.042 6.031 -17.770 1.00 1.54 H new ATOM 0 HB1 ALA A 465 5.221 5.789 -16.542 1.00 11.23 H new ATOM 0 HB2 ALA A 465 5.034 7.391 -17.294 1.00 11.23 H new ATOM 0 HB3 ALA A 465 4.786 7.196 -15.543 1.00 11.23 H new ATOM 1101 N MET A 466 1.522 5.565 -15.048 1.00 33.12 N ATOM 1102 CA MET A 466 0.898 4.640 -14.030 1.00 32.22 C ATOM 1103 C MET A 466 -0.576 4.282 -14.333 1.00 5.11 C ATOM 1104 O MET A 466 -1.106 3.368 -13.697 1.00 30.10 O ATOM 1105 CB MET A 466 1.008 5.160 -12.560 1.00 74.33 C ATOM 1106 CG MET A 466 2.339 4.866 -11.837 1.00 14.52 C ATOM 1107 SD MET A 466 3.827 5.556 -12.595 1.00 53.31 S ATOM 1108 CE MET A 466 5.110 4.761 -11.613 1.00 53.30 C ATOM 0 H MET A 466 1.035 6.459 -15.113 1.00 33.12 H new ATOM 0 HA MET A 466 1.495 3.732 -14.120 1.00 32.22 H new ATOM 0 HB2 MET A 466 0.850 6.239 -12.564 1.00 74.33 H new ATOM 0 HB3 MET A 466 0.197 4.721 -11.979 1.00 74.33 H new ATOM 0 HG2 MET A 466 2.266 5.245 -10.818 1.00 14.52 H new ATOM 0 HG3 MET A 466 2.460 3.785 -11.767 1.00 14.52 H new ATOM 0 HE1 MET A 466 6.090 5.087 -11.962 1.00 53.30 H new ATOM 0 HE2 MET A 466 4.988 5.035 -10.565 1.00 53.30 H new ATOM 0 HE3 MET A 466 5.030 3.679 -11.717 1.00 53.30 H new ATOM 1118 N ASN A 467 -1.276 4.968 -15.260 1.00 41.42 N ATOM 1119 CA ASN A 467 -2.517 4.398 -15.771 1.00 41.20 C ATOM 1120 C ASN A 467 -2.106 3.340 -16.872 1.00 54.44 C ATOM 1121 O ASN A 467 -1.193 3.630 -17.656 1.00 21.04 O ATOM 1122 CB ASN A 467 -3.565 5.465 -16.290 1.00 52.41 C ATOM 1123 CG ASN A 467 -3.120 6.534 -17.304 1.00 44.01 C ATOM 1124 OD1 ASN A 467 -3.662 7.639 -17.274 1.00 52.13 O ATOM 1125 ND2 ASN A 467 -2.223 6.245 -18.230 1.00 52.34 N ATOM 0 H ASN A 467 -1.012 5.873 -15.648 1.00 41.42 H new ATOM 0 HA ASN A 467 -3.060 3.919 -14.956 1.00 41.20 H new ATOM 0 HB2 ASN A 467 -4.395 4.917 -16.736 1.00 52.41 H new ATOM 0 HB3 ASN A 467 -3.959 5.986 -15.418 1.00 52.41 H new ATOM 0 HD21 ASN A 467 -1.972 6.941 -18.932 1.00 52.34 H new ATOM 0 HD22 ASN A 467 -1.782 5.326 -18.243 1.00 52.34 H new ATOM 1132 N GLY A 468 -2.699 2.122 -16.939 1.00 61.53 N ATOM 1133 CA GLY A 468 -2.301 1.165 -18.016 1.00 31.44 C ATOM 1134 C GLY A 468 -1.123 0.174 -17.781 1.00 2.24 C ATOM 1135 O GLY A 468 -0.671 -0.414 -18.771 1.00 1.34 O ATOM 0 H GLY A 468 -3.418 1.785 -16.299 1.00 61.53 H new ATOM 0 HA2 GLY A 468 -3.181 0.570 -18.262 1.00 31.44 H new ATOM 0 HA3 GLY A 468 -2.057 1.755 -18.900 1.00 31.44 H new ATOM 1139 N PHE A 469 -0.608 -0.065 -16.550 1.00 35.21 N ATOM 1140 CA PHE A 469 0.668 -0.833 -16.425 1.00 43.22 C ATOM 1141 C PHE A 469 0.406 -2.397 -16.435 1.00 62.34 C ATOM 1142 O PHE A 469 -0.254 -2.916 -15.525 1.00 13.51 O ATOM 1143 CB PHE A 469 1.456 -0.390 -15.142 1.00 22.23 C ATOM 1144 CG PHE A 469 3.001 -0.308 -15.296 1.00 35.02 C ATOM 1145 CD1 PHE A 469 3.752 -1.459 -15.529 1.00 2.43 C ATOM 1146 CD2 PHE A 469 3.711 0.902 -15.193 1.00 22.11 C ATOM 1147 CE1 PHE A 469 5.143 -1.416 -15.626 1.00 75.11 C ATOM 1148 CE2 PHE A 469 5.106 0.932 -15.300 1.00 71.20 C ATOM 1149 CZ PHE A 469 5.803 -0.223 -15.525 1.00 15.33 C ATOM 0 H PHE A 469 -1.024 0.241 -15.670 1.00 35.21 H new ATOM 0 HA PHE A 469 1.285 -0.606 -17.294 1.00 43.22 H new ATOM 0 HB2 PHE A 469 1.088 0.588 -14.831 1.00 22.23 H new ATOM 0 HB3 PHE A 469 1.226 -1.088 -14.337 1.00 22.23 H new ATOM 0 HD1 PHE A 469 3.245 -2.406 -15.637 1.00 2.43 H new ATOM 0 HD2 PHE A 469 3.171 1.823 -15.029 1.00 22.11 H new ATOM 0 HE1 PHE A 469 5.700 -2.328 -15.781 1.00 75.11 H new ATOM 0 HE2 PHE A 469 5.634 1.870 -15.205 1.00 71.20 H new ATOM 0 HZ PHE A 469 6.878 -0.193 -15.623 1.00 15.33 H new ATOM 1159 N GLN A 470 0.897 -3.140 -17.480 1.00 42.42 N ATOM 1160 CA GLN A 470 0.631 -4.602 -17.637 1.00 74.41 C ATOM 1161 C GLN A 470 1.868 -5.485 -17.180 1.00 33.41 C ATOM 1162 O GLN A 470 2.972 -5.288 -17.691 1.00 64.34 O ATOM 1163 CB GLN A 470 0.287 -4.751 -19.139 1.00 75.43 C ATOM 1164 CG GLN A 470 -0.064 -6.142 -19.717 1.00 30.32 C ATOM 1165 CD GLN A 470 -0.389 -6.101 -21.208 1.00 65.32 C ATOM 1166 OE1 GLN A 470 -0.289 -7.114 -21.898 1.00 73.13 O ATOM 1167 NE2 GLN A 470 -0.728 -4.923 -21.717 1.00 21.01 N ATOM 0 H GLN A 470 1.477 -2.747 -18.221 1.00 42.42 H new ATOM 0 HA GLN A 470 -0.179 -4.961 -17.001 1.00 74.41 H new ATOM 0 HB2 GLN A 470 -0.556 -4.092 -19.346 1.00 75.43 H new ATOM 0 HB3 GLN A 470 1.136 -4.369 -19.706 1.00 75.43 H new ATOM 0 HG2 GLN A 470 0.773 -6.820 -19.551 1.00 30.32 H new ATOM 0 HG3 GLN A 470 -0.917 -6.550 -19.175 1.00 30.32 H new ATOM 0 HE21 GLN A 470 -0.800 -4.107 -21.110 1.00 21.01 H new ATOM 0 HE22 GLN A 470 -0.917 -4.834 -22.715 1.00 21.01 H new ATOM 1176 N ILE A 471 1.678 -6.450 -16.193 1.00 1.22 N ATOM 1177 CA ILE A 471 2.795 -7.292 -15.571 1.00 34.31 C ATOM 1178 C ILE A 471 2.183 -8.708 -15.245 1.00 2.25 C ATOM 1179 O ILE A 471 1.622 -8.856 -14.152 1.00 33.32 O ATOM 1180 CB ILE A 471 3.369 -6.686 -14.184 1.00 74.33 C ATOM 1181 CG1 ILE A 471 3.222 -5.144 -14.169 1.00 45.31 C ATOM 1182 CG2 ILE A 471 4.855 -7.047 -13.920 1.00 53.12 C ATOM 1183 CD1 ILE A 471 3.774 -4.380 -12.952 1.00 54.45 C ATOM 0 H ILE A 471 0.758 -6.665 -15.810 1.00 1.22 H new ATOM 0 HA ILE A 471 3.621 -7.320 -16.282 1.00 34.31 H new ATOM 0 HB ILE A 471 2.774 -7.141 -13.392 1.00 74.33 H new ATOM 0 HG12 ILE A 471 3.712 -4.753 -15.060 1.00 45.31 H new ATOM 0 HG13 ILE A 471 2.162 -4.908 -14.259 1.00 45.31 H new ATOM 0 HG21 ILE A 471 5.173 -6.609 -12.974 1.00 53.12 H new ATOM 0 HG22 ILE A 471 4.963 -8.131 -13.872 1.00 53.12 H new ATOM 0 HG23 ILE A 471 5.474 -6.656 -14.728 1.00 53.12 H new ATOM 0 HD11 ILE A 471 3.599 -3.312 -13.083 1.00 54.45 H new ATOM 0 HD12 ILE A 471 3.270 -4.722 -12.048 1.00 54.45 H new ATOM 0 HD13 ILE A 471 4.845 -4.564 -12.862 1.00 54.45 H new ATOM 1195 N GLY A 472 2.252 -9.749 -16.157 1.00 71.40 N ATOM 1196 CA GLY A 472 1.508 -11.017 -15.936 1.00 42.12 C ATOM 1197 C GLY A 472 -0.056 -10.824 -15.883 1.00 25.33 C ATOM 1198 O GLY A 472 -0.606 -10.117 -16.736 1.00 22.14 O ATOM 0 H GLY A 472 2.800 -9.722 -17.017 1.00 71.40 H new ATOM 0 HA2 GLY A 472 1.753 -11.717 -16.734 1.00 42.12 H new ATOM 0 HA3 GLY A 472 1.843 -11.468 -15.002 1.00 42.12 H new ATOM 1202 N MET A 473 -0.766 -11.415 -14.881 1.00 1.12 N ATOM 1203 CA MET A 473 -2.297 -11.435 -14.848 1.00 53.31 C ATOM 1204 C MET A 473 -2.994 -10.320 -13.985 1.00 72.15 C ATOM 1205 O MET A 473 -4.120 -10.506 -13.534 1.00 34.40 O ATOM 1206 CB MET A 473 -2.817 -12.898 -14.542 1.00 3.10 C ATOM 1207 CG MET A 473 -2.575 -13.549 -13.154 1.00 71.21 C ATOM 1208 SD MET A 473 -3.800 -13.126 -11.892 1.00 60.12 S ATOM 1209 CE MET A 473 -3.195 -14.072 -10.501 1.00 32.34 C ATOM 0 H MET A 473 -0.330 -11.883 -14.086 1.00 1.12 H new ATOM 0 HA MET A 473 -2.615 -11.153 -15.852 1.00 53.31 H new ATOM 0 HB2 MET A 473 -3.893 -12.899 -14.714 1.00 3.10 H new ATOM 0 HB3 MET A 473 -2.375 -13.558 -15.288 1.00 3.10 H new ATOM 0 HG2 MET A 473 -2.558 -14.632 -13.275 1.00 71.21 H new ATOM 0 HG3 MET A 473 -1.589 -13.253 -12.797 1.00 71.21 H new ATOM 0 HE1 MET A 473 -3.848 -13.915 -9.642 1.00 32.34 H new ATOM 0 HE2 MET A 473 -3.183 -15.131 -10.759 1.00 32.34 H new ATOM 0 HE3 MET A 473 -2.184 -13.748 -10.253 1.00 32.34 H new ATOM 1219 N LYS A 474 -2.387 -9.117 -13.859 1.00 1.25 N ATOM 1220 CA LYS A 474 -3.040 -7.974 -13.200 1.00 44.03 C ATOM 1221 C LYS A 474 -2.719 -6.697 -14.016 1.00 72.12 C ATOM 1222 O LYS A 474 -1.603 -6.579 -14.532 1.00 63.43 O ATOM 1223 CB LYS A 474 -2.570 -7.702 -11.733 1.00 15.23 C ATOM 1224 CG LYS A 474 -3.105 -8.620 -10.580 1.00 35.12 C ATOM 1225 CD LYS A 474 -4.402 -8.077 -9.956 1.00 53.44 C ATOM 1226 CE LYS A 474 -4.941 -8.918 -8.775 1.00 33.32 C ATOM 1227 NZ LYS A 474 -3.942 -9.045 -7.676 1.00 45.13 N ATOM 0 H LYS A 474 -1.449 -8.918 -14.206 1.00 1.25 H new ATOM 0 HA LYS A 474 -4.101 -8.221 -13.159 1.00 44.03 H new ATOM 0 HB2 LYS A 474 -1.482 -7.759 -11.720 1.00 15.23 H new ATOM 0 HB3 LYS A 474 -2.838 -6.675 -11.487 1.00 15.23 H new ATOM 0 HG2 LYS A 474 -3.284 -9.622 -10.970 1.00 35.12 H new ATOM 0 HG3 LYS A 474 -2.342 -8.710 -9.807 1.00 35.12 H new ATOM 0 HD2 LYS A 474 -4.226 -7.058 -9.611 1.00 53.44 H new ATOM 0 HD3 LYS A 474 -5.169 -8.024 -10.729 1.00 53.44 H new ATOM 0 HE2 LYS A 474 -5.850 -8.457 -8.387 1.00 33.32 H new ATOM 0 HE3 LYS A 474 -5.215 -9.911 -9.132 1.00 33.32 H new ATOM 0 HZ1 LYS A 474 -4.437 -9.171 -6.770 1.00 45.13 H new ATOM 0 HZ2 LYS A 474 -3.332 -9.868 -7.855 1.00 45.13 H new ATOM 0 HZ3 LYS A 474 -3.359 -8.185 -7.636 1.00 45.13 H new ATOM 1241 N ARG A 475 -3.667 -5.759 -14.166 1.00 31.35 N ATOM 1242 CA ARG A 475 -3.316 -4.387 -14.604 1.00 2.33 C ATOM 1243 C ARG A 475 -3.325 -3.375 -13.390 1.00 64.43 C ATOM 1244 O ARG A 475 -4.217 -3.475 -12.546 1.00 65.11 O ATOM 1245 CB ARG A 475 -4.301 -3.860 -15.713 1.00 65.33 C ATOM 1246 CG ARG A 475 -3.862 -2.599 -16.455 1.00 45.21 C ATOM 1247 CD ARG A 475 -3.580 -2.893 -17.940 1.00 54.10 C ATOM 1248 NE ARG A 475 -3.105 -4.275 -18.157 1.00 62.53 N ATOM 1249 CZ ARG A 475 -3.804 -5.240 -18.792 1.00 44.15 C ATOM 1250 NH1 ARG A 475 -5.017 -5.018 -19.290 1.00 45.11 N ATOM 1251 NH2 ARG A 475 -3.344 -6.475 -18.810 1.00 25.45 N ATOM 0 H ARG A 475 -4.661 -5.913 -13.997 1.00 31.35 H new ATOM 0 HA ARG A 475 -2.310 -4.444 -15.020 1.00 2.33 H new ATOM 0 HB2 ARG A 475 -4.451 -4.654 -16.444 1.00 65.33 H new ATOM 0 HB3 ARG A 475 -5.268 -3.666 -15.249 1.00 65.33 H new ATOM 0 HG2 ARG A 475 -4.638 -1.838 -16.374 1.00 45.21 H new ATOM 0 HG3 ARG A 475 -2.966 -2.192 -15.986 1.00 45.21 H new ATOM 0 HD2 ARG A 475 -4.488 -2.728 -18.520 1.00 54.10 H new ATOM 0 HD3 ARG A 475 -2.833 -2.192 -18.312 1.00 54.10 H new ATOM 0 HE ARG A 475 -2.181 -4.518 -17.801 1.00 62.53 H new ATOM 0 HH11 ARG A 475 -5.446 -4.097 -19.198 1.00 45.11 H new ATOM 0 HH12 ARG A 475 -5.519 -5.769 -19.764 1.00 45.11 H new ATOM 0 HH21 ARG A 475 -2.464 -6.698 -18.346 1.00 25.45 H new ATOM 0 HH22 ARG A 475 -3.868 -7.208 -19.288 1.00 25.45 H new ATOM 1265 N LEU A 476 -2.330 -2.423 -13.293 1.00 13.01 N ATOM 1266 CA LEU A 476 -2.381 -1.274 -12.312 1.00 75.34 C ATOM 1267 C LEU A 476 -3.518 -0.240 -12.713 1.00 31.42 C ATOM 1268 O LEU A 476 -3.477 0.277 -13.841 1.00 21.11 O ATOM 1269 CB LEU A 476 -1.017 -0.479 -12.328 1.00 74.11 C ATOM 1270 CG LEU A 476 -0.562 0.371 -11.098 1.00 70.32 C ATOM 1271 CD1 LEU A 476 0.169 -0.449 -10.019 1.00 40.43 C ATOM 1272 CD2 LEU A 476 0.381 1.487 -11.536 1.00 1.21 C ATOM 0 H LEU A 476 -1.493 -2.429 -13.875 1.00 13.01 H new ATOM 0 HA LEU A 476 -2.577 -1.700 -11.328 1.00 75.34 H new ATOM 0 HB2 LEU A 476 -0.228 -1.205 -12.523 1.00 74.11 H new ATOM 0 HB3 LEU A 476 -1.050 0.194 -13.185 1.00 74.11 H new ATOM 0 HG LEU A 476 -1.483 0.767 -10.669 1.00 70.32 H new ATOM 0 HD11 LEU A 476 0.455 0.206 -9.196 1.00 40.43 H new ATOM 0 HD12 LEU A 476 -0.492 -1.232 -9.647 1.00 40.43 H new ATOM 0 HD13 LEU A 476 1.062 -0.902 -10.449 1.00 40.43 H new ATOM 0 HD21 LEU A 476 0.687 2.068 -10.666 1.00 1.21 H new ATOM 0 HD22 LEU A 476 1.261 1.054 -12.011 1.00 1.21 H new ATOM 0 HD23 LEU A 476 -0.130 2.138 -12.245 1.00 1.21 H new ATOM 1284 N LYS A 477 -4.525 0.075 -11.829 1.00 62.45 N ATOM 1285 CA LYS A 477 -5.519 1.195 -12.134 1.00 32.31 C ATOM 1286 C LYS A 477 -5.483 2.293 -10.983 1.00 65.32 C ATOM 1287 O LYS A 477 -5.875 1.988 -9.857 1.00 41.15 O ATOM 1288 CB LYS A 477 -6.960 0.606 -12.447 1.00 62.30 C ATOM 1289 CG LYS A 477 -8.240 1.577 -12.647 1.00 21.22 C ATOM 1290 CD LYS A 477 -7.984 2.955 -13.301 1.00 54.21 C ATOM 1291 CE LYS A 477 -9.258 3.862 -13.267 1.00 35.24 C ATOM 1292 NZ LYS A 477 -8.898 5.305 -13.208 1.00 64.53 N ATOM 0 H LYS A 477 -4.676 -0.398 -10.938 1.00 62.45 H new ATOM 0 HA LYS A 477 -5.225 1.715 -13.046 1.00 32.31 H new ATOM 0 HB2 LYS A 477 -6.869 0.009 -13.354 1.00 62.30 H new ATOM 0 HB3 LYS A 477 -7.205 -0.081 -11.637 1.00 62.30 H new ATOM 0 HG2 LYS A 477 -8.975 1.047 -13.252 1.00 21.22 H new ATOM 0 HG3 LYS A 477 -8.693 1.745 -11.670 1.00 21.22 H new ATOM 0 HD2 LYS A 477 -7.167 3.457 -12.783 1.00 54.21 H new ATOM 0 HD3 LYS A 477 -7.667 2.813 -14.334 1.00 54.21 H new ATOM 0 HE2 LYS A 477 -9.864 3.673 -14.153 1.00 35.24 H new ATOM 0 HE3 LYS A 477 -9.868 3.602 -12.402 1.00 35.24 H new ATOM 0 HZ1 LYS A 477 -9.733 5.860 -12.933 1.00 64.53 H new ATOM 0 HZ2 LYS A 477 -8.143 5.446 -12.507 1.00 64.53 H new ATOM 0 HZ3 LYS A 477 -8.566 5.618 -14.142 1.00 64.53 H new ATOM 1306 N VAL A 478 -5.009 3.578 -11.263 1.00 53.21 N ATOM 1307 CA VAL A 478 -4.718 4.593 -10.216 1.00 21.01 C ATOM 1308 C VAL A 478 -5.955 5.550 -10.010 1.00 51.44 C ATOM 1309 O VAL A 478 -6.554 5.972 -11.011 1.00 65.44 O ATOM 1310 CB VAL A 478 -3.361 5.407 -10.593 1.00 33.22 C ATOM 1311 CG1 VAL A 478 -3.370 6.934 -10.421 1.00 51.43 C ATOM 1312 CG2 VAL A 478 -2.149 4.904 -9.816 1.00 71.32 C ATOM 0 H VAL A 478 -4.829 3.909 -12.211 1.00 53.21 H new ATOM 0 HA VAL A 478 -4.546 4.091 -9.264 1.00 21.01 H new ATOM 0 HB VAL A 478 -3.304 5.202 -11.662 1.00 33.22 H new ATOM 0 HG11 VAL A 478 -2.400 7.338 -10.710 1.00 51.43 H new ATOM 0 HG12 VAL A 478 -4.146 7.367 -11.052 1.00 51.43 H new ATOM 0 HG13 VAL A 478 -3.570 7.182 -9.379 1.00 51.43 H new ATOM 0 HG21 VAL A 478 -1.269 5.479 -10.103 1.00 71.32 H new ATOM 0 HG22 VAL A 478 -2.327 5.022 -8.747 1.00 71.32 H new ATOM 0 HG23 VAL A 478 -1.984 3.850 -10.042 1.00 71.32 H new ATOM 1322 N GLN A 479 -6.385 5.862 -8.740 1.00 41.02 N ATOM 1323 CA GLN A 479 -7.441 6.860 -8.505 1.00 51.03 C ATOM 1324 C GLN A 479 -6.898 7.990 -7.563 1.00 35.43 C ATOM 1325 O GLN A 479 -6.445 7.679 -6.457 1.00 73.51 O ATOM 1326 CB GLN A 479 -8.763 6.192 -7.914 1.00 33.32 C ATOM 1327 CG GLN A 479 -8.551 5.060 -6.888 1.00 24.34 C ATOM 1328 CD GLN A 479 -9.164 5.371 -5.529 1.00 42.25 C ATOM 1329 OE1 GLN A 479 -8.537 6.012 -4.689 1.00 54.51 O ATOM 1330 NE2 GLN A 479 -10.376 4.879 -5.283 1.00 22.24 N ATOM 0 H GLN A 479 -6.012 5.435 -7.892 1.00 41.02 H new ATOM 0 HA GLN A 479 -7.718 7.304 -9.461 1.00 51.03 H new ATOM 0 HB2 GLN A 479 -9.362 6.973 -7.445 1.00 33.32 H new ATOM 0 HB3 GLN A 479 -9.349 5.797 -8.744 1.00 33.32 H new ATOM 0 HG2 GLN A 479 -8.986 4.139 -7.275 1.00 24.34 H new ATOM 0 HG3 GLN A 479 -7.483 4.881 -6.767 1.00 24.34 H new ATOM 0 HE21 GLN A 479 -10.868 4.351 -6.004 1.00 22.24 H new ATOM 0 HE22 GLN A 479 -10.813 5.030 -4.374 1.00 22.24 H new ATOM 1339 N LEU A 480 -6.898 9.298 -7.986 1.00 50.23 N ATOM 1340 CA LEU A 480 -6.485 10.375 -7.051 1.00 0.53 C ATOM 1341 C LEU A 480 -7.766 11.050 -6.484 1.00 63.04 C ATOM 1342 O LEU A 480 -8.736 11.191 -7.241 1.00 72.42 O ATOM 1343 CB LEU A 480 -5.508 11.428 -7.703 1.00 52.00 C ATOM 1344 CG LEU A 480 -6.063 12.738 -8.360 1.00 43.01 C ATOM 1345 CD1 LEU A 480 -4.927 13.736 -8.525 1.00 13.44 C ATOM 1346 CD2 LEU A 480 -6.707 12.487 -9.717 1.00 24.54 C ATOM 0 H LEU A 480 -7.166 9.610 -8.919 1.00 50.23 H new ATOM 0 HA LEU A 480 -5.909 9.926 -6.242 1.00 0.53 H new ATOM 0 HB2 LEU A 480 -4.802 11.732 -6.930 1.00 52.00 H new ATOM 0 HB3 LEU A 480 -4.936 10.903 -8.468 1.00 52.00 H new ATOM 0 HG LEU A 480 -6.836 13.131 -7.699 1.00 43.01 H new ATOM 0 HD11 LEU A 480 -5.308 14.649 -8.982 1.00 13.44 H new ATOM 0 HD12 LEU A 480 -4.502 13.969 -7.548 1.00 13.44 H new ATOM 0 HD13 LEU A 480 -4.155 13.306 -9.163 1.00 13.44 H new ATOM 0 HD21 LEU A 480 -7.074 13.429 -10.125 1.00 24.54 H new ATOM 0 HD22 LEU A 480 -5.969 12.060 -10.396 1.00 24.54 H new ATOM 0 HD23 LEU A 480 -7.539 11.793 -9.602 1.00 24.54 H new ATOM 1358 N LYS A 481 -7.839 11.465 -5.188 1.00 61.11 N ATOM 1359 CA LYS A 481 -9.120 12.050 -4.718 1.00 62.03 C ATOM 1360 C LYS A 481 -8.935 13.547 -4.371 1.00 45.55 C ATOM 1361 O LYS A 481 -8.350 13.846 -3.331 1.00 3.22 O ATOM 1362 CB LYS A 481 -9.785 11.228 -3.491 1.00 64.42 C ATOM 1363 CG LYS A 481 -11.108 11.766 -2.884 1.00 13.43 C ATOM 1364 CD LYS A 481 -12.090 10.609 -2.661 1.00 64.41 C ATOM 1365 CE LYS A 481 -13.445 11.075 -2.155 1.00 34.54 C ATOM 1366 NZ LYS A 481 -14.503 10.090 -2.492 1.00 24.02 N ATOM 0 H LYS A 481 -7.088 11.412 -4.500 1.00 61.11 H new ATOM 0 HA LYS A 481 -9.829 11.969 -5.542 1.00 62.03 H new ATOM 0 HB2 LYS A 481 -9.964 10.208 -3.831 1.00 64.42 H new ATOM 0 HB3 LYS A 481 -9.049 11.172 -2.689 1.00 64.42 H new ATOM 0 HG2 LYS A 481 -10.906 12.270 -1.939 1.00 13.43 H new ATOM 0 HG3 LYS A 481 -11.550 12.506 -3.552 1.00 13.43 H new ATOM 0 HD2 LYS A 481 -12.224 10.067 -3.597 1.00 64.41 H new ATOM 0 HD3 LYS A 481 -11.661 9.908 -1.945 1.00 64.41 H new ATOM 0 HE2 LYS A 481 -13.405 11.217 -1.075 1.00 34.54 H new ATOM 0 HE3 LYS A 481 -13.689 12.042 -2.595 1.00 34.54 H new ATOM 0 HZ1 LYS A 481 -15.419 10.430 -2.137 1.00 24.02 H new ATOM 0 HZ2 LYS A 481 -14.553 9.974 -3.524 1.00 24.02 H new ATOM 0 HZ3 LYS A 481 -14.278 9.175 -2.052 1.00 24.02 H new ATOM 1380 N ARG A 482 -9.380 14.466 -5.305 1.00 52.13 N ATOM 1381 CA ARG A 482 -9.530 15.933 -5.068 1.00 21.42 C ATOM 1382 C ARG A 482 -8.212 16.684 -5.418 1.00 72.43 C ATOM 1383 O ARG A 482 -7.324 16.824 -4.571 1.00 1.21 O ATOM 1384 CB ARG A 482 -10.016 16.234 -3.603 1.00 4.44 C ATOM 1385 CG ARG A 482 -10.577 17.647 -3.312 1.00 1.34 C ATOM 1386 CD ARG A 482 -11.679 17.630 -2.201 1.00 24.14 C ATOM 1387 NE ARG A 482 -12.023 18.972 -1.726 1.00 54.41 N ATOM 1388 CZ ARG A 482 -12.598 19.227 -0.535 1.00 22.24 C ATOM 1389 NH1 ARG A 482 -12.895 18.235 0.305 1.00 23.24 N ATOM 1390 NH2 ARG A 482 -12.880 20.470 -0.179 1.00 30.22 N ATOM 0 H ARG A 482 -9.644 14.192 -6.251 1.00 52.13 H new ATOM 0 HA ARG A 482 -10.306 16.308 -5.735 1.00 21.42 H new ATOM 0 HB2 ARG A 482 -10.787 15.507 -3.348 1.00 4.44 H new ATOM 0 HB3 ARG A 482 -9.178 16.059 -2.928 1.00 4.44 H new ATOM 0 HG2 ARG A 482 -9.763 18.303 -3.003 1.00 1.34 H new ATOM 0 HG3 ARG A 482 -10.994 18.066 -4.228 1.00 1.34 H new ATOM 0 HD2 ARG A 482 -12.575 17.146 -2.591 1.00 24.14 H new ATOM 0 HD3 ARG A 482 -11.332 17.029 -1.360 1.00 24.14 H new ATOM 0 HE ARG A 482 -11.814 19.763 -2.335 1.00 54.41 H new ATOM 0 HH11 ARG A 482 -12.687 17.270 0.048 1.00 23.24 H new ATOM 0 HH12 ARG A 482 -13.330 18.441 1.204 1.00 23.24 H new ATOM 0 HH21 ARG A 482 -12.662 21.243 -0.808 1.00 30.22 H new ATOM 0 HH22 ARG A 482 -13.315 20.655 0.725 1.00 30.22 H new ATOM 1404 N SER A 483 -8.085 17.146 -6.689 1.00 70.22 N ATOM 1405 CA SER A 483 -6.828 17.742 -7.204 1.00 61.24 C ATOM 1406 C SER A 483 -6.841 19.311 -7.030 1.00 2.14 C ATOM 1407 O SER A 483 -7.805 19.918 -7.502 1.00 73.11 O ATOM 1408 CB SER A 483 -6.755 17.395 -8.717 1.00 62.52 C ATOM 1409 OG SER A 483 -7.214 16.076 -8.942 1.00 40.11 O ATOM 0 H SER A 483 -8.839 17.116 -7.375 1.00 70.22 H new ATOM 0 HA SER A 483 -5.970 17.351 -6.657 1.00 61.24 H new ATOM 0 HB2 SER A 483 -7.359 18.100 -9.288 1.00 62.52 H new ATOM 0 HB3 SER A 483 -5.729 17.495 -9.071 1.00 62.52 H new ATOM 0 HG SER A 483 -6.880 15.756 -9.806 1.00 40.11 H new ATOM 1415 N LYS A 484 -5.821 19.995 -6.374 1.00 60.43 N ATOM 1416 CA LYS A 484 -5.806 21.499 -6.327 1.00 65.02 C ATOM 1417 C LYS A 484 -4.372 21.983 -6.090 1.00 63.44 C ATOM 1418 O LYS A 484 -3.528 21.187 -5.680 1.00 14.43 O ATOM 1419 CB LYS A 484 -6.727 22.059 -5.205 1.00 5.24 C ATOM 1420 CG LYS A 484 -7.873 23.017 -5.646 1.00 50.43 C ATOM 1421 CD LYS A 484 -8.910 23.133 -4.512 1.00 12.21 C ATOM 1422 CE LYS A 484 -10.041 24.173 -4.710 1.00 30.30 C ATOM 1423 NZ LYS A 484 -11.065 24.012 -3.649 1.00 20.43 N ATOM 0 H LYS A 484 -5.040 19.544 -5.896 1.00 60.43 H new ATOM 0 HA LYS A 484 -6.184 21.865 -7.282 1.00 65.02 H new ATOM 0 HB2 LYS A 484 -7.174 21.215 -4.680 1.00 5.24 H new ATOM 0 HB3 LYS A 484 -6.102 22.587 -4.485 1.00 5.24 H new ATOM 0 HG2 LYS A 484 -7.468 24.000 -5.885 1.00 50.43 H new ATOM 0 HG3 LYS A 484 -8.349 22.640 -6.551 1.00 50.43 H new ATOM 0 HD2 LYS A 484 -9.368 22.155 -4.368 1.00 12.21 H new ATOM 0 HD3 LYS A 484 -8.381 23.376 -3.590 1.00 12.21 H new ATOM 0 HE2 LYS A 484 -9.629 25.182 -4.680 1.00 30.30 H new ATOM 0 HE3 LYS A 484 -10.498 24.044 -5.691 1.00 30.30 H new ATOM 0 HZ1 LYS A 484 -11.821 24.712 -3.787 1.00 20.43 H new ATOM 0 HZ2 LYS A 484 -11.467 23.054 -3.697 1.00 20.43 H new ATOM 0 HZ3 LYS A 484 -10.625 24.156 -2.718 1.00 20.43 H new ATOM 1437 N ASN A 485 -4.070 23.268 -6.365 1.00 42.33 N ATOM 1438 CA ASN A 485 -2.710 23.767 -6.113 1.00 11.02 C ATOM 1439 C ASN A 485 -2.583 24.598 -4.814 1.00 14.11 C ATOM 1440 O ASN A 485 -1.633 24.345 -4.063 1.00 44.44 O ATOM 1441 CB ASN A 485 -2.090 24.488 -7.349 1.00 64.12 C ATOM 1442 CG ASN A 485 -2.849 25.726 -7.798 1.00 32.12 C ATOM 1443 OD1 ASN A 485 -3.789 25.644 -8.587 1.00 42.03 O ATOM 1444 ND2 ASN A 485 -2.421 26.887 -7.326 1.00 22.45 N ATOM 0 H ASN A 485 -4.723 23.953 -6.746 1.00 42.33 H new ATOM 0 HA ASN A 485 -2.108 22.874 -5.945 1.00 11.02 H new ATOM 0 HB2 ASN A 485 -1.064 24.771 -7.113 1.00 64.12 H new ATOM 0 HB3 ASN A 485 -2.043 23.784 -8.180 1.00 64.12 H new ATOM 0 HD21 ASN A 485 -2.874 27.754 -7.616 1.00 22.45 H new ATOM 0 HD22 ASN A 485 -1.638 26.915 -6.673 1.00 22.45 H new ATOM 1451 N ASP A 486 -3.572 25.508 -4.521 1.00 24.31 N ATOM 1452 CA ASP A 486 -3.500 26.544 -3.440 1.00 2.52 C ATOM 1453 C ASP A 486 -2.059 27.048 -3.125 1.00 45.14 C ATOM 1454 O ASP A 486 -1.451 27.709 -3.976 1.00 63.02 O ATOM 1455 CB ASP A 486 -4.266 26.093 -2.172 1.00 41.45 C ATOM 1456 CG ASP A 486 -5.775 26.093 -2.372 1.00 61.13 C ATOM 1457 OD1 ASP A 486 -6.295 25.233 -3.107 1.00 75.21 O ATOM 1458 OD2 ASP A 486 -6.437 26.972 -1.779 1.00 61.13 O ATOM 0 H ASP A 486 -4.451 25.539 -5.038 1.00 24.31 H new ATOM 0 HA ASP A 486 -4.008 27.422 -3.839 1.00 2.52 H new ATOM 0 HB2 ASP A 486 -3.940 25.091 -1.891 1.00 41.45 H new ATOM 0 HB3 ASP A 486 -4.012 26.755 -1.344 1.00 41.45 H new ATOM 1463 N SER A 487 -1.503 26.714 -1.941 1.00 52.53 N ATOM 1464 CA SER A 487 -0.104 27.055 -1.586 1.00 55.31 C ATOM 1465 C SER A 487 0.480 25.983 -0.627 1.00 11.05 C ATOM 1466 O SER A 487 1.378 25.245 -1.032 1.00 22.21 O ATOM 1467 CB SER A 487 -0.006 28.494 -0.991 1.00 43.23 C ATOM 1468 OG SER A 487 -0.353 29.484 -1.949 1.00 61.24 O ATOM 0 H SER A 487 -2.002 26.206 -1.210 1.00 52.53 H new ATOM 0 HA SER A 487 0.499 27.053 -2.494 1.00 55.31 H new ATOM 0 HB2 SER A 487 -0.666 28.576 -0.127 1.00 43.23 H new ATOM 0 HB3 SER A 487 1.009 28.672 -0.635 1.00 43.23 H new ATOM 0 HG SER A 487 -0.617 29.050 -2.787 1.00 61.24 H new ATOM 1474 N LYS A 488 -0.064 25.884 0.615 1.00 32.24 N ATOM 1475 CA LYS A 488 0.378 24.905 1.655 1.00 63.33 C ATOM 1476 C LYS A 488 -0.587 25.055 2.872 1.00 11.34 C ATOM 1477 O LYS A 488 -1.094 26.163 3.067 1.00 43.42 O ATOM 1478 CB LYS A 488 1.857 25.181 2.067 1.00 2.30 C ATOM 1479 CG LYS A 488 2.699 23.912 2.228 1.00 41.04 C ATOM 1480 CD LYS A 488 4.136 24.113 1.751 1.00 72.35 C ATOM 1481 CE LYS A 488 4.897 22.789 1.736 1.00 75.20 C ATOM 1482 NZ LYS A 488 6.238 22.914 1.105 1.00 63.35 N ATOM 0 H LYS A 488 -0.827 26.484 0.929 1.00 32.24 H new ATOM 0 HA LYS A 488 0.341 23.885 1.272 1.00 63.33 H new ATOM 0 HB2 LYS A 488 2.320 25.821 1.316 1.00 2.30 H new ATOM 0 HB3 LYS A 488 1.866 25.734 3.006 1.00 2.30 H new ATOM 0 HG2 LYS A 488 2.704 23.611 3.276 1.00 41.04 H new ATOM 0 HG3 LYS A 488 2.241 23.099 1.665 1.00 41.04 H new ATOM 0 HD2 LYS A 488 4.134 24.547 0.751 1.00 72.35 H new ATOM 0 HD3 LYS A 488 4.644 24.822 2.405 1.00 72.35 H new ATOM 0 HE2 LYS A 488 5.011 22.427 2.758 1.00 75.20 H new ATOM 0 HE3 LYS A 488 4.313 22.043 1.197 1.00 75.20 H new ATOM 0 HZ1 LYS A 488 6.715 21.990 1.118 1.00 63.35 H new ATOM 0 HZ2 LYS A 488 6.130 23.234 0.121 1.00 63.35 H new ATOM 0 HZ3 LYS A 488 6.807 23.606 1.633 1.00 63.35 H new ATOM 1496 N PRO A 489 -0.910 23.976 3.691 1.00 71.54 N ATOM 1497 CA PRO A 489 -1.920 24.083 4.779 1.00 44.42 C ATOM 1498 C PRO A 489 -1.422 24.891 6.032 1.00 44.21 C ATOM 1499 O PRO A 489 -0.796 24.312 6.929 1.00 20.41 O ATOM 1500 CB PRO A 489 -2.184 22.617 5.178 1.00 73.31 C ATOM 1501 CG PRO A 489 -0.936 21.889 4.830 1.00 1.32 C ATOM 1502 CD PRO A 489 -0.358 22.596 3.621 1.00 34.42 C ATOM 0 HA PRO A 489 -2.799 24.626 4.432 1.00 44.42 H new ATOM 0 HB2 PRO A 489 -2.406 22.532 6.242 1.00 73.31 H new ATOM 0 HB3 PRO A 489 -3.040 22.210 4.640 1.00 73.31 H new ATOM 0 HG2 PRO A 489 -0.232 21.903 5.662 1.00 1.32 H new ATOM 0 HG3 PRO A 489 -1.145 20.843 4.606 1.00 1.32 H new ATOM 0 HD2 PRO A 489 0.732 22.603 3.650 1.00 34.42 H new ATOM 0 HD3 PRO A 489 -0.649 22.100 2.695 1.00 34.42 H new ATOM 1510 N TYR A 490 -1.699 26.217 6.061 1.00 13.24 N ATOM 1511 CA TYR A 490 -1.241 27.163 7.121 1.00 73.32 C ATOM 1512 C TYR A 490 0.287 27.327 7.086 1.00 61.11 C ATOM 1513 O TYR A 490 0.994 26.651 7.864 1.00 0.55 O ATOM 1514 CB TYR A 490 -1.712 26.833 8.580 1.00 3.42 C ATOM 1515 CG TYR A 490 -2.093 28.071 9.361 1.00 70.22 C ATOM 1516 CD1 TYR A 490 -3.107 28.905 8.902 1.00 63.30 C ATOM 1517 CD2 TYR A 490 -1.452 28.411 10.548 1.00 54.14 C ATOM 1518 CE1 TYR A 490 -3.473 30.039 9.597 1.00 1.52 C ATOM 1519 CE2 TYR A 490 -1.815 29.546 11.251 1.00 43.31 C ATOM 1520 CZ TYR A 490 -2.825 30.356 10.770 1.00 65.25 C ATOM 1521 OH TYR A 490 -3.189 31.488 11.462 1.00 35.25 O ATOM 1522 OXT TYR A 490 0.765 28.141 6.271 1.00 37.89 O ATOM 0 H TYR A 490 -2.256 26.672 5.338 1.00 13.24 H new ATOM 0 HA TYR A 490 -1.734 28.102 6.870 1.00 73.32 H new ATOM 0 HB2 TYR A 490 -2.566 26.157 8.538 1.00 3.42 H new ATOM 0 HB3 TYR A 490 -0.915 26.307 9.105 1.00 3.42 H new ATOM 0 HD1 TYR A 490 -3.618 28.660 7.983 1.00 63.30 H new ATOM 0 HD2 TYR A 490 -0.661 27.781 10.926 1.00 54.14 H new ATOM 0 HE1 TYR A 490 -4.263 30.674 9.224 1.00 1.52 H new ATOM 0 HE2 TYR A 490 -1.311 29.798 12.172 1.00 43.31 H new ATOM 0 HH TYR A 490 -2.638 31.570 12.268 1.00 35.25 H new TER 1532 TYR A 490