USER MOD reduce.3.24.130724 H: found=0, std=0, add=764, rem=0, adj=19 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 -1 HIS : no HD1:sc= -0.0348 X(o=0.28,f=0.26) USER MOD Set 1.2: A 433 SER OG : rot 11:sc= 0.31 USER MOD Single : A 0 MET CE :methyl -167:sc= -0.0176 (180deg=-0.255) USER MOD Single : A -2 SER OG : rot 37:sc= 0.032 USER MOD Single : A -3 GLY N :NH3+ -148:sc= 0.00554 (180deg=0) USER MOD Single : A 398 GLN : amide:sc= 0.664 K(o=0.66,f=-4.5!) USER MOD Single : A 399 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 406 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 410 TYR OH : rot 180:sc= -0.0436 USER MOD Single : A 411 HIS : no HD1:sc= -0.75 X(o=-0.75,f=-0.88) USER MOD Single : A 414 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 419 GLN : amide:sc= -0.0922 K(o=-0.092,f=-0.83) USER MOD Single : A 423 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 424 MET CE :methyl 153:sc= -0.0691 (180deg=-0.696) USER MOD Single : A 426 MET CE :methyl -145:sc= -0.0681 (180deg=-1.46!) USER MOD Single : A 430 ASN : amide:sc= 0 X(o=0,f=-0.055) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 440 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 GLN : amide:sc= -0.153 X(o=-0.15,f=-0.035) USER MOD Single : A 442 THR OG1 : rot 180:sc= 0 USER MOD Single : A 443 ASN : amide:sc= -0.109 X(o=-0.11,f=-0.11) USER MOD Single : A 445 SER OG : rot 46:sc= 0.013 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 452 SER OG : rot 87:sc= 0 USER MOD Single : A 453 TYR OH : rot 45:sc= -0.145 USER MOD Single : A 455 ASN : amide:sc= -0.581 X(o=-0.58,f=-0.58) USER MOD Single : A 458 SER OG : rot 124:sc= 0.48 USER MOD Single : A 460 GLN : amide:sc= -0.19 X(o=-0.19,f=-0.1) USER MOD Single : A 464 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 466 MET CE :methyl -150:sc=-0.00381 (180deg=-0.77) USER MOD Single : A 467 ASN :FLIP amide:sc= -0.0139 F(o=-0.6,f=-0.014) USER MOD Single : A 470 GLN :FLIP amide:sc= 0 F(o=-0.58,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+ 180:sc= 0 (180deg=0) USER MOD Single : A 479 GLN : amide:sc= -0.244 X(o=-0.24,f=0) USER MOD Single : A 481 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 483 SER OG : rot 180:sc= 0 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=-0.18) USER MOD Single : A 487 SER OG : rot 180:sc= 0.00219 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 -12.495 -12.050 3.805 1.00 21.10 N ATOM 2 CA GLY A -3 -12.935 -10.840 4.537 1.00 3.42 C ATOM 3 C GLY A -3 -11.764 -9.984 4.978 1.00 75.13 C ATOM 4 O GLY A -3 -10.784 -9.836 4.237 1.00 15.33 O ATOM 0 H1 GLY A -3 -13.208 -12.302 3.091 1.00 21.10 H new ATOM 0 H2 GLY A -3 -11.587 -11.860 3.335 1.00 21.10 H new ATOM 0 H3 GLY A -3 -12.381 -12.838 4.474 1.00 21.10 H new ATOM 0 HA2 GLY A -3 -13.595 -10.251 3.900 1.00 3.42 H new ATOM 0 HA3 GLY A -3 -13.516 -11.136 5.410 1.00 3.42 H new ATOM 10 N SER A -2 -11.860 -9.440 6.192 1.00 34.24 N ATOM 11 CA SER A -2 -10.821 -8.582 6.754 1.00 53.42 C ATOM 12 C SER A -2 -9.636 -9.414 7.267 1.00 33.53 C ATOM 13 O SER A -2 -9.812 -10.360 8.042 1.00 44.41 O ATOM 14 CB SER A -2 -11.414 -7.715 7.879 1.00 32.25 C ATOM 15 OG SER A -2 -12.216 -8.490 8.755 1.00 32.05 O ATOM 0 H SER A -2 -12.659 -9.582 6.810 1.00 34.24 H new ATOM 0 HA SER A -2 -10.445 -7.928 5.968 1.00 53.42 H new ATOM 0 HB2 SER A -2 -10.608 -7.243 8.441 1.00 32.25 H new ATOM 0 HB3 SER A -2 -12.013 -6.913 7.447 1.00 32.25 H new ATOM 0 HG SER A -2 -11.811 -9.375 8.872 1.00 32.05 H new ATOM 21 N HIS A -1 -8.438 -9.082 6.796 1.00 12.24 N ATOM 22 CA HIS A -1 -7.237 -9.796 7.200 1.00 63.42 C ATOM 23 C HIS A -1 -6.158 -8.822 7.649 1.00 64.04 C ATOM 24 O HIS A -1 -6.189 -7.640 7.285 1.00 61.23 O ATOM 25 CB HIS A -1 -6.722 -10.729 6.058 1.00 2.41 C ATOM 26 CG HIS A -1 -6.516 -10.084 4.701 1.00 2.03 C ATOM 27 ND1 HIS A -1 -7.443 -10.176 3.681 1.00 52.54 N ATOM 28 CD2 HIS A -1 -5.485 -9.355 4.197 1.00 30.02 C ATOM 29 CE1 HIS A -1 -6.989 -9.542 2.614 1.00 53.11 C ATOM 30 NE2 HIS A -1 -5.805 -9.037 2.900 1.00 70.44 N ATOM 0 H HIS A -1 -8.276 -8.323 6.134 1.00 12.24 H new ATOM 0 HA HIS A -1 -7.491 -10.431 8.049 1.00 63.42 H new ATOM 0 HB2 HIS A -1 -5.776 -11.167 6.375 1.00 2.41 H new ATOM 0 HB3 HIS A -1 -7.430 -11.550 5.942 1.00 2.41 H new ATOM 0 HD2 HIS A -1 -4.582 -9.077 4.720 1.00 30.02 H new ATOM 0 HE1 HIS A -1 -7.501 -9.453 1.667 1.00 53.11 H new ATOM 0 HE2 HIS A -1 -5.221 -8.497 2.261 1.00 70.44 H new ATOM 39 N MET A 0 -5.231 -9.324 8.467 1.00 1.52 N ATOM 40 CA MET A 0 -4.021 -8.589 8.847 1.00 30.23 C ATOM 41 C MET A 0 -3.147 -8.346 7.604 1.00 54.40 C ATOM 42 O MET A 0 -3.236 -9.102 6.624 1.00 1.35 O ATOM 43 CB MET A 0 -3.257 -9.396 9.919 1.00 62.40 C ATOM 44 CG MET A 0 -2.042 -8.689 10.531 1.00 31.12 C ATOM 45 SD MET A 0 -1.163 -9.715 11.734 1.00 22.21 S ATOM 46 CE MET A 0 -2.366 -9.816 13.058 1.00 64.15 C ATOM 0 H MET A 0 -5.297 -10.252 8.885 1.00 1.52 H new ATOM 0 HA MET A 0 -4.287 -7.618 9.265 1.00 30.23 H new ATOM 0 HB2 MET A 0 -3.950 -9.650 10.721 1.00 62.40 H new ATOM 0 HB3 MET A 0 -2.925 -10.334 9.475 1.00 62.40 H new ATOM 0 HG2 MET A 0 -1.355 -8.403 9.734 1.00 31.12 H new ATOM 0 HG3 MET A 0 -2.369 -7.769 11.016 1.00 31.12 H new ATOM 0 HE1 MET A 0 -1.889 -10.214 13.953 1.00 64.15 H new ATOM 0 HE2 MET A 0 -2.760 -8.822 13.268 1.00 64.15 H new ATOM 0 HE3 MET A 0 -3.182 -10.474 12.759 1.00 64.15 H new ATOM 56 N GLN A 398 -2.330 -7.286 7.649 1.00 11.34 N ATOM 57 CA GLN A 398 -1.450 -6.899 6.539 1.00 4.43 C ATOM 58 C GLN A 398 -0.494 -8.047 6.177 1.00 25.03 C ATOM 59 O GLN A 398 0.179 -8.603 7.049 1.00 21.32 O ATOM 60 CB GLN A 398 -0.616 -5.596 6.864 1.00 24.54 C ATOM 61 CG GLN A 398 0.246 -5.609 8.190 1.00 30.25 C ATOM 62 CD GLN A 398 -0.474 -5.128 9.461 1.00 60.20 C ATOM 63 OE1 GLN A 398 -1.698 -5.214 9.579 1.00 21.45 O ATOM 64 NE2 GLN A 398 0.310 -4.634 10.437 1.00 72.31 N ATOM 0 H GLN A 398 -2.261 -6.670 8.459 1.00 11.34 H new ATOM 0 HA GLN A 398 -2.095 -6.681 5.688 1.00 4.43 H new ATOM 0 HB2 GLN A 398 0.054 -5.405 6.026 1.00 24.54 H new ATOM 0 HB3 GLN A 398 -1.308 -4.755 6.918 1.00 24.54 H new ATOM 0 HG2 GLN A 398 0.602 -6.625 8.359 1.00 30.25 H new ATOM 0 HG3 GLN A 398 1.126 -4.984 8.035 1.00 30.25 H new ATOM 0 HE21 GLN A 398 1.319 -4.579 10.302 1.00 72.31 H new ATOM 0 HE22 GLN A 398 -0.105 -4.315 11.312 1.00 72.31 H new ATOM 73 N LYS A 399 -0.473 -8.440 4.904 1.00 62.44 N ATOM 74 CA LYS A 399 0.491 -9.457 4.481 1.00 10.54 C ATOM 75 C LYS A 399 1.751 -8.718 4.008 1.00 42.21 C ATOM 76 O LYS A 399 1.727 -8.051 2.972 1.00 0.23 O ATOM 77 CB LYS A 399 -0.078 -10.367 3.338 1.00 12.33 C ATOM 78 CG LYS A 399 -0.805 -11.691 3.735 1.00 11.21 C ATOM 79 CD LYS A 399 0.130 -12.771 4.337 1.00 32.01 C ATOM 80 CE LYS A 399 0.027 -14.085 3.568 1.00 14.21 C ATOM 81 NZ LYS A 399 0.851 -15.154 4.193 1.00 74.10 N ATOM 0 H LYS A 399 -1.087 -8.086 4.171 1.00 62.44 H new ATOM 0 HA LYS A 399 0.715 -10.122 5.315 1.00 10.54 H new ATOM 0 HB2 LYS A 399 -0.776 -9.768 2.753 1.00 12.33 H new ATOM 0 HB3 LYS A 399 0.750 -10.628 2.678 1.00 12.33 H new ATOM 0 HG2 LYS A 399 -1.588 -11.460 4.457 1.00 11.21 H new ATOM 0 HG3 LYS A 399 -1.296 -12.102 2.853 1.00 11.21 H new ATOM 0 HD2 LYS A 399 1.160 -12.415 4.317 1.00 32.01 H new ATOM 0 HD3 LYS A 399 -0.129 -12.938 5.382 1.00 32.01 H new ATOM 0 HE2 LYS A 399 -1.015 -14.404 3.530 1.00 14.21 H new ATOM 0 HE3 LYS A 399 0.351 -13.931 2.539 1.00 14.21 H new ATOM 0 HZ1 LYS A 399 0.756 -16.032 3.643 1.00 74.10 H new ATOM 0 HZ2 LYS A 399 1.849 -14.860 4.207 1.00 74.10 H new ATOM 0 HZ3 LYS A 399 0.525 -15.319 5.167 1.00 74.10 H new ATOM 95 N GLU A 400 2.836 -8.799 4.793 1.00 42.33 N ATOM 96 CA GLU A 400 4.157 -8.347 4.319 1.00 34.33 C ATOM 97 C GLU A 400 4.859 -9.573 3.679 1.00 62.20 C ATOM 98 O GLU A 400 4.680 -10.683 4.201 1.00 61.33 O ATOM 99 CB GLU A 400 4.998 -7.651 5.488 1.00 31.14 C ATOM 100 CG GLU A 400 5.188 -8.462 6.779 1.00 12.04 C ATOM 101 CD GLU A 400 6.055 -7.720 7.768 1.00 71.52 C ATOM 102 OE1 GLU A 400 5.557 -6.766 8.419 1.00 25.52 O ATOM 103 OE2 GLU A 400 7.232 -8.088 7.915 1.00 11.40 O ATOM 0 H GLU A 400 2.829 -9.167 5.744 1.00 42.33 H new ATOM 0 HA GLU A 400 4.060 -7.566 3.565 1.00 34.33 H new ATOM 0 HB2 GLU A 400 5.984 -7.401 5.095 1.00 31.14 H new ATOM 0 HB3 GLU A 400 4.509 -6.711 5.745 1.00 31.14 H new ATOM 0 HG2 GLU A 400 4.216 -8.670 7.227 1.00 12.04 H new ATOM 0 HG3 GLU A 400 5.642 -9.424 6.543 1.00 12.04 H new ATOM 110 N GLY A 401 5.501 -9.395 2.455 1.00 74.12 N ATOM 111 CA GLY A 401 6.339 -10.409 1.808 1.00 0.21 C ATOM 112 C GLY A 401 7.079 -11.420 2.692 1.00 40.22 C ATOM 113 O GLY A 401 7.676 -11.040 3.706 1.00 73.44 O ATOM 0 H GLY A 401 5.429 -8.531 1.917 1.00 74.12 H new ATOM 0 HA2 GLY A 401 5.708 -10.971 1.120 1.00 0.21 H new ATOM 0 HA3 GLY A 401 7.083 -9.888 1.205 1.00 0.21 H new ATOM 117 N PRO A 402 7.117 -12.729 2.292 1.00 70.32 N ATOM 118 CA PRO A 402 7.710 -13.785 3.101 1.00 34.13 C ATOM 119 C PRO A 402 9.243 -13.842 3.003 1.00 22.03 C ATOM 120 O PRO A 402 9.867 -12.941 2.433 1.00 32.21 O ATOM 121 CB PRO A 402 7.086 -15.050 2.525 1.00 55.04 C ATOM 122 CG PRO A 402 7.024 -14.766 1.071 1.00 10.22 C ATOM 123 CD PRO A 402 6.620 -13.316 0.995 1.00 34.31 C ATOM 0 HA PRO A 402 7.518 -13.633 4.163 1.00 34.13 H new ATOM 0 HB2 PRO A 402 7.692 -15.931 2.738 1.00 55.04 H new ATOM 0 HB3 PRO A 402 6.096 -15.236 2.941 1.00 55.04 H new ATOM 0 HG2 PRO A 402 7.987 -14.937 0.590 1.00 10.22 H new ATOM 0 HG3 PRO A 402 6.299 -15.408 0.570 1.00 10.22 H new ATOM 0 HD2 PRO A 402 7.070 -12.821 0.135 1.00 34.31 H new ATOM 0 HD3 PRO A 402 5.540 -13.207 0.896 1.00 34.31 H new ATOM 131 N GLU A 403 9.796 -14.875 3.672 1.00 62.31 N ATOM 132 CA GLU A 403 11.213 -15.311 3.604 1.00 43.02 C ATOM 133 C GLU A 403 11.953 -14.944 2.257 1.00 3.03 C ATOM 134 O GLU A 403 11.667 -15.547 1.216 1.00 51.32 O ATOM 135 CB GLU A 403 11.075 -16.862 3.676 1.00 65.01 C ATOM 136 CG GLU A 403 11.481 -17.416 5.017 1.00 24.50 C ATOM 137 CD GLU A 403 10.981 -18.823 5.240 1.00 33.33 C ATOM 138 OE1 GLU A 403 11.697 -19.774 4.866 1.00 35.11 O ATOM 139 OE2 GLU A 403 9.865 -18.972 5.786 1.00 73.20 O ATOM 0 H GLU A 403 9.245 -15.456 4.304 1.00 62.31 H new ATOM 0 HA GLU A 403 11.803 -14.830 4.384 1.00 43.02 H new ATOM 0 HB2 GLU A 403 10.042 -17.142 3.469 1.00 65.01 H new ATOM 0 HB3 GLU A 403 11.690 -17.315 2.898 1.00 65.01 H new ATOM 0 HG2 GLU A 403 12.568 -17.404 5.097 1.00 24.50 H new ATOM 0 HG3 GLU A 403 11.096 -16.769 5.805 1.00 24.50 H new ATOM 146 N GLY A 404 12.862 -13.902 2.257 1.00 41.34 N ATOM 147 CA GLY A 404 13.734 -13.652 1.118 1.00 14.01 C ATOM 148 C GLY A 404 13.154 -12.715 0.072 1.00 55.13 C ATOM 149 O GLY A 404 13.939 -12.047 -0.603 1.00 52.14 O ATOM 0 H GLY A 404 12.984 -13.251 3.033 1.00 41.34 H new ATOM 0 HA2 GLY A 404 14.673 -13.234 1.481 1.00 14.01 H new ATOM 0 HA3 GLY A 404 13.971 -14.604 0.643 1.00 14.01 H new ATOM 153 N ALA A 405 11.815 -12.620 -0.113 1.00 33.44 N ATOM 154 CA ALA A 405 11.354 -11.585 -1.032 1.00 13.23 C ATOM 155 C ALA A 405 10.451 -10.596 -0.349 1.00 65.23 C ATOM 156 O ALA A 405 9.382 -10.900 0.178 1.00 54.22 O ATOM 157 CB ALA A 405 10.728 -12.129 -2.292 1.00 32.21 C ATOM 0 H ALA A 405 11.098 -13.199 0.325 1.00 33.44 H new ATOM 0 HA ALA A 405 12.252 -11.056 -1.351 1.00 13.23 H new ATOM 0 HB1 ALA A 405 10.409 -11.302 -2.926 1.00 32.21 H new ATOM 0 HB2 ALA A 405 11.457 -12.737 -2.827 1.00 32.21 H new ATOM 0 HB3 ALA A 405 9.864 -12.742 -2.034 1.00 32.21 H new ATOM 163 N ASN A 406 10.912 -9.384 -0.459 1.00 20.41 N ATOM 164 CA ASN A 406 10.401 -8.245 0.289 1.00 54.25 C ATOM 165 C ASN A 406 10.382 -7.031 -0.641 1.00 22.52 C ATOM 166 O ASN A 406 11.476 -6.573 -1.000 1.00 13.22 O ATOM 167 CB ASN A 406 11.308 -7.999 1.532 1.00 54.12 C ATOM 168 CG ASN A 406 11.135 -9.034 2.623 1.00 71.01 C ATOM 169 OD1 ASN A 406 11.853 -10.027 2.686 1.00 41.05 O ATOM 170 ND2 ASN A 406 10.202 -8.790 3.509 1.00 44.45 N ATOM 0 H ASN A 406 11.677 -9.141 -1.088 1.00 20.41 H new ATOM 0 HA ASN A 406 9.388 -8.431 0.646 1.00 54.25 H new ATOM 0 HB2 ASN A 406 12.351 -7.989 1.214 1.00 54.12 H new ATOM 0 HB3 ASN A 406 11.090 -7.012 1.941 1.00 54.12 H new ATOM 0 HD21 ASN A 406 10.053 -9.436 4.284 1.00 44.45 H new ATOM 0 HD22 ASN A 406 9.624 -7.954 3.424 1.00 44.45 H new ATOM 177 N LEU A 407 9.223 -6.484 -1.082 1.00 22.21 N ATOM 178 CA LEU A 407 9.313 -5.396 -2.051 1.00 44.52 C ATOM 179 C LEU A 407 8.626 -4.159 -1.417 1.00 12.02 C ATOM 180 O LEU A 407 7.410 -4.190 -1.269 1.00 12.13 O ATOM 181 CB LEU A 407 8.617 -5.821 -3.442 1.00 12.32 C ATOM 182 CG LEU A 407 9.066 -7.066 -4.275 1.00 72.42 C ATOM 183 CD1 LEU A 407 8.750 -8.398 -3.594 1.00 63.31 C ATOM 184 CD2 LEU A 407 8.332 -7.015 -5.601 1.00 21.15 C ATOM 0 H LEU A 407 8.283 -6.762 -0.800 1.00 22.21 H new ATOM 0 HA LEU A 407 10.352 -5.162 -2.284 1.00 44.52 H new ATOM 0 HB2 LEU A 407 7.557 -5.958 -3.228 1.00 12.32 H new ATOM 0 HB3 LEU A 407 8.699 -4.960 -4.105 1.00 12.32 H new ATOM 0 HG LEU A 407 10.149 -7.020 -4.390 1.00 72.42 H new ATOM 0 HD11 LEU A 407 9.088 -9.219 -4.226 1.00 63.31 H new ATOM 0 HD12 LEU A 407 9.262 -8.446 -2.633 1.00 63.31 H new ATOM 0 HD13 LEU A 407 7.675 -8.480 -3.437 1.00 63.31 H new ATOM 0 HD21 LEU A 407 8.622 -7.871 -6.210 1.00 21.15 H new ATOM 0 HD22 LEU A 407 7.257 -7.043 -5.423 1.00 21.15 H new ATOM 0 HD23 LEU A 407 8.589 -6.094 -6.124 1.00 21.15 H new ATOM 196 N PHE A 408 9.381 -3.062 -1.006 1.00 14.21 N ATOM 197 CA PHE A 408 8.684 -1.820 -0.560 1.00 12.33 C ATOM 198 C PHE A 408 8.608 -0.797 -1.726 1.00 64.55 C ATOM 199 O PHE A 408 9.654 -0.387 -2.232 1.00 22.25 O ATOM 200 CB PHE A 408 9.406 -1.151 0.656 1.00 10.21 C ATOM 201 CG PHE A 408 9.421 -1.920 1.966 1.00 34.31 C ATOM 202 CD1 PHE A 408 10.254 -3.023 2.153 1.00 1.24 C ATOM 203 CD2 PHE A 408 8.584 -1.545 3.013 1.00 52.42 C ATOM 204 CE1 PHE A 408 10.241 -3.726 3.331 1.00 12.42 C ATOM 205 CE2 PHE A 408 8.571 -2.261 4.194 1.00 53.21 C ATOM 206 CZ PHE A 408 9.396 -3.355 4.350 1.00 35.22 C ATOM 0 H PHE A 408 10.400 -3.027 -0.981 1.00 14.21 H new ATOM 0 HA PHE A 408 7.680 -2.110 -0.249 1.00 12.33 H new ATOM 0 HB2 PHE A 408 10.439 -0.954 0.369 1.00 10.21 H new ATOM 0 HB3 PHE A 408 8.936 -0.184 0.837 1.00 10.21 H new ATOM 0 HD1 PHE A 408 10.919 -3.328 1.359 1.00 1.24 H new ATOM 0 HD2 PHE A 408 7.939 -0.686 2.901 1.00 52.42 H new ATOM 0 HE1 PHE A 408 10.897 -4.574 3.458 1.00 12.42 H new ATOM 0 HE2 PHE A 408 7.913 -1.963 4.997 1.00 53.21 H new ATOM 0 HZ PHE A 408 9.378 -3.919 5.271 1.00 35.22 H new ATOM 216 N ILE A 409 7.364 -0.417 -2.177 1.00 53.44 N ATOM 217 CA ILE A 409 7.175 0.591 -3.281 1.00 32.40 C ATOM 218 C ILE A 409 6.712 1.930 -2.719 1.00 70.40 C ATOM 219 O ILE A 409 5.585 2.059 -2.237 1.00 75.21 O ATOM 220 CB ILE A 409 6.169 0.087 -4.404 1.00 52.45 C ATOM 221 CG1 ILE A 409 5.771 -1.424 -4.251 1.00 71.11 C ATOM 222 CG2 ILE A 409 6.799 0.317 -5.787 1.00 12.21 C ATOM 223 CD1 ILE A 409 4.336 -1.754 -4.683 1.00 73.33 C ATOM 0 H ILE A 409 6.492 -0.787 -1.800 1.00 53.44 H new ATOM 0 HA ILE A 409 8.148 0.720 -3.755 1.00 32.40 H new ATOM 0 HB ILE A 409 5.251 0.664 -4.292 1.00 52.45 H new ATOM 0 HG12 ILE A 409 6.461 -2.029 -4.838 1.00 71.11 H new ATOM 0 HG13 ILE A 409 5.899 -1.716 -3.209 1.00 71.11 H new ATOM 0 HG21 ILE A 409 6.113 -0.027 -6.561 1.00 12.21 H new ATOM 0 HG22 ILE A 409 6.997 1.380 -5.924 1.00 12.21 H new ATOM 0 HG23 ILE A 409 7.734 -0.239 -5.858 1.00 12.21 H new ATOM 0 HD11 ILE A 409 4.150 -2.819 -4.543 1.00 73.33 H new ATOM 0 HD12 ILE A 409 3.633 -1.180 -4.079 1.00 73.33 H new ATOM 0 HD13 ILE A 409 4.205 -1.498 -5.734 1.00 73.33 H new ATOM 235 N TYR A 410 7.633 2.924 -2.767 1.00 61.23 N ATOM 236 CA TYR A 410 7.324 4.305 -2.357 1.00 21.54 C ATOM 237 C TYR A 410 7.457 5.273 -3.558 1.00 41.45 C ATOM 238 O TYR A 410 8.144 4.929 -4.530 1.00 61.25 O ATOM 239 CB TYR A 410 8.192 4.794 -1.142 1.00 20.21 C ATOM 240 CG TYR A 410 9.728 5.011 -1.316 1.00 33.41 C ATOM 241 CD1 TYR A 410 10.239 6.104 -2.012 1.00 72.51 C ATOM 242 CD2 TYR A 410 10.671 4.147 -0.738 1.00 4.52 C ATOM 243 CE1 TYR A 410 11.595 6.330 -2.138 1.00 4.51 C ATOM 244 CE2 TYR A 410 12.038 4.377 -0.863 1.00 51.04 C ATOM 245 CZ TYR A 410 12.487 5.462 -1.572 1.00 72.32 C ATOM 246 OH TYR A 410 13.845 5.680 -1.714 1.00 1.24 O ATOM 0 H TYR A 410 8.592 2.789 -3.086 1.00 61.23 H new ATOM 0 HA TYR A 410 6.289 4.306 -2.014 1.00 21.54 H new ATOM 0 HB2 TYR A 410 7.768 5.738 -0.800 1.00 20.21 H new ATOM 0 HB3 TYR A 410 8.056 4.073 -0.336 1.00 20.21 H new ATOM 0 HD1 TYR A 410 9.550 6.799 -2.469 1.00 72.51 H new ATOM 0 HD2 TYR A 410 10.329 3.285 -0.184 1.00 4.52 H new ATOM 0 HE1 TYR A 410 11.951 7.192 -2.683 1.00 4.51 H new ATOM 0 HE2 TYR A 410 12.744 3.702 -0.402 1.00 51.04 H new ATOM 0 HH TYR A 410 14.340 4.972 -1.251 1.00 1.24 H new ATOM 256 N HIS A 411 6.760 6.461 -3.512 1.00 24.03 N ATOM 257 CA HIS A 411 6.985 7.587 -4.450 1.00 31.00 C ATOM 258 C HIS A 411 6.430 7.285 -5.864 1.00 72.04 C ATOM 259 O HIS A 411 7.047 7.665 -6.866 1.00 24.33 O ATOM 260 CB HIS A 411 8.474 8.039 -4.513 1.00 44.54 C ATOM 261 CG HIS A 411 8.914 8.936 -3.367 1.00 3.35 C ATOM 262 ND1 HIS A 411 8.186 9.060 -2.193 1.00 31.54 N ATOM 263 CD2 HIS A 411 10.007 9.756 -3.204 1.00 24.42 C ATOM 264 CE1 HIS A 411 8.800 9.890 -1.374 1.00 54.35 C ATOM 265 NE2 HIS A 411 9.895 10.331 -1.959 1.00 12.33 N ATOM 0 H HIS A 411 6.033 6.649 -2.821 1.00 24.03 H new ATOM 0 HA HIS A 411 6.421 8.427 -4.044 1.00 31.00 H new ATOM 0 HB2 HIS A 411 9.108 7.153 -4.527 1.00 44.54 H new ATOM 0 HB3 HIS A 411 8.640 8.565 -5.453 1.00 44.54 H new ATOM 0 HD2 HIS A 411 10.802 9.917 -3.917 1.00 24.42 H new ATOM 0 HE1 HIS A 411 8.461 10.164 -0.386 1.00 54.35 H new ATOM 0 HE2 HIS A 411 10.555 10.994 -1.553 1.00 12.33 H new ATOM 274 N LEU A 412 5.251 6.615 -5.927 1.00 12.43 N ATOM 275 CA LEU A 412 4.510 6.400 -7.199 1.00 15.43 C ATOM 276 C LEU A 412 4.147 7.729 -7.920 1.00 2.34 C ATOM 277 O LEU A 412 3.842 8.743 -7.285 1.00 64.04 O ATOM 278 CB LEU A 412 3.180 5.601 -6.955 1.00 51.11 C ATOM 279 CG LEU A 412 2.275 6.106 -5.790 1.00 22.22 C ATOM 280 CD1 LEU A 412 1.208 7.142 -6.179 1.00 11.23 C ATOM 281 CD2 LEU A 412 1.572 4.981 -5.046 1.00 12.31 C ATOM 0 H LEU A 412 4.791 6.213 -5.110 1.00 12.43 H new ATOM 0 HA LEU A 412 5.187 5.830 -7.835 1.00 15.43 H new ATOM 0 HB2 LEU A 412 2.596 5.620 -7.875 1.00 51.11 H new ATOM 0 HB3 LEU A 412 3.437 4.559 -6.762 1.00 51.11 H new ATOM 0 HG LEU A 412 3.002 6.598 -5.144 1.00 22.22 H new ATOM 0 HD11 LEU A 412 0.636 7.424 -5.295 1.00 11.23 H new ATOM 0 HD12 LEU A 412 1.693 8.025 -6.595 1.00 11.23 H new ATOM 0 HD13 LEU A 412 0.538 6.712 -6.923 1.00 11.23 H new ATOM 0 HD21 LEU A 412 0.959 5.400 -4.248 1.00 12.31 H new ATOM 0 HD22 LEU A 412 0.938 4.427 -5.739 1.00 12.31 H new ATOM 0 HD23 LEU A 412 2.315 4.308 -4.617 1.00 12.31 H new ATOM 293 N PRO A 413 4.270 7.726 -9.267 1.00 55.33 N ATOM 294 CA PRO A 413 3.703 8.740 -10.185 1.00 34.01 C ATOM 295 C PRO A 413 2.168 8.710 -10.234 1.00 4.14 C ATOM 296 O PRO A 413 1.567 7.762 -9.767 1.00 11.12 O ATOM 297 CB PRO A 413 4.328 8.345 -11.524 1.00 54.32 C ATOM 298 CG PRO A 413 4.534 6.899 -11.392 1.00 71.13 C ATOM 299 CD PRO A 413 5.058 6.741 -10.026 1.00 15.21 C ATOM 0 HA PRO A 413 3.924 9.763 -9.880 1.00 34.01 H new ATOM 0 HB2 PRO A 413 3.670 8.582 -12.360 1.00 54.32 H new ATOM 0 HB3 PRO A 413 5.267 8.870 -11.699 1.00 54.32 H new ATOM 0 HG2 PRO A 413 3.603 6.348 -11.529 1.00 71.13 H new ATOM 0 HG3 PRO A 413 5.238 6.526 -12.136 1.00 71.13 H new ATOM 0 HD2 PRO A 413 4.912 5.728 -9.650 1.00 15.21 H new ATOM 0 HD3 PRO A 413 6.127 6.950 -9.975 1.00 15.21 H new ATOM 307 N GLN A 414 1.563 9.791 -10.756 1.00 53.33 N ATOM 308 CA GLN A 414 0.074 9.980 -10.825 1.00 72.00 C ATOM 309 C GLN A 414 -0.712 8.781 -11.490 1.00 74.25 C ATOM 310 O GLN A 414 -1.848 8.509 -11.085 1.00 65.03 O ATOM 311 CB GLN A 414 -0.204 11.358 -11.523 1.00 5.11 C ATOM 312 CG GLN A 414 -1.400 11.437 -12.511 1.00 61.21 C ATOM 313 CD GLN A 414 -1.418 12.752 -13.254 1.00 3.05 C ATOM 314 OE1 GLN A 414 -2.057 13.707 -12.823 1.00 61.03 O ATOM 315 NE2 GLN A 414 -0.672 12.833 -14.354 1.00 60.31 N ATOM 0 H GLN A 414 2.084 10.574 -11.150 1.00 53.33 H new ATOM 0 HA GLN A 414 -0.319 9.988 -9.808 1.00 72.00 H new ATOM 0 HB2 GLN A 414 -0.363 12.103 -10.743 1.00 5.11 H new ATOM 0 HB3 GLN A 414 0.697 11.649 -12.063 1.00 5.11 H new ATOM 0 HG2 GLN A 414 -1.339 10.615 -13.225 1.00 61.21 H new ATOM 0 HG3 GLN A 414 -2.334 11.314 -11.963 1.00 61.21 H new ATOM 0 HE21 GLN A 414 -0.155 12.017 -14.681 1.00 60.31 H new ATOM 0 HE22 GLN A 414 -0.617 13.711 -14.870 1.00 60.31 H new ATOM 324 N GLU A 415 -0.117 8.048 -12.474 1.00 32.43 N ATOM 325 CA GLU A 415 -0.830 6.906 -13.127 1.00 23.32 C ATOM 326 C GLU A 415 -0.450 5.530 -12.462 1.00 72.41 C ATOM 327 O GLU A 415 -0.978 4.488 -12.848 1.00 4.13 O ATOM 328 CB GLU A 415 -0.638 6.963 -14.683 1.00 32.40 C ATOM 329 CG GLU A 415 -1.853 6.472 -15.516 1.00 30.21 C ATOM 330 CD GLU A 415 -1.602 6.609 -16.994 1.00 22.40 C ATOM 331 OE1 GLU A 415 -1.526 7.756 -17.479 1.00 74.32 O ATOM 332 OE2 GLU A 415 -1.482 5.573 -17.682 1.00 25.32 O ATOM 0 H GLU A 415 0.825 8.218 -12.825 1.00 32.43 H new ATOM 0 HA GLU A 415 -1.902 7.001 -12.957 1.00 23.32 H new ATOM 0 HB2 GLU A 415 -0.413 7.991 -14.968 1.00 32.40 H new ATOM 0 HB3 GLU A 415 0.231 6.361 -14.948 1.00 32.40 H new ATOM 0 HG2 GLU A 415 -2.062 5.429 -15.277 1.00 30.21 H new ATOM 0 HG3 GLU A 415 -2.739 7.045 -15.242 1.00 30.21 H new ATOM 339 N PHE A 416 0.470 5.553 -11.459 1.00 43.01 N ATOM 340 CA PHE A 416 0.569 4.441 -10.416 1.00 44.54 C ATOM 341 C PHE A 416 -0.157 4.888 -9.079 1.00 73.34 C ATOM 342 O PHE A 416 -0.435 6.059 -8.893 1.00 20.43 O ATOM 343 CB PHE A 416 2.019 3.862 -10.122 1.00 30.40 C ATOM 344 CG PHE A 416 2.624 2.771 -11.022 1.00 75.34 C ATOM 345 CD1 PHE A 416 1.987 2.162 -12.123 1.00 34.21 C ATOM 346 CD2 PHE A 416 3.901 2.316 -10.690 1.00 53.14 C ATOM 347 CE1 PHE A 416 2.630 1.161 -12.845 1.00 34.13 C ATOM 348 CE2 PHE A 416 4.525 1.322 -11.408 1.00 54.33 C ATOM 349 CZ PHE A 416 3.890 0.741 -12.476 1.00 34.22 C ATOM 0 H PHE A 416 1.150 6.303 -11.333 1.00 43.01 H new ATOM 0 HA PHE A 416 0.056 3.593 -10.870 1.00 44.54 H new ATOM 0 HB2 PHE A 416 2.710 4.705 -10.131 1.00 30.40 H new ATOM 0 HB3 PHE A 416 2.008 3.470 -9.105 1.00 30.40 H new ATOM 0 HD1 PHE A 416 0.993 2.475 -12.408 1.00 34.21 H new ATOM 0 HD2 PHE A 416 4.413 2.756 -9.847 1.00 53.14 H new ATOM 0 HE1 PHE A 416 2.141 0.712 -13.697 1.00 34.13 H new ATOM 0 HE2 PHE A 416 5.517 0.998 -11.130 1.00 54.33 H new ATOM 0 HZ PHE A 416 4.378 -0.048 -13.029 1.00 34.22 H new ATOM 359 N GLY A 417 -0.513 3.925 -8.196 1.00 54.01 N ATOM 360 CA GLY A 417 -1.642 4.086 -7.219 1.00 74.45 C ATOM 361 C GLY A 417 -2.060 2.697 -6.723 1.00 3.14 C ATOM 362 O GLY A 417 -1.578 1.735 -7.286 1.00 60.23 O ATOM 0 H GLY A 417 -0.040 3.023 -8.132 1.00 54.01 H new ATOM 0 HA2 GLY A 417 -1.331 4.709 -6.381 1.00 74.45 H new ATOM 0 HA3 GLY A 417 -2.485 4.588 -7.694 1.00 74.45 H new ATOM 366 N ASP A 418 -2.965 2.544 -5.726 1.00 4.12 N ATOM 367 CA ASP A 418 -3.031 1.225 -5.013 1.00 14.52 C ATOM 368 C ASP A 418 -3.852 0.101 -5.665 1.00 32.51 C ATOM 369 O ASP A 418 -3.318 -1.007 -5.771 1.00 11.12 O ATOM 370 CB ASP A 418 -3.375 1.286 -3.517 1.00 51.22 C ATOM 371 CG ASP A 418 -4.505 2.236 -3.151 1.00 20.34 C ATOM 372 OD1 ASP A 418 -5.600 2.159 -3.745 1.00 75.11 O ATOM 373 OD2 ASP A 418 -4.279 3.099 -2.271 1.00 63.22 O ATOM 0 H ASP A 418 -3.621 3.256 -5.406 1.00 4.12 H new ATOM 0 HA ASP A 418 -1.982 0.950 -5.122 1.00 14.52 H new ATOM 0 HB2 ASP A 418 -3.641 0.284 -3.180 1.00 51.22 H new ATOM 0 HB3 ASP A 418 -2.481 1.581 -2.967 1.00 51.22 H new ATOM 378 N GLN A 419 -5.142 0.339 -6.041 1.00 41.43 N ATOM 379 CA GLN A 419 -5.955 -0.653 -6.730 1.00 21.13 C ATOM 380 C GLN A 419 -5.279 -0.990 -8.102 1.00 21.05 C ATOM 381 O GLN A 419 -5.335 -2.122 -8.589 1.00 43.10 O ATOM 382 CB GLN A 419 -7.447 -0.169 -6.886 1.00 15.51 C ATOM 383 CG GLN A 419 -8.326 -1.157 -7.667 1.00 65.53 C ATOM 384 CD GLN A 419 -8.490 -0.789 -9.143 1.00 64.53 C ATOM 385 OE1 GLN A 419 -8.538 0.389 -9.510 1.00 61.33 O ATOM 386 NE2 GLN A 419 -8.532 -1.802 -10.003 1.00 4.43 N ATOM 0 H GLN A 419 -5.624 1.221 -5.868 1.00 41.43 H new ATOM 0 HA GLN A 419 -6.006 -1.566 -6.137 1.00 21.13 H new ATOM 0 HB2 GLN A 419 -7.877 -0.014 -5.896 1.00 15.51 H new ATOM 0 HB3 GLN A 419 -7.458 0.796 -7.393 1.00 15.51 H new ATOM 0 HG2 GLN A 419 -7.891 -2.154 -7.595 1.00 65.53 H new ATOM 0 HG3 GLN A 419 -9.310 -1.204 -7.200 1.00 65.53 H new ATOM 0 HE21 GLN A 419 -8.490 -2.762 -9.662 1.00 4.43 H new ATOM 0 HE22 GLN A 419 -8.606 -1.619 -11.004 1.00 4.43 H new ATOM 395 N ASP A 420 -4.562 0.010 -8.653 1.00 42.53 N ATOM 396 CA ASP A 420 -3.859 -0.112 -9.936 1.00 13.14 C ATOM 397 C ASP A 420 -2.421 -0.709 -9.815 1.00 20.53 C ATOM 398 O ASP A 420 -1.774 -0.937 -10.836 1.00 64.32 O ATOM 399 CB ASP A 420 -3.844 1.203 -10.751 1.00 70.53 C ATOM 400 CG ASP A 420 -3.614 2.451 -9.938 1.00 34.12 C ATOM 401 OD1 ASP A 420 -4.545 2.886 -9.197 1.00 33.41 O ATOM 402 OD2 ASP A 420 -2.518 2.990 -10.058 1.00 22.14 O ATOM 0 H ASP A 420 -4.457 0.925 -8.216 1.00 42.53 H new ATOM 0 HA ASP A 420 -4.453 -0.836 -10.494 1.00 13.14 H new ATOM 0 HB2 ASP A 420 -3.066 1.133 -11.511 1.00 70.53 H new ATOM 0 HB3 ASP A 420 -4.794 1.299 -11.276 1.00 70.53 H new ATOM 407 N ILE A 421 -1.905 -0.933 -8.580 1.00 62.11 N ATOM 408 CA ILE A 421 -0.498 -1.423 -8.355 1.00 70.11 C ATOM 409 C ILE A 421 -0.324 -2.882 -8.830 1.00 30.14 C ATOM 410 O ILE A 421 0.759 -3.311 -9.252 1.00 73.04 O ATOM 411 CB ILE A 421 -0.083 -1.251 -6.828 1.00 52.44 C ATOM 412 CG1 ILE A 421 1.001 -0.151 -6.654 1.00 3.10 C ATOM 413 CG2 ILE A 421 0.392 -2.553 -6.113 1.00 52.14 C ATOM 414 CD1 ILE A 421 0.875 0.597 -5.325 1.00 11.02 C ATOM 0 H ILE A 421 -2.432 -0.786 -7.719 1.00 62.11 H new ATOM 0 HA ILE A 421 0.173 -0.810 -8.957 1.00 70.11 H new ATOM 0 HB ILE A 421 -1.012 -0.956 -6.341 1.00 52.44 H new ATOM 0 HG12 ILE A 421 1.989 -0.607 -6.717 1.00 3.10 H new ATOM 0 HG13 ILE A 421 0.925 0.561 -7.476 1.00 3.10 H new ATOM 0 HG21 ILE A 421 0.651 -2.326 -5.079 1.00 52.14 H new ATOM 0 HG22 ILE A 421 -0.409 -3.292 -6.133 1.00 52.14 H new ATOM 0 HG23 ILE A 421 1.267 -2.952 -6.627 1.00 52.14 H new ATOM 0 HD11 ILE A 421 1.657 1.353 -5.257 1.00 11.02 H new ATOM 0 HD12 ILE A 421 -0.101 1.079 -5.270 1.00 11.02 H new ATOM 0 HD13 ILE A 421 0.979 -0.107 -4.500 1.00 11.02 H new ATOM 426 N LEU A 422 -1.439 -3.602 -8.798 1.00 14.22 N ATOM 427 CA LEU A 422 -1.532 -4.978 -9.219 1.00 0.42 C ATOM 428 C LEU A 422 -1.525 -5.029 -10.801 1.00 14.45 C ATOM 429 O LEU A 422 -1.188 -6.061 -11.370 1.00 11.04 O ATOM 430 CB LEU A 422 -2.786 -5.635 -8.471 1.00 63.54 C ATOM 431 CG LEU A 422 -3.585 -6.819 -9.076 1.00 14.11 C ATOM 432 CD1 LEU A 422 -4.558 -7.372 -8.051 1.00 71.11 C ATOM 433 CD2 LEU A 422 -4.394 -6.445 -10.314 1.00 32.04 C ATOM 0 H LEU A 422 -2.327 -3.224 -8.466 1.00 14.22 H new ATOM 0 HA LEU A 422 -0.677 -5.590 -8.931 1.00 0.42 H new ATOM 0 HB2 LEU A 422 -2.431 -5.964 -7.495 1.00 63.54 H new ATOM 0 HB3 LEU A 422 -3.502 -4.832 -8.296 1.00 63.54 H new ATOM 0 HG LEU A 422 -2.835 -7.555 -9.366 1.00 14.11 H new ATOM 0 HD11 LEU A 422 -5.113 -8.202 -8.487 1.00 71.11 H new ATOM 0 HD12 LEU A 422 -4.007 -7.722 -7.178 1.00 71.11 H new ATOM 0 HD13 LEU A 422 -5.254 -6.589 -7.750 1.00 71.11 H new ATOM 0 HD21 LEU A 422 -4.925 -7.323 -10.680 1.00 32.04 H new ATOM 0 HD22 LEU A 422 -5.113 -5.667 -10.058 1.00 32.04 H new ATOM 0 HD23 LEU A 422 -3.723 -6.077 -11.090 1.00 32.04 H new ATOM 445 N GLN A 423 -1.850 -3.869 -11.502 1.00 33.24 N ATOM 446 CA GLN A 423 -2.005 -3.837 -12.981 1.00 75.32 C ATOM 447 C GLN A 423 -0.662 -4.052 -13.721 1.00 52.01 C ATOM 448 O GLN A 423 -0.575 -4.979 -14.529 1.00 23.40 O ATOM 449 CB GLN A 423 -2.735 -2.549 -13.524 1.00 13.14 C ATOM 450 CG GLN A 423 -4.221 -2.393 -13.101 1.00 13.11 C ATOM 451 CD GLN A 423 -4.954 -1.370 -13.942 1.00 43.24 C ATOM 452 OE1 GLN A 423 -4.367 -0.410 -14.439 1.00 13.21 O ATOM 453 NE2 GLN A 423 -6.251 -1.559 -14.090 1.00 71.31 N ATOM 0 H GLN A 423 -2.003 -2.967 -11.052 1.00 33.24 H new ATOM 0 HA GLN A 423 -2.659 -4.681 -13.202 1.00 75.32 H new ATOM 0 HB2 GLN A 423 -2.185 -1.671 -13.185 1.00 13.14 H new ATOM 0 HB3 GLN A 423 -2.684 -2.556 -14.613 1.00 13.14 H new ATOM 0 HG2 GLN A 423 -4.723 -3.357 -13.186 1.00 13.11 H new ATOM 0 HG3 GLN A 423 -4.269 -2.099 -12.052 1.00 13.11 H new ATOM 0 HE21 GLN A 423 -6.701 -2.368 -13.662 1.00 71.31 H new ATOM 0 HE22 GLN A 423 -6.804 -0.896 -14.633 1.00 71.31 H new ATOM 462 N MET A 424 0.397 -3.259 -13.439 1.00 62.15 N ATOM 463 CA MET A 424 1.653 -3.395 -14.203 1.00 51.11 C ATOM 464 C MET A 424 2.622 -4.451 -13.638 1.00 20.54 C ATOM 465 O MET A 424 3.530 -4.880 -14.352 1.00 73.20 O ATOM 466 CB MET A 424 2.383 -2.052 -14.327 1.00 54.41 C ATOM 467 CG MET A 424 2.467 -1.483 -15.749 1.00 4.23 C ATOM 468 SD MET A 424 3.504 -2.466 -16.862 1.00 13.22 S ATOM 469 CE MET A 424 2.277 -3.319 -17.852 1.00 0.02 C ATOM 0 H MET A 424 0.408 -2.542 -12.713 1.00 62.15 H new ATOM 0 HA MET A 424 1.341 -3.741 -15.188 1.00 51.11 H new ATOM 0 HB2 MET A 424 1.881 -1.324 -13.691 1.00 54.41 H new ATOM 0 HB3 MET A 424 3.395 -2.170 -13.940 1.00 54.41 H new ATOM 0 HG2 MET A 424 1.462 -1.418 -16.165 1.00 4.23 H new ATOM 0 HG3 MET A 424 2.859 -0.467 -15.702 1.00 4.23 H new ATOM 0 HE1 MET A 424 2.699 -3.557 -18.828 1.00 0.02 H new ATOM 0 HE2 MET A 424 1.981 -4.240 -17.350 1.00 0.02 H new ATOM 0 HE3 MET A 424 1.404 -2.679 -17.980 1.00 0.02 H new ATOM 479 N PHE A 425 2.435 -4.890 -12.383 1.00 60.15 N ATOM 480 CA PHE A 425 3.429 -5.741 -11.724 1.00 64.42 C ATOM 481 C PHE A 425 3.128 -7.260 -11.903 1.00 2.42 C ATOM 482 O PHE A 425 3.859 -8.097 -11.375 1.00 64.15 O ATOM 483 CB PHE A 425 3.717 -5.309 -10.235 1.00 4.23 C ATOM 484 CG PHE A 425 5.159 -4.972 -10.011 1.00 24.03 C ATOM 485 CD1 PHE A 425 5.604 -3.694 -10.283 1.00 55.55 C ATOM 486 CD2 PHE A 425 6.067 -5.913 -9.557 1.00 5.23 C ATOM 487 CE1 PHE A 425 6.914 -3.350 -10.114 1.00 24.03 C ATOM 488 CE2 PHE A 425 7.391 -5.584 -9.390 1.00 14.53 C ATOM 489 CZ PHE A 425 7.826 -4.296 -9.669 1.00 13.00 C ATOM 0 H PHE A 425 1.617 -4.672 -11.814 1.00 60.15 H new ATOM 0 HA PHE A 425 4.373 -5.577 -12.244 1.00 64.42 H new ATOM 0 HB2 PHE A 425 3.101 -4.446 -9.984 1.00 4.23 H new ATOM 0 HB3 PHE A 425 3.426 -6.115 -9.562 1.00 4.23 H new ATOM 0 HD1 PHE A 425 4.903 -2.953 -10.636 1.00 55.55 H new ATOM 0 HD2 PHE A 425 5.732 -6.915 -9.332 1.00 5.23 H new ATOM 0 HE1 PHE A 425 7.240 -2.343 -10.326 1.00 24.03 H new ATOM 0 HE2 PHE A 425 8.093 -6.328 -9.042 1.00 14.53 H new ATOM 0 HZ PHE A 425 8.865 -4.032 -9.541 1.00 13.00 H new ATOM 499 N MET A 426 2.060 -7.607 -12.675 1.00 54.23 N ATOM 500 CA MET A 426 1.529 -8.969 -12.759 1.00 72.41 C ATOM 501 C MET A 426 2.378 -9.946 -13.628 1.00 3.12 C ATOM 502 O MET A 426 2.529 -11.096 -13.230 1.00 31.11 O ATOM 503 CB MET A 426 0.104 -8.942 -13.304 1.00 34.24 C ATOM 504 CG MET A 426 -0.939 -9.228 -12.250 1.00 70.52 C ATOM 505 SD MET A 426 -0.920 -10.940 -11.706 1.00 54.11 S ATOM 506 CE MET A 426 -2.101 -10.827 -10.375 1.00 13.42 C ATOM 0 H MET A 426 1.552 -6.937 -13.252 1.00 54.23 H new ATOM 0 HA MET A 426 1.561 -9.351 -11.739 1.00 72.41 H new ATOM 0 HB2 MET A 426 -0.092 -7.964 -13.744 1.00 34.24 H new ATOM 0 HB3 MET A 426 0.014 -9.676 -14.105 1.00 34.24 H new ATOM 0 HG2 MET A 426 -0.772 -8.576 -11.392 1.00 70.52 H new ATOM 0 HG3 MET A 426 -1.926 -8.987 -12.646 1.00 70.52 H new ATOM 0 HE1 MET A 426 -1.807 -11.500 -9.570 1.00 13.42 H new ATOM 0 HE2 MET A 426 -2.130 -9.804 -10.000 1.00 13.42 H new ATOM 0 HE3 MET A 426 -3.089 -11.108 -10.740 1.00 13.42 H new ATOM 516 N PRO A 427 2.919 -9.570 -14.855 1.00 74.42 N ATOM 517 CA PRO A 427 3.659 -10.544 -15.684 1.00 54.04 C ATOM 518 C PRO A 427 5.071 -10.912 -15.175 1.00 11.25 C ATOM 519 O PRO A 427 5.628 -11.931 -15.601 1.00 25.22 O ATOM 520 CB PRO A 427 3.756 -9.907 -17.062 1.00 20.13 C ATOM 521 CG PRO A 427 3.340 -8.476 -16.943 1.00 23.52 C ATOM 522 CD PRO A 427 2.788 -8.259 -15.558 1.00 45.41 C ATOM 0 HA PRO A 427 3.121 -11.492 -15.667 1.00 54.04 H new ATOM 0 HB2 PRO A 427 4.775 -9.977 -17.443 1.00 20.13 H new ATOM 0 HB3 PRO A 427 3.115 -10.432 -17.770 1.00 20.13 H new ATOM 0 HG2 PRO A 427 4.190 -7.817 -17.121 1.00 23.52 H new ATOM 0 HG3 PRO A 427 2.588 -8.235 -17.694 1.00 23.52 H new ATOM 0 HD2 PRO A 427 3.341 -7.479 -15.035 1.00 45.41 H new ATOM 0 HD3 PRO A 427 1.747 -7.940 -15.598 1.00 45.41 H new ATOM 530 N PHE A 428 5.653 -10.091 -14.297 1.00 25.31 N ATOM 531 CA PHE A 428 6.878 -10.477 -13.588 1.00 73.04 C ATOM 532 C PHE A 428 6.575 -11.398 -12.351 1.00 33.12 C ATOM 533 O PHE A 428 7.528 -11.766 -11.662 1.00 43.42 O ATOM 534 CB PHE A 428 7.794 -9.245 -13.159 1.00 72.32 C ATOM 535 CG PHE A 428 8.250 -8.299 -14.260 1.00 63.23 C ATOM 536 CD1 PHE A 428 8.956 -8.775 -15.346 1.00 35.12 C ATOM 537 CD2 PHE A 428 8.004 -6.925 -14.190 1.00 64.23 C ATOM 538 CE1 PHE A 428 9.399 -7.923 -16.339 1.00 33.01 C ATOM 539 CE2 PHE A 428 8.446 -6.073 -15.186 1.00 33.52 C ATOM 540 CZ PHE A 428 9.142 -6.575 -16.259 1.00 1.11 C ATOM 0 H PHE A 428 5.301 -9.163 -14.061 1.00 25.31 H new ATOM 0 HA PHE A 428 7.454 -11.049 -14.316 1.00 73.04 H new ATOM 0 HB2 PHE A 428 7.249 -8.662 -12.417 1.00 72.32 H new ATOM 0 HB3 PHE A 428 8.681 -9.640 -12.665 1.00 72.32 H new ATOM 0 HD1 PHE A 428 9.166 -9.832 -15.421 1.00 35.12 H new ATOM 0 HD2 PHE A 428 7.462 -6.523 -13.347 1.00 64.23 H new ATOM 0 HE1 PHE A 428 9.949 -8.317 -17.181 1.00 33.01 H new ATOM 0 HE2 PHE A 428 8.244 -5.014 -15.120 1.00 33.52 H new ATOM 0 HZ PHE A 428 9.487 -5.912 -17.038 1.00 1.11 H new ATOM 550 N GLY A 429 5.288 -11.836 -12.067 1.00 14.25 N ATOM 551 CA GLY A 429 5.094 -12.712 -10.883 1.00 52.41 C ATOM 552 C GLY A 429 3.726 -12.557 -10.083 1.00 32.43 C ATOM 553 O GLY A 429 2.954 -11.652 -10.377 1.00 63.43 O ATOM 0 H GLY A 429 4.449 -11.611 -12.602 1.00 14.25 H new ATOM 0 HA2 GLY A 429 5.179 -13.748 -11.211 1.00 52.41 H new ATOM 0 HA3 GLY A 429 5.914 -12.529 -10.189 1.00 52.41 H new ATOM 557 N ASN A 430 3.449 -13.454 -9.047 1.00 63.22 N ATOM 558 CA ASN A 430 2.147 -13.505 -8.243 1.00 72.12 C ATOM 559 C ASN A 430 1.891 -12.197 -7.337 1.00 52.40 C ATOM 560 O ASN A 430 2.853 -11.707 -6.737 1.00 3.33 O ATOM 561 CB ASN A 430 2.241 -14.775 -7.326 1.00 32.13 C ATOM 562 CG ASN A 430 0.943 -15.199 -6.622 1.00 63.13 C ATOM 563 OD1 ASN A 430 0.640 -14.724 -5.533 1.00 54.42 O ATOM 564 ND2 ASN A 430 0.193 -16.144 -7.212 1.00 73.24 N ATOM 0 H ASN A 430 4.122 -14.160 -8.748 1.00 63.22 H new ATOM 0 HA ASN A 430 1.308 -13.545 -8.937 1.00 72.12 H new ATOM 0 HB2 ASN A 430 2.591 -15.611 -7.932 1.00 32.13 H new ATOM 0 HB3 ASN A 430 3.000 -14.593 -6.565 1.00 32.13 H new ATOM 0 HD21 ASN A 430 -0.652 -16.484 -6.754 1.00 73.24 H new ATOM 0 HD22 ASN A 430 0.469 -16.522 -8.118 1.00 73.24 H new ATOM 571 N VAL A 431 0.612 -11.620 -7.235 1.00 3.24 N ATOM 572 CA VAL A 431 0.269 -10.571 -6.175 1.00 11.33 C ATOM 573 C VAL A 431 -0.261 -11.303 -4.893 1.00 72.24 C ATOM 574 O VAL A 431 -0.906 -12.346 -5.035 1.00 63.33 O ATOM 575 CB VAL A 431 -0.855 -9.483 -6.535 1.00 5.14 C ATOM 576 CG1 VAL A 431 -0.547 -8.573 -7.728 1.00 65.43 C ATOM 577 CG2 VAL A 431 -2.275 -10.052 -6.677 1.00 72.24 C ATOM 0 H VAL A 431 -0.165 -11.857 -7.852 1.00 3.24 H new ATOM 0 HA VAL A 431 1.206 -10.025 -6.060 1.00 11.33 H new ATOM 0 HB VAL A 431 -0.823 -8.857 -5.643 1.00 5.14 H new ATOM 0 HG11 VAL A 431 -1.374 -7.879 -7.879 1.00 65.43 H new ATOM 0 HG12 VAL A 431 0.366 -8.012 -7.531 1.00 65.43 H new ATOM 0 HG13 VAL A 431 -0.414 -9.180 -8.624 1.00 65.43 H new ATOM 0 HG21 VAL A 431 -2.967 -9.246 -6.921 1.00 72.24 H new ATOM 0 HG22 VAL A 431 -2.291 -10.797 -7.473 1.00 72.24 H new ATOM 0 HG23 VAL A 431 -2.576 -10.518 -5.738 1.00 72.24 H new ATOM 587 N ILE A 432 0.018 -10.840 -3.639 1.00 21.25 N ATOM 588 CA ILE A 432 -0.886 -11.310 -2.496 1.00 62.40 C ATOM 589 C ILE A 432 -1.626 -10.138 -1.777 1.00 22.24 C ATOM 590 O ILE A 432 -2.835 -10.254 -1.568 1.00 1.13 O ATOM 591 CB ILE A 432 -0.362 -12.436 -1.448 1.00 74.12 C ATOM 592 CG1 ILE A 432 0.904 -13.197 -1.900 1.00 72.32 C ATOM 593 CG2 ILE A 432 -1.435 -13.536 -1.279 1.00 1.00 C ATOM 594 CD1 ILE A 432 1.370 -14.356 -0.954 1.00 51.33 C ATOM 0 H ILE A 432 0.776 -10.206 -3.387 1.00 21.25 H new ATOM 0 HA ILE A 432 -1.596 -11.900 -3.076 1.00 62.40 H new ATOM 0 HB ILE A 432 -0.146 -11.875 -0.539 1.00 74.12 H new ATOM 0 HG12 ILE A 432 0.722 -13.612 -2.891 1.00 72.32 H new ATOM 0 HG13 ILE A 432 1.721 -12.482 -1.999 1.00 72.32 H new ATOM 0 HG21 ILE A 432 -1.078 -14.288 -0.575 1.00 1.00 H new ATOM 0 HG22 ILE A 432 -2.355 -13.092 -0.899 1.00 1.00 H new ATOM 0 HG23 ILE A 432 -1.630 -14.005 -2.243 1.00 1.00 H new ATOM 0 HD11 ILE A 432 2.265 -14.823 -1.364 1.00 51.33 H new ATOM 0 HD12 ILE A 432 1.591 -13.952 0.034 1.00 51.33 H new ATOM 0 HD13 ILE A 432 0.578 -15.100 -0.873 1.00 51.33 H new ATOM 606 N SER A 433 -0.945 -9.008 -1.399 1.00 3.43 N ATOM 607 CA SER A 433 -1.677 -7.871 -0.682 1.00 14.40 C ATOM 608 C SER A 433 -1.077 -6.434 -0.965 1.00 24.14 C ATOM 609 O SER A 433 0.151 -6.321 -1.025 1.00 2.30 O ATOM 610 CB SER A 433 -1.719 -8.112 0.872 1.00 22.44 C ATOM 611 OG SER A 433 -2.669 -9.108 1.204 1.00 54.34 O ATOM 0 H SER A 433 0.050 -8.849 -1.559 1.00 3.43 H new ATOM 0 HA SER A 433 -2.685 -7.885 -1.095 1.00 14.40 H new ATOM 0 HB2 SER A 433 -0.732 -8.413 1.224 1.00 22.44 H new ATOM 0 HB3 SER A 433 -1.969 -7.181 1.382 1.00 22.44 H new ATOM 0 HG SER A 433 -2.969 -9.559 0.387 1.00 54.34 H new ATOM 617 N ALA A 434 -1.926 -5.329 -1.153 1.00 3.24 N ATOM 618 CA ALA A 434 -1.385 -3.920 -1.223 1.00 73.41 C ATOM 619 C ALA A 434 -2.083 -2.900 -0.323 1.00 61.23 C ATOM 620 O ALA A 434 -3.302 -2.943 -0.138 1.00 0.42 O ATOM 621 CB ALA A 434 -1.474 -3.378 -2.624 1.00 0.12 C ATOM 0 H ALA A 434 -2.939 -5.398 -1.253 1.00 3.24 H new ATOM 0 HA ALA A 434 -0.358 -4.031 -0.875 1.00 73.41 H new ATOM 0 HB1 ALA A 434 -1.078 -2.363 -2.647 1.00 0.12 H new ATOM 0 HB2 ALA A 434 -0.893 -4.009 -3.296 1.00 0.12 H new ATOM 0 HB3 ALA A 434 -2.516 -3.369 -2.945 1.00 0.12 H new ATOM 627 N LYS A 435 -1.262 -1.976 0.241 1.00 41.32 N ATOM 628 CA LYS A 435 -1.738 -0.720 0.854 1.00 44.34 C ATOM 629 C LYS A 435 -0.594 0.326 0.832 1.00 22.52 C ATOM 630 O LYS A 435 0.495 0.036 1.341 1.00 11.31 O ATOM 631 CB LYS A 435 -2.240 -0.911 2.320 1.00 53.13 C ATOM 632 CG LYS A 435 -1.874 -2.257 2.975 1.00 2.33 C ATOM 633 CD LYS A 435 -2.101 -2.275 4.476 1.00 2.51 C ATOM 634 CE LYS A 435 -1.189 -1.293 5.197 1.00 32.22 C ATOM 635 NZ LYS A 435 -1.306 -1.426 6.663 1.00 2.03 N ATOM 0 H LYS A 435 -0.249 -2.087 0.280 1.00 41.32 H new ATOM 0 HA LYS A 435 -2.589 -0.376 0.267 1.00 44.34 H new ATOM 0 HB2 LYS A 435 -1.834 -0.106 2.933 1.00 53.13 H new ATOM 0 HB3 LYS A 435 -3.325 -0.804 2.331 1.00 53.13 H new ATOM 0 HG2 LYS A 435 -2.465 -3.049 2.516 1.00 2.33 H new ATOM 0 HG3 LYS A 435 -0.827 -2.480 2.770 1.00 2.33 H new ATOM 0 HD2 LYS A 435 -3.141 -2.029 4.689 1.00 2.51 H new ATOM 0 HD3 LYS A 435 -1.927 -3.281 4.858 1.00 2.51 H new ATOM 0 HE2 LYS A 435 -0.156 -1.465 4.896 1.00 32.22 H new ATOM 0 HE3 LYS A 435 -1.442 -0.275 4.901 1.00 32.22 H new ATOM 0 HZ1 LYS A 435 -0.672 -0.743 7.125 1.00 2.03 H new ATOM 0 HZ2 LYS A 435 -2.287 -1.238 6.951 1.00 2.03 H new ATOM 0 HZ3 LYS A 435 -1.041 -2.391 6.946 1.00 2.03 H new ATOM 649 N VAL A 436 -0.822 1.524 0.244 1.00 40.23 N ATOM 650 CA VAL A 436 0.157 2.636 0.362 1.00 43.24 C ATOM 651 C VAL A 436 -0.210 3.372 1.626 1.00 44.13 C ATOM 652 O VAL A 436 -1.366 3.782 1.738 1.00 53.23 O ATOM 653 CB VAL A 436 0.139 3.705 -0.819 1.00 15.13 C ATOM 654 CG1 VAL A 436 1.556 4.085 -1.257 1.00 23.20 C ATOM 655 CG2 VAL A 436 -0.698 3.301 -2.031 1.00 73.52 C ATOM 0 H VAL A 436 -1.653 1.745 -0.304 1.00 40.23 H new ATOM 0 HA VAL A 436 1.151 2.189 0.343 1.00 43.24 H new ATOM 0 HB VAL A 436 -0.354 4.577 -0.390 1.00 15.13 H new ATOM 0 HG11 VAL A 436 1.504 4.816 -2.064 1.00 23.20 H new ATOM 0 HG12 VAL A 436 2.095 4.515 -0.413 1.00 23.20 H new ATOM 0 HG13 VAL A 436 2.080 3.195 -1.607 1.00 23.20 H new ATOM 0 HG21 VAL A 436 -0.652 4.088 -2.784 1.00 73.52 H new ATOM 0 HG22 VAL A 436 -0.307 2.374 -2.451 1.00 73.52 H new ATOM 0 HG23 VAL A 436 -1.733 3.152 -1.725 1.00 73.52 H new ATOM 665 N PHE A 437 0.702 3.523 2.617 1.00 72.45 N ATOM 666 CA PHE A 437 0.321 4.310 3.763 1.00 43.45 C ATOM 667 C PHE A 437 0.452 5.794 3.415 1.00 61.35 C ATOM 668 O PHE A 437 1.531 6.389 3.501 1.00 72.14 O ATOM 669 CB PHE A 437 1.199 3.903 4.953 1.00 0.23 C ATOM 670 CG PHE A 437 0.451 3.756 6.255 1.00 0.42 C ATOM 671 CD1 PHE A 437 -0.622 2.881 6.356 1.00 20.10 C ATOM 672 CD2 PHE A 437 0.806 4.501 7.371 1.00 43.34 C ATOM 673 CE1 PHE A 437 -1.323 2.750 7.532 1.00 23.41 C ATOM 674 CE2 PHE A 437 0.102 4.375 8.555 1.00 14.53 C ATOM 675 CZ PHE A 437 -0.966 3.499 8.634 1.00 64.05 C ATOM 0 H PHE A 437 1.643 3.129 2.631 1.00 72.45 H new ATOM 0 HA PHE A 437 -0.718 4.131 4.041 1.00 43.45 H new ATOM 0 HB2 PHE A 437 1.690 2.958 4.721 1.00 0.23 H new ATOM 0 HB3 PHE A 437 1.985 4.647 5.081 1.00 0.23 H new ATOM 0 HD1 PHE A 437 -0.911 2.294 5.497 1.00 20.10 H new ATOM 0 HD2 PHE A 437 1.640 5.185 7.314 1.00 43.34 H new ATOM 0 HE1 PHE A 437 -2.153 2.061 7.593 1.00 23.41 H new ATOM 0 HE2 PHE A 437 0.386 4.960 9.417 1.00 14.53 H new ATOM 0 HZ PHE A 437 -1.519 3.402 9.557 1.00 64.05 H new ATOM 685 N ILE A 438 -0.665 6.343 2.939 1.00 23.34 N ATOM 686 CA ILE A 438 -0.852 7.781 2.804 1.00 2.12 C ATOM 687 C ILE A 438 -2.302 8.094 3.249 1.00 62.13 C ATOM 688 O ILE A 438 -3.240 7.541 2.661 1.00 54.04 O ATOM 689 CB ILE A 438 -0.484 8.323 1.311 1.00 32.32 C ATOM 690 CG1 ILE A 438 -0.607 9.875 1.229 1.00 11.44 C ATOM 691 CG2 ILE A 438 -1.272 7.646 0.144 1.00 55.04 C ATOM 692 CD1 ILE A 438 -0.287 10.483 -0.140 1.00 62.23 C ATOM 0 H ILE A 438 -1.470 5.795 2.635 1.00 23.34 H new ATOM 0 HA ILE A 438 -0.156 8.322 3.445 1.00 2.12 H new ATOM 0 HB ILE A 438 0.555 8.028 1.162 1.00 32.32 H new ATOM 0 HG12 ILE A 438 -1.622 10.158 1.506 1.00 11.44 H new ATOM 0 HG13 ILE A 438 0.060 10.316 1.970 1.00 11.44 H new ATOM 0 HG21 ILE A 438 -0.955 8.076 -0.806 1.00 55.04 H new ATOM 0 HG22 ILE A 438 -1.071 6.575 0.143 1.00 55.04 H new ATOM 0 HG23 ILE A 438 -2.340 7.815 0.280 1.00 55.04 H new ATOM 0 HD11 ILE A 438 -0.402 11.566 -0.093 1.00 62.23 H new ATOM 0 HD12 ILE A 438 0.739 10.238 -0.416 1.00 62.23 H new ATOM 0 HD13 ILE A 438 -0.970 10.078 -0.887 1.00 62.23 H new ATOM 704 N ASP A 439 -2.498 8.834 4.384 1.00 0.04 N ATOM 705 CA ASP A 439 -3.786 9.451 4.687 1.00 30.01 C ATOM 706 C ASP A 439 -4.232 10.357 3.499 1.00 0.11 C ATOM 707 O ASP A 439 -3.710 11.465 3.350 1.00 51.21 O ATOM 708 CB ASP A 439 -3.625 10.202 6.044 1.00 31.12 C ATOM 709 CG ASP A 439 -3.424 9.233 7.200 1.00 42.52 C ATOM 710 OD1 ASP A 439 -4.320 8.403 7.455 1.00 52.21 O ATOM 711 OD2 ASP A 439 -2.338 9.272 7.817 1.00 62.44 O ATOM 0 H ASP A 439 -1.776 9.004 5.084 1.00 0.04 H new ATOM 0 HA ASP A 439 -4.586 8.719 4.800 1.00 30.01 H new ATOM 0 HB2 ASP A 439 -2.775 10.881 5.986 1.00 31.12 H new ATOM 0 HB3 ASP A 439 -4.509 10.813 6.230 1.00 31.12 H new ATOM 716 N LYS A 440 -5.172 9.847 2.615 1.00 72.11 N ATOM 717 CA LYS A 440 -5.451 10.485 1.289 1.00 75.12 C ATOM 718 C LYS A 440 -6.011 11.921 1.370 1.00 31.22 C ATOM 719 O LYS A 440 -5.831 12.683 0.429 1.00 10.25 O ATOM 720 CB LYS A 440 -6.396 9.657 0.364 1.00 50.42 C ATOM 721 CG LYS A 440 -5.863 8.302 -0.144 1.00 54.20 C ATOM 722 CD LYS A 440 -6.213 7.129 0.783 1.00 31.41 C ATOM 723 CE LYS A 440 -5.927 5.790 0.111 1.00 14.34 C ATOM 724 NZ LYS A 440 -6.303 4.639 0.973 1.00 42.50 N ATOM 0 H LYS A 440 -5.731 9.015 2.803 1.00 72.11 H new ATOM 0 HA LYS A 440 -4.454 10.519 0.849 1.00 75.12 H new ATOM 0 HB2 LYS A 440 -7.325 9.475 0.904 1.00 50.42 H new ATOM 0 HB3 LYS A 440 -6.645 10.270 -0.502 1.00 50.42 H new ATOM 0 HG2 LYS A 440 -6.271 8.107 -1.136 1.00 54.20 H new ATOM 0 HG3 LYS A 440 -4.780 8.362 -0.251 1.00 54.20 H new ATOM 0 HD2 LYS A 440 -5.637 7.206 1.705 1.00 31.41 H new ATOM 0 HD3 LYS A 440 -7.266 7.182 1.060 1.00 31.41 H new ATOM 0 HE2 LYS A 440 -6.476 5.732 -0.829 1.00 14.34 H new ATOM 0 HE3 LYS A 440 -4.867 5.727 -0.134 1.00 14.34 H new ATOM 0 HZ1 LYS A 440 -6.091 3.750 0.477 1.00 42.50 H new ATOM 0 HZ2 LYS A 440 -5.761 4.678 1.860 1.00 42.50 H new ATOM 0 HZ3 LYS A 440 -7.320 4.683 1.186 1.00 42.50 H new ATOM 738 N GLN A 441 -6.671 12.299 2.488 1.00 71.11 N ATOM 739 CA GLN A 441 -7.237 13.664 2.670 1.00 3.35 C ATOM 740 C GLN A 441 -6.142 14.748 2.902 1.00 74.01 C ATOM 741 O GLN A 441 -6.470 15.936 2.978 1.00 42.05 O ATOM 742 CB GLN A 441 -8.324 13.728 3.824 1.00 60.41 C ATOM 743 CG GLN A 441 -9.578 12.823 3.665 1.00 22.33 C ATOM 744 CD GLN A 441 -9.347 11.349 4.025 1.00 64.52 C ATOM 745 OE1 GLN A 441 -9.480 10.961 5.182 1.00 55.33 O ATOM 746 NE2 GLN A 441 -9.026 10.514 3.033 1.00 3.13 N ATOM 0 H GLN A 441 -6.827 11.679 3.283 1.00 71.11 H new ATOM 0 HA GLN A 441 -7.735 13.890 1.727 1.00 3.35 H new ATOM 0 HB2 GLN A 441 -7.836 13.468 4.763 1.00 60.41 H new ATOM 0 HB3 GLN A 441 -8.661 14.761 3.915 1.00 60.41 H new ATOM 0 HG2 GLN A 441 -10.377 13.217 4.293 1.00 22.33 H new ATOM 0 HG3 GLN A 441 -9.925 12.882 2.633 1.00 22.33 H new ATOM 0 HE21 GLN A 441 -8.923 10.868 2.082 1.00 3.13 H new ATOM 0 HE22 GLN A 441 -8.884 9.523 3.227 1.00 3.13 H new ATOM 755 N THR A 442 -4.857 14.343 3.013 1.00 51.32 N ATOM 756 CA THR A 442 -3.900 15.045 3.841 1.00 75.45 C ATOM 757 C THR A 442 -2.531 15.233 3.132 1.00 1.33 C ATOM 758 O THR A 442 -1.902 16.267 3.361 1.00 74.23 O ATOM 759 CB THR A 442 -3.846 14.308 5.226 1.00 33.13 C ATOM 760 OG1 THR A 442 -4.723 14.970 6.140 1.00 1.20 O ATOM 761 CG2 THR A 442 -2.454 14.201 5.855 1.00 41.41 C ATOM 0 H THR A 442 -4.476 13.529 2.531 1.00 51.32 H new ATOM 0 HA THR A 442 -4.214 16.073 4.022 1.00 75.45 H new ATOM 0 HB THR A 442 -4.156 13.282 5.026 1.00 33.13 H new ATOM 0 HG1 THR A 442 -4.696 14.514 7.007 1.00 1.20 H new ATOM 0 HG21 THR A 442 -2.525 13.676 6.808 1.00 41.41 H new ATOM 0 HG22 THR A 442 -1.793 13.650 5.185 1.00 41.41 H new ATOM 0 HG23 THR A 442 -2.052 15.200 6.020 1.00 41.41 H new ATOM 769 N ASN A 443 -2.106 14.263 2.233 1.00 44.05 N ATOM 770 CA ASN A 443 -0.917 14.397 1.331 1.00 21.41 C ATOM 771 C ASN A 443 0.358 14.926 2.031 1.00 75.15 C ATOM 772 O ASN A 443 0.958 15.928 1.632 1.00 3.11 O ATOM 773 CB ASN A 443 -1.240 15.148 -0.008 1.00 44.53 C ATOM 774 CG ASN A 443 -2.009 16.480 0.128 1.00 31.25 C ATOM 775 OD1 ASN A 443 -3.241 16.505 0.074 1.00 71.31 O ATOM 776 ND2 ASN A 443 -1.286 17.586 0.305 1.00 24.44 N ATOM 0 H ASN A 443 -2.588 13.371 2.124 1.00 44.05 H new ATOM 0 HA ASN A 443 -0.671 13.373 1.050 1.00 21.41 H new ATOM 0 HB2 ASN A 443 -0.301 15.345 -0.526 1.00 44.53 H new ATOM 0 HB3 ASN A 443 -1.821 14.480 -0.644 1.00 44.53 H new ATOM 0 HD21 ASN A 443 -1.750 18.489 0.401 1.00 24.44 H new ATOM 0 HD22 ASN A 443 -0.268 17.529 0.345 1.00 24.44 H new ATOM 783 N LEU A 444 0.770 14.207 3.076 1.00 33.53 N ATOM 784 CA LEU A 444 2.029 14.516 3.788 1.00 40.22 C ATOM 785 C LEU A 444 3.150 13.705 3.064 1.00 20.10 C ATOM 786 O LEU A 444 2.861 12.561 2.684 1.00 31.25 O ATOM 787 CB LEU A 444 1.866 14.218 5.372 1.00 31.45 C ATOM 788 CG LEU A 444 2.155 12.789 5.967 1.00 64.14 C ATOM 789 CD1 LEU A 444 3.640 12.449 6.089 1.00 62.33 C ATOM 790 CD2 LEU A 444 1.537 12.652 7.344 1.00 23.43 C ATOM 0 H LEU A 444 0.259 13.409 3.453 1.00 33.53 H new ATOM 0 HA LEU A 444 2.300 15.571 3.750 1.00 40.22 H new ATOM 0 HB2 LEU A 444 2.516 14.918 5.896 1.00 31.45 H new ATOM 0 HB3 LEU A 444 0.841 14.473 5.640 1.00 31.45 H new ATOM 0 HG LEU A 444 1.711 12.095 5.254 1.00 64.14 H new ATOM 0 HD11 LEU A 444 3.751 11.448 6.507 1.00 62.33 H new ATOM 0 HD12 LEU A 444 4.103 12.484 5.103 1.00 62.33 H new ATOM 0 HD13 LEU A 444 4.126 13.172 6.744 1.00 62.33 H new ATOM 0 HD21 LEU A 444 1.747 11.658 7.740 1.00 23.43 H new ATOM 0 HD22 LEU A 444 1.960 13.404 8.009 1.00 23.43 H new ATOM 0 HD23 LEU A 444 0.459 12.795 7.275 1.00 23.43 H new ATOM 802 N SER A 445 4.383 14.292 2.750 1.00 31.30 N ATOM 803 CA SER A 445 5.441 13.518 2.028 1.00 52.55 C ATOM 804 C SER A 445 5.779 12.186 2.728 1.00 3.43 C ATOM 805 O SER A 445 6.326 12.174 3.840 1.00 44.34 O ATOM 806 CB SER A 445 6.723 14.365 1.865 1.00 60.31 C ATOM 807 OG SER A 445 7.046 15.043 3.061 1.00 24.12 O ATOM 0 H SER A 445 4.639 15.252 2.982 1.00 31.30 H new ATOM 0 HA SER A 445 5.036 13.279 1.044 1.00 52.55 H new ATOM 0 HB2 SER A 445 7.553 13.720 1.574 1.00 60.31 H new ATOM 0 HB3 SER A 445 6.584 15.088 1.061 1.00 60.31 H new ATOM 0 HG SER A 445 6.971 14.425 3.818 1.00 24.12 H new ATOM 813 N LYS A 446 5.483 11.060 2.037 1.00 13.41 N ATOM 814 CA LYS A 446 5.601 9.726 2.606 1.00 74.11 C ATOM 815 C LYS A 446 5.430 8.706 1.466 1.00 51.54 C ATOM 816 O LYS A 446 6.430 8.271 0.893 1.00 44.22 O ATOM 817 CB LYS A 446 4.558 9.506 3.734 1.00 64.31 C ATOM 818 CG LYS A 446 5.063 8.641 4.880 1.00 23.52 C ATOM 819 CD LYS A 446 3.968 7.742 5.457 1.00 72.24 C ATOM 820 CE LYS A 446 2.876 8.511 6.196 1.00 3.12 C ATOM 821 NZ LYS A 446 3.286 8.893 7.577 1.00 32.30 N ATOM 0 H LYS A 446 5.157 11.067 1.071 1.00 13.41 H new ATOM 0 HA LYS A 446 6.581 9.599 3.065 1.00 74.11 H new ATOM 0 HB2 LYS A 446 4.255 10.475 4.130 1.00 64.31 H new ATOM 0 HB3 LYS A 446 3.668 9.044 3.307 1.00 64.31 H new ATOM 0 HG2 LYS A 446 5.889 8.023 4.529 1.00 23.52 H new ATOM 0 HG3 LYS A 446 5.457 9.281 5.669 1.00 23.52 H new ATOM 0 HD2 LYS A 446 3.514 7.170 4.648 1.00 72.24 H new ATOM 0 HD3 LYS A 446 4.421 7.023 6.140 1.00 72.24 H new ATOM 0 HE2 LYS A 446 2.624 9.410 5.633 1.00 3.12 H new ATOM 0 HE3 LYS A 446 1.974 7.901 6.243 1.00 3.12 H new ATOM 0 HZ1 LYS A 446 2.512 9.413 8.038 1.00 32.30 H new ATOM 0 HZ2 LYS A 446 3.502 8.036 8.125 1.00 32.30 H new ATOM 0 HZ3 LYS A 446 4.131 9.498 7.534 1.00 32.30 H new ATOM 835 N CYS A 447 4.148 8.411 1.098 1.00 21.04 N ATOM 836 CA CYS A 447 3.763 7.499 -0.013 1.00 64.32 C ATOM 837 C CYS A 447 4.451 6.127 0.105 1.00 45.12 C ATOM 838 O CYS A 447 4.986 5.618 -0.874 1.00 54.33 O ATOM 839 CB CYS A 447 4.063 8.138 -1.395 1.00 14.12 C ATOM 840 SG CYS A 447 3.594 9.889 -1.515 1.00 55.24 S ATOM 0 H CYS A 447 3.341 8.810 1.577 1.00 21.04 H new ATOM 0 HA CYS A 447 2.688 7.339 0.067 1.00 64.32 H new ATOM 0 HB2 CYS A 447 5.128 8.042 -1.605 1.00 14.12 H new ATOM 0 HB3 CYS A 447 3.535 7.577 -2.166 1.00 14.12 H new ATOM 0 HG CYS A 447 3.884 10.336 -2.701 1.00 55.24 H new ATOM 846 N PHE A 448 4.377 5.509 1.290 1.00 55.02 N ATOM 847 CA PHE A 448 5.276 4.397 1.620 1.00 31.32 C ATOM 848 C PHE A 448 4.489 3.059 1.750 1.00 34.13 C ATOM 849 O PHE A 448 3.574 2.952 2.563 1.00 4.04 O ATOM 850 CB PHE A 448 6.025 4.802 2.928 1.00 61.24 C ATOM 851 CG PHE A 448 7.532 4.684 2.877 1.00 0.14 C ATOM 852 CD1 PHE A 448 8.177 3.507 3.239 1.00 55.24 C ATOM 853 CD2 PHE A 448 8.311 5.769 2.481 1.00 45.55 C ATOM 854 CE1 PHE A 448 9.559 3.417 3.203 1.00 64.10 C ATOM 855 CE2 PHE A 448 9.689 5.680 2.446 1.00 0.10 C ATOM 856 CZ PHE A 448 10.312 4.504 2.806 1.00 24.25 C ATOM 0 H PHE A 448 3.715 5.755 2.026 1.00 55.02 H new ATOM 0 HA PHE A 448 6.002 4.217 0.827 1.00 31.32 H new ATOM 0 HB2 PHE A 448 5.766 5.833 3.170 1.00 61.24 H new ATOM 0 HB3 PHE A 448 5.657 4.181 3.744 1.00 61.24 H new ATOM 0 HD1 PHE A 448 7.594 2.653 3.552 1.00 55.24 H new ATOM 0 HD2 PHE A 448 7.830 6.694 2.197 1.00 45.55 H new ATOM 0 HE1 PHE A 448 10.048 2.496 3.486 1.00 64.10 H new ATOM 0 HE2 PHE A 448 10.278 6.531 2.137 1.00 0.10 H new ATOM 0 HZ PHE A 448 11.389 4.433 2.777 1.00 24.25 H new ATOM 866 N GLY A 449 4.877 2.041 0.953 1.00 3.33 N ATOM 867 CA GLY A 449 4.121 0.725 0.897 1.00 44.24 C ATOM 868 C GLY A 449 5.013 -0.535 0.838 1.00 21.22 C ATOM 869 O GLY A 449 6.223 -0.402 0.741 1.00 45.10 O ATOM 0 H GLY A 449 5.692 2.081 0.341 1.00 3.33 H new ATOM 0 HA2 GLY A 449 3.476 0.655 1.773 1.00 44.24 H new ATOM 0 HA3 GLY A 449 3.470 0.733 0.022 1.00 44.24 H new ATOM 873 N PHE A 450 4.390 -1.764 0.909 1.00 33.23 N ATOM 874 CA PHE A 450 5.115 -3.082 0.846 1.00 53.22 C ATOM 875 C PHE A 450 4.206 -4.191 0.235 1.00 34.51 C ATOM 876 O PHE A 450 2.981 -4.025 0.249 1.00 53.44 O ATOM 877 CB PHE A 450 5.685 -3.494 2.239 1.00 12.43 C ATOM 878 CG PHE A 450 4.761 -3.324 3.447 1.00 3.42 C ATOM 879 CD1 PHE A 450 3.754 -4.246 3.738 1.00 40.22 C ATOM 880 CD2 PHE A 450 4.917 -2.234 4.307 1.00 44.22 C ATOM 881 CE1 PHE A 450 2.937 -4.081 4.843 1.00 61.30 C ATOM 882 CE2 PHE A 450 4.097 -2.073 5.410 1.00 13.11 C ATOM 883 CZ PHE A 450 3.110 -2.996 5.675 1.00 12.31 C ATOM 0 H PHE A 450 3.380 -1.865 1.011 1.00 33.23 H new ATOM 0 HA PHE A 450 5.971 -2.960 0.182 1.00 53.22 H new ATOM 0 HB2 PHE A 450 5.984 -4.541 2.186 1.00 12.43 H new ATOM 0 HB3 PHE A 450 6.589 -2.913 2.420 1.00 12.43 H new ATOM 0 HD1 PHE A 450 3.610 -5.100 3.092 1.00 40.22 H new ATOM 0 HD2 PHE A 450 5.689 -1.506 4.108 1.00 44.22 H new ATOM 0 HE1 PHE A 450 2.163 -4.804 5.054 1.00 61.30 H new ATOM 0 HE2 PHE A 450 4.231 -1.223 6.063 1.00 13.11 H new ATOM 0 HZ PHE A 450 2.471 -2.869 6.536 1.00 12.31 H new ATOM 893 N VAL A 451 4.769 -5.327 -0.311 1.00 74.44 N ATOM 894 CA VAL A 451 3.905 -6.283 -1.086 1.00 54.42 C ATOM 895 C VAL A 451 4.502 -7.729 -1.106 1.00 22.34 C ATOM 896 O VAL A 451 5.690 -7.905 -0.826 1.00 42.31 O ATOM 897 CB VAL A 451 3.597 -5.675 -2.541 1.00 61.44 C ATOM 898 CG1 VAL A 451 4.856 -5.423 -3.348 1.00 24.22 C ATOM 899 CG2 VAL A 451 2.633 -6.487 -3.420 1.00 74.13 C ATOM 0 H VAL A 451 5.752 -5.588 -0.235 1.00 74.44 H new ATOM 0 HA VAL A 451 2.946 -6.396 -0.580 1.00 54.42 H new ATOM 0 HB VAL A 451 3.098 -4.739 -2.290 1.00 61.44 H new ATOM 0 HG11 VAL A 451 4.588 -5.013 -4.322 1.00 24.22 H new ATOM 0 HG12 VAL A 451 5.492 -4.714 -2.818 1.00 24.22 H new ATOM 0 HG13 VAL A 451 5.394 -6.361 -3.485 1.00 24.22 H new ATOM 0 HG21 VAL A 451 2.500 -5.982 -4.377 1.00 74.13 H new ATOM 0 HG22 VAL A 451 3.045 -7.482 -3.589 1.00 74.13 H new ATOM 0 HG23 VAL A 451 1.669 -6.574 -2.919 1.00 74.13 H new ATOM 909 N SER A 452 3.653 -8.767 -1.386 1.00 60.31 N ATOM 910 CA SER A 452 4.007 -10.164 -1.191 1.00 72.21 C ATOM 911 C SER A 452 4.245 -10.854 -2.556 1.00 74.32 C ATOM 912 O SER A 452 3.315 -10.906 -3.363 1.00 4.30 O ATOM 913 CB SER A 452 2.835 -10.825 -0.400 1.00 62.30 C ATOM 914 OG SER A 452 2.828 -10.404 0.953 1.00 55.05 O ATOM 0 H SER A 452 2.711 -8.632 -1.752 1.00 60.31 H new ATOM 0 HA SER A 452 4.935 -10.265 -0.629 1.00 72.21 H new ATOM 0 HB2 SER A 452 1.885 -10.567 -0.869 1.00 62.30 H new ATOM 0 HB3 SER A 452 2.928 -11.910 -0.445 1.00 62.30 H new ATOM 0 HG SER A 452 2.319 -9.571 1.034 1.00 55.05 H new ATOM 920 N TYR A 453 5.487 -11.378 -2.829 1.00 71.33 N ATOM 921 CA TYR A 453 5.789 -12.021 -4.131 1.00 41.30 C ATOM 922 C TYR A 453 6.238 -13.485 -3.847 1.00 35.30 C ATOM 923 O TYR A 453 7.050 -13.631 -2.926 1.00 14.52 O ATOM 924 CB TYR A 453 6.908 -11.109 -4.763 1.00 52.54 C ATOM 925 CG TYR A 453 6.874 -10.690 -6.244 1.00 65.42 C ATOM 926 CD1 TYR A 453 5.841 -9.951 -6.823 1.00 25.11 C ATOM 927 CD2 TYR A 453 7.982 -10.907 -7.026 1.00 42.51 C ATOM 928 CE1 TYR A 453 5.957 -9.443 -8.110 1.00 41.14 C ATOM 929 CE2 TYR A 453 8.076 -10.422 -8.319 1.00 44.11 C ATOM 930 CZ TYR A 453 7.062 -9.706 -8.840 1.00 32.24 C ATOM 931 OH TYR A 453 7.185 -9.184 -10.091 1.00 51.23 O ATOM 0 H TYR A 453 6.269 -11.363 -2.174 1.00 71.33 H new ATOM 0 HA TYR A 453 4.952 -12.097 -4.825 1.00 41.30 H new ATOM 0 HB2 TYR A 453 6.935 -10.191 -4.176 1.00 52.54 H new ATOM 0 HB3 TYR A 453 7.858 -11.618 -4.601 1.00 52.54 H new ATOM 0 HD1 TYR A 453 4.937 -9.771 -6.261 1.00 25.11 H new ATOM 0 HD2 TYR A 453 8.806 -11.474 -6.619 1.00 42.51 H new ATOM 0 HE1 TYR A 453 5.165 -8.839 -8.526 1.00 41.14 H new ATOM 0 HE2 TYR A 453 8.960 -10.617 -8.908 1.00 44.11 H new ATOM 0 HH TYR A 453 6.927 -8.239 -10.078 1.00 51.23 H new ATOM 941 N ASP A 454 5.675 -14.565 -4.595 1.00 1.44 N ATOM 942 CA ASP A 454 5.946 -16.030 -4.309 1.00 55.53 C ATOM 943 C ASP A 454 7.281 -16.380 -3.653 1.00 64.51 C ATOM 944 O ASP A 454 7.330 -16.589 -2.441 1.00 32.42 O ATOM 945 CB ASP A 454 5.842 -16.922 -5.559 1.00 13.12 C ATOM 946 CG ASP A 454 4.436 -17.387 -5.860 1.00 22.25 C ATOM 947 OD1 ASP A 454 3.717 -17.768 -4.909 1.00 71.41 O ATOM 948 OD2 ASP A 454 4.051 -17.370 -7.046 1.00 51.54 O ATOM 0 H ASP A 454 5.044 -14.419 -5.383 1.00 1.44 H new ATOM 0 HA ASP A 454 5.154 -16.228 -3.587 1.00 55.53 H new ATOM 0 HB2 ASP A 454 6.225 -16.373 -6.419 1.00 13.12 H new ATOM 0 HB3 ASP A 454 6.483 -17.794 -5.426 1.00 13.12 H new ATOM 953 N ASN A 455 8.348 -16.500 -4.448 1.00 24.41 N ATOM 954 CA ASN A 455 9.627 -16.979 -3.936 1.00 44.41 C ATOM 955 C ASN A 455 10.795 -16.245 -4.613 1.00 23.11 C ATOM 956 O ASN A 455 10.686 -15.929 -5.795 1.00 53.34 O ATOM 957 CB ASN A 455 9.713 -18.488 -4.151 1.00 12.11 C ATOM 958 CG ASN A 455 10.640 -19.200 -3.172 1.00 2.11 C ATOM 959 OD1 ASN A 455 11.817 -19.418 -3.447 1.00 0.15 O ATOM 960 ND2 ASN A 455 10.101 -19.523 -2.002 1.00 64.41 N ATOM 0 H ASN A 455 8.348 -16.273 -5.442 1.00 24.41 H new ATOM 0 HA ASN A 455 9.696 -16.770 -2.868 1.00 44.41 H new ATOM 0 HB2 ASN A 455 8.714 -18.915 -4.066 1.00 12.11 H new ATOM 0 HB3 ASN A 455 10.056 -18.681 -5.167 1.00 12.11 H new ATOM 0 HD21 ASN A 455 10.670 -19.973 -1.285 1.00 64.41 H new ATOM 0 HD22 ASN A 455 9.118 -19.321 -1.820 1.00 64.41 H new ATOM 967 N PRO A 456 11.894 -15.906 -3.841 1.00 72.22 N ATOM 968 CA PRO A 456 13.108 -15.120 -4.270 1.00 22.23 C ATOM 969 C PRO A 456 13.716 -15.188 -5.722 1.00 41.24 C ATOM 970 O PRO A 456 14.550 -14.319 -6.015 1.00 14.52 O ATOM 971 CB PRO A 456 14.187 -15.505 -3.232 1.00 44.02 C ATOM 972 CG PRO A 456 13.518 -16.435 -2.274 1.00 62.54 C ATOM 973 CD PRO A 456 12.054 -16.146 -2.372 1.00 31.42 C ATOM 0 HA PRO A 456 12.754 -14.090 -4.313 1.00 22.23 H new ATOM 0 HB2 PRO A 456 15.039 -15.986 -3.713 1.00 44.02 H new ATOM 0 HB3 PRO A 456 14.568 -14.622 -2.718 1.00 44.02 H new ATOM 0 HG2 PRO A 456 13.728 -17.474 -2.528 1.00 62.54 H new ATOM 0 HG3 PRO A 456 13.880 -16.275 -1.258 1.00 62.54 H new ATOM 0 HD2 PRO A 456 11.447 -16.982 -2.025 1.00 31.42 H new ATOM 0 HD3 PRO A 456 11.767 -15.276 -1.781 1.00 31.42 H new ATOM 981 N VAL A 457 13.351 -16.139 -6.636 1.00 4.22 N ATOM 982 CA VAL A 457 13.868 -16.059 -8.025 1.00 60.34 C ATOM 983 C VAL A 457 13.206 -14.828 -8.757 1.00 75.42 C ATOM 984 O VAL A 457 13.785 -14.254 -9.680 1.00 74.51 O ATOM 985 CB VAL A 457 13.788 -17.437 -8.853 1.00 71.21 C ATOM 986 CG1 VAL A 457 12.390 -18.050 -8.927 1.00 23.33 C ATOM 987 CG2 VAL A 457 14.347 -17.291 -10.268 1.00 61.20 C ATOM 0 H VAL A 457 12.733 -16.928 -6.444 1.00 4.22 H new ATOM 0 HA VAL A 457 14.943 -15.888 -7.969 1.00 60.34 H new ATOM 0 HB VAL A 457 14.411 -18.124 -8.280 1.00 71.21 H new ATOM 0 HG11 VAL A 457 12.428 -18.975 -9.503 1.00 23.33 H new ATOM 0 HG12 VAL A 457 12.033 -18.264 -7.920 1.00 23.33 H new ATOM 0 HG13 VAL A 457 11.710 -17.349 -9.412 1.00 23.33 H new ATOM 0 HG21 VAL A 457 14.272 -18.246 -10.789 1.00 61.20 H new ATOM 0 HG22 VAL A 457 13.776 -16.537 -10.809 1.00 61.20 H new ATOM 0 HG23 VAL A 457 15.392 -16.987 -10.217 1.00 61.20 H new ATOM 997 N SER A 458 12.026 -14.373 -8.269 1.00 21.25 N ATOM 998 CA SER A 458 11.408 -13.154 -8.762 1.00 61.25 C ATOM 999 C SER A 458 11.868 -11.830 -7.998 1.00 13.15 C ATOM 1000 O SER A 458 11.584 -10.756 -8.525 1.00 11.52 O ATOM 1001 CB SER A 458 9.849 -13.348 -8.844 1.00 43.11 C ATOM 1002 OG SER A 458 9.337 -13.781 -7.596 1.00 12.31 O ATOM 0 H SER A 458 11.497 -14.844 -7.535 1.00 21.25 H new ATOM 0 HA SER A 458 11.774 -12.978 -9.773 1.00 61.25 H new ATOM 0 HB2 SER A 458 9.375 -12.410 -9.133 1.00 43.11 H new ATOM 0 HB3 SER A 458 9.608 -14.078 -9.616 1.00 43.11 H new ATOM 0 HG SER A 458 8.646 -13.157 -7.292 1.00 12.31 H new ATOM 1008 N ALA A 459 12.578 -11.850 -6.763 1.00 14.42 N ATOM 1009 CA ALA A 459 13.019 -10.571 -6.112 1.00 52.44 C ATOM 1010 C ALA A 459 14.070 -9.798 -6.906 1.00 34.10 C ATOM 1011 O ALA A 459 13.786 -8.698 -7.359 1.00 20.20 O ATOM 1012 CB ALA A 459 13.525 -10.726 -4.691 1.00 3.21 C ATOM 0 H ALA A 459 12.827 -12.698 -6.254 1.00 14.42 H new ATOM 0 HA ALA A 459 12.091 -10.000 -6.091 1.00 52.44 H new ATOM 0 HB1 ALA A 459 13.821 -9.752 -4.302 1.00 3.21 H new ATOM 0 HB2 ALA A 459 12.734 -11.141 -4.066 1.00 3.21 H new ATOM 0 HB3 ALA A 459 14.384 -11.397 -4.682 1.00 3.21 H new ATOM 1018 N GLN A 460 15.261 -10.375 -7.130 1.00 61.52 N ATOM 1019 CA GLN A 460 16.379 -9.625 -7.684 1.00 32.05 C ATOM 1020 C GLN A 460 16.293 -9.471 -9.225 1.00 22.05 C ATOM 1021 O GLN A 460 16.920 -8.554 -9.762 1.00 52.51 O ATOM 1022 CB GLN A 460 17.736 -10.192 -7.161 1.00 44.55 C ATOM 1023 CG GLN A 460 18.520 -9.201 -6.277 1.00 3.35 C ATOM 1024 CD GLN A 460 19.697 -9.832 -5.540 1.00 52.33 C ATOM 1025 OE1 GLN A 460 20.017 -9.423 -4.428 1.00 31.20 O ATOM 1026 NE2 GLN A 460 20.366 -10.808 -6.147 1.00 41.25 N ATOM 0 H GLN A 460 15.466 -11.355 -6.934 1.00 61.52 H new ATOM 0 HA GLN A 460 16.319 -8.600 -7.318 1.00 32.05 H new ATOM 0 HB2 GLN A 460 17.545 -11.101 -6.591 1.00 44.55 H new ATOM 0 HB3 GLN A 460 18.355 -10.474 -8.013 1.00 44.55 H new ATOM 0 HG2 GLN A 460 18.888 -8.386 -6.900 1.00 3.35 H new ATOM 0 HG3 GLN A 460 17.839 -8.762 -5.547 1.00 3.35 H new ATOM 0 HE21 GLN A 460 20.076 -11.127 -7.072 1.00 41.25 H new ATOM 0 HE22 GLN A 460 21.169 -11.238 -5.688 1.00 41.25 H new ATOM 1035 N ALA A 461 15.513 -10.337 -9.948 1.00 51.33 N ATOM 1036 CA ALA A 461 15.185 -10.056 -11.363 1.00 32.42 C ATOM 1037 C ALA A 461 14.286 -8.722 -11.605 1.00 31.44 C ATOM 1038 O ALA A 461 14.599 -7.995 -12.552 1.00 14.02 O ATOM 1039 CB ALA A 461 14.695 -11.367 -12.099 1.00 2.13 C ATOM 0 H ALA A 461 15.118 -11.202 -9.580 1.00 51.33 H new ATOM 0 HA ALA A 461 16.112 -9.768 -11.858 1.00 32.42 H new ATOM 0 HB1 ALA A 461 14.460 -11.135 -13.138 1.00 2.13 H new ATOM 0 HB2 ALA A 461 15.483 -12.120 -12.065 1.00 2.13 H new ATOM 0 HB3 ALA A 461 13.804 -11.752 -11.603 1.00 2.13 H new ATOM 1045 N ALA A 462 13.191 -8.359 -10.794 1.00 72.24 N ATOM 1046 CA ALA A 462 12.487 -6.999 -10.927 1.00 63.45 C ATOM 1047 C ALA A 462 13.108 -5.830 -10.090 1.00 70.42 C ATOM 1048 O ALA A 462 13.080 -4.696 -10.577 1.00 54.31 O ATOM 1049 CB ALA A 462 10.992 -7.116 -10.617 1.00 53.12 C ATOM 0 H ALA A 462 12.796 -8.964 -10.074 1.00 72.24 H new ATOM 0 HA ALA A 462 12.641 -6.727 -11.971 1.00 63.45 H new ATOM 0 HB1 ALA A 462 10.522 -6.138 -10.719 1.00 53.12 H new ATOM 0 HB2 ALA A 462 10.530 -7.816 -11.313 1.00 53.12 H new ATOM 0 HB3 ALA A 462 10.859 -7.477 -9.597 1.00 53.12 H new ATOM 1055 N ILE A 463 13.603 -6.090 -8.834 1.00 14.12 N ATOM 1056 CA ILE A 463 14.219 -5.059 -7.920 1.00 3.10 C ATOM 1057 C ILE A 463 15.220 -4.066 -8.658 1.00 61.24 C ATOM 1058 O ILE A 463 15.195 -2.865 -8.371 1.00 4.23 O ATOM 1059 CB ILE A 463 14.822 -5.701 -6.519 1.00 5.21 C ATOM 1060 CG1 ILE A 463 13.797 -5.743 -5.329 1.00 44.43 C ATOM 1061 CG2 ILE A 463 16.070 -4.975 -5.950 1.00 22.24 C ATOM 1062 CD1 ILE A 463 12.368 -6.226 -5.582 1.00 43.45 C ATOM 0 H ILE A 463 13.586 -7.024 -8.424 1.00 14.12 H new ATOM 0 HA ILE A 463 13.390 -4.426 -7.604 1.00 3.10 H new ATOM 0 HB ILE A 463 15.080 -6.705 -6.855 1.00 5.21 H new ATOM 0 HG12 ILE A 463 14.224 -6.378 -4.553 1.00 44.43 H new ATOM 0 HG13 ILE A 463 13.733 -4.736 -4.917 1.00 44.43 H new ATOM 0 HG21 ILE A 463 16.391 -5.468 -5.032 1.00 22.24 H new ATOM 0 HG22 ILE A 463 16.877 -5.010 -6.682 1.00 22.24 H new ATOM 0 HG23 ILE A 463 15.820 -3.936 -5.735 1.00 22.24 H new ATOM 0 HD11 ILE A 463 11.801 -6.189 -4.652 1.00 43.45 H new ATOM 0 HD12 ILE A 463 11.892 -5.583 -6.323 1.00 43.45 H new ATOM 0 HD13 ILE A 463 12.391 -7.251 -5.952 1.00 43.45 H new ATOM 1074 N GLN A 464 16.070 -4.538 -9.625 1.00 24.32 N ATOM 1075 CA GLN A 464 16.967 -3.626 -10.380 1.00 63.20 C ATOM 1076 C GLN A 464 16.406 -3.026 -11.742 1.00 51.13 C ATOM 1077 O GLN A 464 16.842 -1.921 -12.086 1.00 0.41 O ATOM 1078 CB GLN A 464 18.393 -4.240 -10.542 1.00 34.32 C ATOM 1079 CG GLN A 464 19.166 -4.394 -9.220 1.00 74.40 C ATOM 1080 CD GLN A 464 20.237 -5.462 -9.321 1.00 63.41 C ATOM 1081 OE1 GLN A 464 20.829 -5.677 -10.379 1.00 11.02 O ATOM 1082 NE2 GLN A 464 20.465 -6.167 -8.226 1.00 23.11 N ATOM 0 H GLN A 464 16.146 -5.520 -9.889 1.00 24.32 H new ATOM 0 HA GLN A 464 17.027 -2.742 -9.746 1.00 63.20 H new ATOM 0 HB2 GLN A 464 18.304 -5.218 -11.014 1.00 34.32 H new ATOM 0 HB3 GLN A 464 18.973 -3.611 -11.218 1.00 34.32 H new ATOM 0 HG2 GLN A 464 19.625 -3.442 -8.953 1.00 74.40 H new ATOM 0 HG3 GLN A 464 18.472 -4.649 -8.419 1.00 74.40 H new ATOM 0 HE21 GLN A 464 19.953 -5.958 -7.369 1.00 23.11 H new ATOM 0 HE22 GLN A 464 21.153 -6.920 -8.238 1.00 23.11 H new ATOM 1091 N ALA A 465 15.487 -3.710 -12.548 1.00 51.54 N ATOM 1092 CA ALA A 465 14.806 -3.047 -13.746 1.00 3.31 C ATOM 1093 C ALA A 465 13.926 -1.815 -13.369 1.00 64.33 C ATOM 1094 O ALA A 465 13.439 -1.111 -14.254 1.00 53.25 O ATOM 1095 CB ALA A 465 13.962 -4.033 -14.638 1.00 53.54 C ATOM 0 H ALA A 465 15.212 -4.680 -12.395 1.00 51.54 H new ATOM 0 HA ALA A 465 15.652 -2.698 -14.339 1.00 3.31 H new ATOM 0 HB1 ALA A 465 13.513 -3.482 -15.465 1.00 53.54 H new ATOM 0 HB2 ALA A 465 14.612 -4.814 -15.033 1.00 53.54 H new ATOM 0 HB3 ALA A 465 13.175 -4.486 -14.035 1.00 53.54 H new ATOM 1101 N MET A 466 13.736 -1.558 -12.071 1.00 25.15 N ATOM 1102 CA MET A 466 12.819 -0.521 -11.562 1.00 50.31 C ATOM 1103 C MET A 466 13.585 0.545 -10.735 1.00 64.11 C ATOM 1104 O MET A 466 12.970 1.368 -10.053 1.00 13.23 O ATOM 1105 CB MET A 466 11.743 -1.182 -10.671 1.00 31.03 C ATOM 1106 CG MET A 466 10.266 -0.794 -10.965 1.00 24.41 C ATOM 1107 SD MET A 466 9.429 -1.837 -12.192 1.00 44.14 S ATOM 1108 CE MET A 466 10.128 -1.267 -13.734 1.00 53.03 C ATOM 0 H MET A 466 14.219 -2.068 -11.331 1.00 25.15 H new ATOM 0 HA MET A 466 12.352 -0.027 -12.414 1.00 50.31 H new ATOM 0 HB2 MET A 466 11.837 -2.264 -10.767 1.00 31.03 H new ATOM 0 HB3 MET A 466 11.961 -0.934 -9.632 1.00 31.03 H new ATOM 0 HG2 MET A 466 9.703 -0.833 -10.032 1.00 24.41 H new ATOM 0 HG3 MET A 466 10.239 0.240 -11.310 1.00 24.41 H new ATOM 0 HE1 MET A 466 9.396 -1.390 -14.533 1.00 53.03 H new ATOM 0 HE2 MET A 466 10.395 -0.214 -13.645 1.00 53.03 H new ATOM 0 HE3 MET A 466 11.020 -1.849 -13.966 1.00 53.03 H new ATOM 1118 N ASN A 467 14.932 0.515 -10.795 1.00 50.32 N ATOM 1119 CA ASN A 467 15.783 1.365 -9.929 1.00 10.14 C ATOM 1120 C ASN A 467 15.999 2.766 -10.578 1.00 64.53 C ATOM 1121 O ASN A 467 16.732 2.832 -11.570 1.00 64.01 O ATOM 1122 CB ASN A 467 17.143 0.654 -9.670 1.00 53.33 C ATOM 1123 CG ASN A 467 17.906 1.221 -8.444 1.00 44.32 C ATOM 1124 OD1 ASN A 467 17.210 1.648 -7.353 1.00 11.31 O flip ATOM 1125 ND2 ASN A 467 19.131 1.276 -8.463 1.00 24.34 N flip ATOM 0 H ASN A 467 15.455 -0.086 -11.432 1.00 50.32 H new ATOM 0 HA ASN A 467 15.281 1.516 -8.973 1.00 10.14 H new ATOM 0 HB2 ASN A 467 16.966 -0.411 -9.519 1.00 53.33 H new ATOM 0 HB3 ASN A 467 17.770 0.750 -10.556 1.00 53.33 H new ATOM 0 HD21 ASN A 467 19.643 0.954 -9.284 1.00 24.34 H new ATOM 0 HD22 ASN A 467 19.638 1.644 -7.658 1.00 24.34 H new ATOM 1132 N GLY A 468 15.360 3.898 -10.079 1.00 5.41 N ATOM 1133 CA GLY A 468 15.744 5.215 -10.611 1.00 31.22 C ATOM 1134 C GLY A 468 15.091 5.621 -11.947 1.00 64.32 C ATOM 1135 O GLY A 468 15.568 6.546 -12.595 1.00 53.35 O ATOM 0 H GLY A 468 14.634 3.902 -9.363 1.00 5.41 H new ATOM 0 HA2 GLY A 468 15.499 5.971 -9.865 1.00 31.22 H new ATOM 0 HA3 GLY A 468 16.826 5.232 -10.739 1.00 31.22 H new ATOM 1139 N PHE A 469 13.990 4.974 -12.327 1.00 0.14 N ATOM 1140 CA PHE A 469 13.521 4.934 -13.715 1.00 64.43 C ATOM 1141 C PHE A 469 12.421 6.024 -13.839 1.00 70.31 C ATOM 1142 O PHE A 469 11.367 5.886 -13.198 1.00 2.41 O ATOM 1143 CB PHE A 469 13.039 3.443 -14.004 1.00 14.42 C ATOM 1144 CG PHE A 469 12.480 3.126 -15.371 1.00 24.12 C ATOM 1145 CD1 PHE A 469 11.152 3.374 -15.679 1.00 64.22 C ATOM 1146 CD2 PHE A 469 13.275 2.499 -16.329 1.00 0.33 C ATOM 1147 CE1 PHE A 469 10.629 3.019 -16.896 1.00 23.00 C ATOM 1148 CE2 PHE A 469 12.755 2.153 -17.558 1.00 32.31 C ATOM 1149 CZ PHE A 469 11.428 2.412 -17.846 1.00 20.52 C ATOM 0 H PHE A 469 13.394 4.460 -11.679 1.00 0.14 H new ATOM 0 HA PHE A 469 14.277 5.161 -14.466 1.00 64.43 H new ATOM 0 HB2 PHE A 469 13.886 2.779 -13.828 1.00 14.42 H new ATOM 0 HB3 PHE A 469 12.278 3.190 -13.266 1.00 14.42 H new ATOM 0 HD1 PHE A 469 10.518 3.855 -14.949 1.00 64.22 H new ATOM 0 HD2 PHE A 469 14.309 2.282 -16.106 1.00 0.33 H new ATOM 0 HE1 PHE A 469 9.589 3.215 -17.113 1.00 23.00 H new ATOM 0 HE2 PHE A 469 13.385 1.679 -18.296 1.00 32.31 H new ATOM 0 HZ PHE A 469 11.018 2.142 -18.808 1.00 20.52 H new ATOM 1159 N GLN A 470 12.684 7.140 -14.604 1.00 53.34 N ATOM 1160 CA GLN A 470 11.763 8.302 -14.636 1.00 21.01 C ATOM 1161 C GLN A 470 10.467 8.032 -15.421 1.00 42.14 C ATOM 1162 O GLN A 470 10.502 7.645 -16.590 1.00 35.30 O ATOM 1163 CB GLN A 470 12.486 9.535 -15.232 1.00 41.14 C ATOM 1164 CG GLN A 470 13.120 10.477 -14.191 1.00 1.22 C ATOM 1165 CD GLN A 470 12.175 11.580 -13.706 1.00 5.43 C ATOM 1166 OE1 GLN A 470 10.866 11.337 -13.748 1.00 61.35 O flip ATOM 1167 NE2 GLN A 470 12.622 12.656 -13.319 1.00 42.02 N flip ATOM 0 H GLN A 470 13.512 7.245 -15.190 1.00 53.34 H new ATOM 0 HA GLN A 470 11.472 8.494 -13.603 1.00 21.01 H new ATOM 0 HB2 GLN A 470 13.266 9.189 -15.911 1.00 41.14 H new ATOM 0 HB3 GLN A 470 11.773 10.103 -15.829 1.00 41.14 H new ATOM 0 HG2 GLN A 470 13.449 9.889 -13.334 1.00 1.22 H new ATOM 0 HG3 GLN A 470 14.009 10.936 -14.623 1.00 1.22 H new ATOM 0 HE21 GLN A 470 13.630 12.812 -13.298 1.00 42.02 H new ATOM 0 HE22 GLN A 470 11.986 13.394 -13.018 1.00 42.02 H new ATOM 1176 N ILE A 471 9.318 8.274 -14.756 1.00 32.12 N ATOM 1177 CA ILE A 471 7.985 8.075 -15.343 1.00 1.14 C ATOM 1178 C ILE A 471 7.125 9.323 -14.938 1.00 13.40 C ATOM 1179 O ILE A 471 6.652 9.373 -13.794 1.00 60.53 O ATOM 1180 CB ILE A 471 7.308 6.684 -14.849 1.00 73.24 C ATOM 1181 CG1 ILE A 471 8.012 5.440 -15.504 1.00 14.30 C ATOM 1182 CG2 ILE A 471 5.776 6.627 -15.071 1.00 41.31 C ATOM 1183 CD1 ILE A 471 7.307 4.088 -15.339 1.00 43.21 C ATOM 0 H ILE A 471 9.293 8.614 -13.795 1.00 32.12 H new ATOM 0 HA ILE A 471 8.051 7.991 -16.428 1.00 1.14 H new ATOM 0 HB ILE A 471 7.463 6.648 -13.771 1.00 73.24 H new ATOM 0 HG12 ILE A 471 8.128 5.636 -16.570 1.00 14.30 H new ATOM 0 HG13 ILE A 471 9.014 5.355 -15.084 1.00 14.30 H new ATOM 0 HG21 ILE A 471 5.393 5.670 -14.718 1.00 41.31 H new ATOM 0 HG22 ILE A 471 5.298 7.436 -14.518 1.00 41.31 H new ATOM 0 HG23 ILE A 471 5.558 6.735 -16.133 1.00 41.31 H new ATOM 0 HD11 ILE A 471 7.890 3.311 -15.834 1.00 43.21 H new ATOM 0 HD12 ILE A 471 7.215 3.853 -14.279 1.00 43.21 H new ATOM 0 HD13 ILE A 471 6.315 4.138 -15.787 1.00 43.21 H new ATOM 1195 N GLY A 472 7.011 10.398 -15.798 1.00 44.13 N ATOM 1196 CA GLY A 472 6.164 11.538 -15.431 1.00 44.41 C ATOM 1197 C GLY A 472 6.913 12.505 -14.540 1.00 73.31 C ATOM 1198 O GLY A 472 8.117 12.716 -14.707 1.00 45.13 O ATOM 0 H GLY A 472 7.480 10.476 -16.701 1.00 44.13 H new ATOM 0 HA2 GLY A 472 5.830 12.052 -16.332 1.00 44.41 H new ATOM 0 HA3 GLY A 472 5.271 11.182 -14.917 1.00 44.41 H new ATOM 1202 N MET A 473 6.202 13.068 -13.577 1.00 52.30 N ATOM 1203 CA MET A 473 6.803 13.983 -12.596 1.00 44.42 C ATOM 1204 C MET A 473 7.257 13.258 -11.301 1.00 43.40 C ATOM 1205 O MET A 473 7.472 13.916 -10.278 1.00 4.43 O ATOM 1206 CB MET A 473 5.836 15.157 -12.259 1.00 0.23 C ATOM 1207 CG MET A 473 4.375 14.750 -12.062 1.00 43.51 C ATOM 1208 SD MET A 473 3.439 15.962 -11.109 1.00 14.00 S ATOM 1209 CE MET A 473 1.770 15.351 -11.334 1.00 4.33 C ATOM 0 H MET A 473 5.203 12.912 -13.446 1.00 52.30 H new ATOM 0 HA MET A 473 7.699 14.392 -13.062 1.00 44.42 H new ATOM 0 HB2 MET A 473 6.187 15.649 -11.352 1.00 0.23 H new ATOM 0 HB3 MET A 473 5.888 15.893 -13.061 1.00 0.23 H new ATOM 0 HG2 MET A 473 3.904 14.617 -13.036 1.00 43.51 H new ATOM 0 HG3 MET A 473 4.336 13.786 -11.555 1.00 43.51 H new ATOM 0 HE1 MET A 473 1.071 15.997 -10.802 1.00 4.33 H new ATOM 0 HE2 MET A 473 1.524 15.347 -12.396 1.00 4.33 H new ATOM 0 HE3 MET A 473 1.698 14.337 -10.941 1.00 4.33 H new ATOM 1219 N LYS A 474 7.436 11.922 -11.343 1.00 64.35 N ATOM 1220 CA LYS A 474 7.911 11.161 -10.147 1.00 12.23 C ATOM 1221 C LYS A 474 8.975 10.101 -10.562 1.00 11.15 C ATOM 1222 O LYS A 474 9.092 9.786 -11.744 1.00 51.21 O ATOM 1223 CB LYS A 474 6.759 10.424 -9.384 1.00 41.44 C ATOM 1224 CG LYS A 474 5.580 11.257 -8.800 1.00 35.25 C ATOM 1225 CD LYS A 474 5.978 12.284 -7.715 1.00 21.45 C ATOM 1226 CE LYS A 474 4.827 12.512 -6.720 1.00 54.31 C ATOM 1227 NZ LYS A 474 5.040 13.730 -5.900 1.00 2.11 N ATOM 0 H LYS A 474 7.266 11.349 -12.169 1.00 64.35 H new ATOM 0 HA LYS A 474 8.340 11.905 -9.476 1.00 12.23 H new ATOM 0 HB2 LYS A 474 6.334 9.686 -10.065 1.00 41.44 H new ATOM 0 HB3 LYS A 474 7.212 9.873 -8.559 1.00 41.44 H new ATOM 0 HG2 LYS A 474 5.090 11.786 -9.617 1.00 35.25 H new ATOM 0 HG3 LYS A 474 4.845 10.572 -8.378 1.00 35.25 H new ATOM 0 HD2 LYS A 474 6.860 11.930 -7.181 1.00 21.45 H new ATOM 0 HD3 LYS A 474 6.248 13.229 -8.186 1.00 21.45 H new ATOM 0 HE2 LYS A 474 3.887 12.601 -7.265 1.00 54.31 H new ATOM 0 HE3 LYS A 474 4.735 11.645 -6.066 1.00 54.31 H new ATOM 0 HZ1 LYS A 474 4.243 13.849 -5.242 1.00 2.11 H new ATOM 0 HZ2 LYS A 474 5.924 13.635 -5.360 1.00 2.11 H new ATOM 0 HZ3 LYS A 474 5.102 14.561 -6.522 1.00 2.11 H new ATOM 1241 N ARG A 475 9.750 9.530 -9.590 1.00 62.13 N ATOM 1242 CA ARG A 475 10.737 8.461 -9.925 1.00 60.04 C ATOM 1243 C ARG A 475 10.608 7.270 -8.948 1.00 64.31 C ATOM 1244 O ARG A 475 10.368 7.481 -7.752 1.00 65.11 O ATOM 1245 CB ARG A 475 12.207 9.069 -9.962 1.00 44.31 C ATOM 1246 CG ARG A 475 12.873 9.440 -8.578 1.00 51.14 C ATOM 1247 CD ARG A 475 13.515 10.855 -8.459 1.00 71.42 C ATOM 1248 NE ARG A 475 14.907 10.877 -8.931 1.00 61.43 N ATOM 1249 CZ ARG A 475 15.967 11.052 -8.132 1.00 20.30 C ATOM 1250 NH1 ARG A 475 15.824 11.215 -6.818 1.00 2.42 N ATOM 1251 NH2 ARG A 475 17.187 11.065 -8.646 1.00 31.15 N ATOM 0 H ARG A 475 9.713 9.782 -8.602 1.00 62.13 H new ATOM 0 HA ARG A 475 10.523 8.070 -10.920 1.00 60.04 H new ATOM 0 HB2 ARG A 475 12.855 8.353 -10.467 1.00 44.31 H new ATOM 0 HB3 ARG A 475 12.185 9.968 -10.577 1.00 44.31 H new ATOM 0 HG2 ARG A 475 12.115 9.346 -7.801 1.00 51.14 H new ATOM 0 HG3 ARG A 475 13.643 8.699 -8.363 1.00 51.14 H new ATOM 0 HD2 ARG A 475 12.927 11.568 -9.036 1.00 71.42 H new ATOM 0 HD3 ARG A 475 13.481 11.181 -7.419 1.00 71.42 H new ATOM 0 HE ARG A 475 15.076 10.751 -9.929 1.00 61.43 H new ATOM 0 HH11 ARG A 475 14.893 11.208 -6.402 1.00 2.42 H new ATOM 0 HH12 ARG A 475 16.646 11.347 -6.228 1.00 2.42 H new ATOM 0 HH21 ARG A 475 17.319 10.942 -9.650 1.00 31.15 H new ATOM 0 HH22 ARG A 475 17.995 11.198 -8.038 1.00 31.15 H new ATOM 1265 N LEU A 476 10.744 6.023 -9.451 1.00 23.13 N ATOM 1266 CA LEU A 476 10.544 4.827 -8.582 1.00 50.11 C ATOM 1267 C LEU A 476 11.933 4.425 -7.944 1.00 71.44 C ATOM 1268 O LEU A 476 12.812 4.003 -8.689 1.00 41.24 O ATOM 1269 CB LEU A 476 9.972 3.589 -9.424 1.00 61.21 C ATOM 1270 CG LEU A 476 8.549 3.613 -10.151 1.00 2.31 C ATOM 1271 CD1 LEU A 476 7.381 3.820 -9.197 1.00 34.44 C ATOM 1272 CD2 LEU A 476 8.454 4.619 -11.295 1.00 1.24 C ATOM 0 H LEU A 476 10.983 5.814 -10.420 1.00 23.13 H new ATOM 0 HA LEU A 476 9.821 5.075 -7.805 1.00 50.11 H new ATOM 0 HB2 LEU A 476 10.710 3.373 -10.196 1.00 61.21 H new ATOM 0 HB3 LEU A 476 9.959 2.734 -8.747 1.00 61.21 H new ATOM 0 HG LEU A 476 8.471 2.613 -10.577 1.00 2.31 H new ATOM 0 HD11 LEU A 476 6.448 3.825 -9.760 1.00 34.44 H new ATOM 0 HD12 LEU A 476 7.360 3.011 -8.467 1.00 34.44 H new ATOM 0 HD13 LEU A 476 7.498 4.772 -8.680 1.00 34.44 H new ATOM 0 HD21 LEU A 476 7.459 4.575 -11.737 1.00 1.24 H new ATOM 0 HD22 LEU A 476 8.637 5.623 -10.913 1.00 1.24 H new ATOM 0 HD23 LEU A 476 9.199 4.379 -12.054 1.00 1.24 H new ATOM 1284 N LYS A 477 12.181 4.585 -6.583 1.00 54.13 N ATOM 1285 CA LYS A 477 13.469 4.085 -5.962 1.00 71.01 C ATOM 1286 C LYS A 477 13.214 2.831 -5.046 1.00 54.31 C ATOM 1287 O LYS A 477 12.466 2.953 -4.073 1.00 11.23 O ATOM 1288 CB LYS A 477 14.132 5.188 -5.071 1.00 22.54 C ATOM 1289 CG LYS A 477 14.304 6.627 -5.643 1.00 64.23 C ATOM 1290 CD LYS A 477 15.016 7.576 -4.636 1.00 13.43 C ATOM 1291 CE LYS A 477 16.420 7.082 -4.253 1.00 31.24 C ATOM 1292 NZ LYS A 477 16.983 7.847 -3.130 1.00 3.33 N ATOM 0 H LYS A 477 11.538 5.033 -5.930 1.00 54.13 H new ATOM 0 HA LYS A 477 14.126 3.819 -6.790 1.00 71.01 H new ATOM 0 HB2 LYS A 477 13.545 5.267 -4.156 1.00 22.54 H new ATOM 0 HB3 LYS A 477 15.121 4.828 -4.785 1.00 22.54 H new ATOM 0 HG2 LYS A 477 14.879 6.583 -6.568 1.00 64.23 H new ATOM 0 HG3 LYS A 477 13.326 7.036 -5.896 1.00 64.23 H new ATOM 0 HD2 LYS A 477 15.091 8.572 -5.072 1.00 13.43 H new ATOM 0 HD3 LYS A 477 14.408 7.667 -3.736 1.00 13.43 H new ATOM 0 HE2 LYS A 477 16.373 6.026 -3.986 1.00 31.24 H new ATOM 0 HE3 LYS A 477 17.081 7.163 -5.116 1.00 31.24 H new ATOM 0 HZ1 LYS A 477 17.930 7.483 -2.902 1.00 3.33 H new ATOM 0 HZ2 LYS A 477 17.052 8.851 -3.394 1.00 3.33 H new ATOM 0 HZ3 LYS A 477 16.366 7.749 -2.299 1.00 3.33 H new ATOM 1306 N VAL A 478 13.865 1.641 -5.325 1.00 32.24 N ATOM 1307 CA VAL A 478 13.371 0.342 -4.800 1.00 72.34 C ATOM 1308 C VAL A 478 14.581 -0.624 -4.434 1.00 75.05 C ATOM 1309 O VAL A 478 15.621 -0.539 -5.101 1.00 34.43 O ATOM 1310 CB VAL A 478 12.364 -0.272 -5.847 1.00 42.51 C ATOM 1311 CG1 VAL A 478 12.314 -1.790 -5.798 1.00 25.41 C ATOM 1312 CG2 VAL A 478 10.930 0.281 -5.679 1.00 23.44 C ATOM 0 H VAL A 478 14.708 1.572 -5.896 1.00 32.24 H new ATOM 0 HA VAL A 478 12.831 0.487 -3.864 1.00 72.34 H new ATOM 0 HB VAL A 478 12.753 0.032 -6.819 1.00 42.51 H new ATOM 0 HG11 VAL A 478 11.604 -2.155 -6.540 1.00 25.41 H new ATOM 0 HG12 VAL A 478 13.303 -2.194 -6.013 1.00 25.41 H new ATOM 0 HG13 VAL A 478 11.998 -2.112 -4.806 1.00 25.41 H new ATOM 0 HG21 VAL A 478 10.276 -0.173 -6.423 1.00 23.44 H new ATOM 0 HG22 VAL A 478 10.563 0.044 -4.680 1.00 23.44 H new ATOM 0 HG23 VAL A 478 10.939 1.362 -5.815 1.00 23.44 H new ATOM 1322 N GLN A 479 14.449 -1.525 -3.381 1.00 72.53 N ATOM 1323 CA GLN A 479 15.624 -2.299 -2.825 1.00 11.42 C ATOM 1324 C GLN A 479 15.210 -3.559 -1.952 1.00 73.15 C ATOM 1325 O GLN A 479 14.021 -3.718 -1.659 1.00 13.23 O ATOM 1326 CB GLN A 479 16.578 -1.356 -2.056 1.00 11.42 C ATOM 1327 CG GLN A 479 18.036 -1.815 -2.056 1.00 12.44 C ATOM 1328 CD GLN A 479 19.040 -0.692 -1.834 1.00 53.32 C ATOM 1329 OE1 GLN A 479 20.164 -0.755 -2.325 1.00 53.03 O ATOM 1330 NE2 GLN A 479 18.645 0.349 -1.116 1.00 21.12 N ATOM 0 H GLN A 479 13.563 -1.724 -2.917 1.00 72.53 H new ATOM 0 HA GLN A 479 16.154 -2.713 -3.683 1.00 11.42 H new ATOM 0 HB2 GLN A 479 16.521 -0.360 -2.496 1.00 11.42 H new ATOM 0 HB3 GLN A 479 16.235 -1.270 -1.025 1.00 11.42 H new ATOM 0 HG2 GLN A 479 18.169 -2.567 -1.278 1.00 12.44 H new ATOM 0 HG3 GLN A 479 18.253 -2.300 -3.008 1.00 12.44 H new ATOM 0 HE21 GLN A 479 17.704 0.370 -0.722 1.00 21.12 H new ATOM 0 HE22 GLN A 479 19.282 1.130 -0.957 1.00 21.12 H new ATOM 1339 N LEU A 480 16.214 -4.455 -1.553 1.00 42.12 N ATOM 1340 CA LEU A 480 15.961 -5.656 -0.613 1.00 31.34 C ATOM 1341 C LEU A 480 15.511 -5.110 0.768 1.00 72.53 C ATOM 1342 O LEU A 480 15.747 -3.922 1.003 1.00 44.43 O ATOM 1343 CB LEU A 480 17.244 -6.540 -0.343 1.00 33.51 C ATOM 1344 CG LEU A 480 17.231 -8.101 -0.604 1.00 54.01 C ATOM 1345 CD1 LEU A 480 17.320 -8.400 -2.096 1.00 62.53 C ATOM 1346 CD2 LEU A 480 18.443 -8.721 0.089 1.00 54.41 C ATOM 0 H LEU A 480 17.184 -4.374 -1.858 1.00 42.12 H new ATOM 0 HA LEU A 480 15.214 -6.277 -1.107 1.00 31.34 H new ATOM 0 HB2 LEU A 480 18.051 -6.123 -0.945 1.00 33.51 H new ATOM 0 HB3 LEU A 480 17.518 -6.394 0.702 1.00 33.51 H new ATOM 0 HG LEU A 480 16.301 -8.516 -0.215 1.00 54.01 H new ATOM 0 HD11 LEU A 480 17.310 -9.479 -2.252 1.00 62.53 H new ATOM 0 HD12 LEU A 480 16.469 -7.951 -2.608 1.00 62.53 H new ATOM 0 HD13 LEU A 480 18.245 -7.985 -2.496 1.00 62.53 H new ATOM 0 HD21 LEU A 480 18.448 -9.798 -0.082 1.00 54.41 H new ATOM 0 HD22 LEU A 480 19.356 -8.285 -0.316 1.00 54.41 H new ATOM 0 HD23 LEU A 480 18.390 -8.524 1.160 1.00 54.41 H new ATOM 1358 N LYS A 481 14.832 -5.910 1.657 1.00 61.23 N ATOM 1359 CA LYS A 481 14.396 -5.359 2.987 1.00 54.54 C ATOM 1360 C LYS A 481 15.602 -4.902 3.770 1.00 63.03 C ATOM 1361 O LYS A 481 16.418 -5.689 4.260 1.00 71.24 O ATOM 1362 CB LYS A 481 13.533 -6.313 3.906 1.00 61.31 C ATOM 1363 CG LYS A 481 12.920 -5.656 5.231 1.00 34.42 C ATOM 1364 CD LYS A 481 13.860 -5.631 6.482 1.00 31.21 C ATOM 1365 CE LYS A 481 13.714 -6.868 7.382 1.00 32.43 C ATOM 1366 NZ LYS A 481 14.589 -6.788 8.598 1.00 73.33 N ATOM 0 H LYS A 481 14.586 -6.886 1.490 1.00 61.23 H new ATOM 0 HA LYS A 481 13.728 -4.539 2.721 1.00 54.54 H new ATOM 0 HB2 LYS A 481 12.712 -6.711 3.310 1.00 61.31 H new ATOM 0 HB3 LYS A 481 14.154 -7.159 4.199 1.00 61.31 H new ATOM 0 HG2 LYS A 481 12.625 -4.632 5.002 1.00 34.42 H new ATOM 0 HG3 LYS A 481 12.012 -6.198 5.495 1.00 34.42 H new ATOM 0 HD2 LYS A 481 14.895 -5.554 6.148 1.00 31.21 H new ATOM 0 HD3 LYS A 481 13.648 -4.737 7.069 1.00 31.21 H new ATOM 0 HE2 LYS A 481 12.674 -6.970 7.691 1.00 32.43 H new ATOM 0 HE3 LYS A 481 13.967 -7.762 6.812 1.00 32.43 H new ATOM 0 HZ1 LYS A 481 14.459 -7.643 9.176 1.00 73.33 H new ATOM 0 HZ2 LYS A 481 15.584 -6.717 8.305 1.00 73.33 H new ATOM 0 HZ3 LYS A 481 14.331 -5.949 9.157 1.00 73.33 H new ATOM 1380 N ARG A 482 15.702 -3.605 3.831 1.00 51.24 N ATOM 1381 CA ARG A 482 16.688 -2.944 4.608 1.00 54.34 C ATOM 1382 C ARG A 482 15.999 -2.388 5.864 1.00 22.44 C ATOM 1383 O ARG A 482 14.771 -2.218 5.842 1.00 12.14 O ATOM 1384 CB ARG A 482 17.379 -1.909 3.680 1.00 13.35 C ATOM 1385 CG ARG A 482 16.661 -0.564 3.356 1.00 22.25 C ATOM 1386 CD ARG A 482 15.439 -0.596 2.380 1.00 34.22 C ATOM 1387 NE ARG A 482 15.015 0.773 2.033 1.00 74.31 N ATOM 1388 CZ ARG A 482 14.182 1.539 2.757 1.00 14.33 C ATOM 1389 NH1 ARG A 482 13.640 1.095 3.896 1.00 54.11 N ATOM 1390 NH2 ARG A 482 13.887 2.772 2.330 1.00 43.44 N ATOM 0 H ARG A 482 15.082 -2.971 3.327 1.00 51.24 H new ATOM 0 HA ARG A 482 17.485 -3.586 4.983 1.00 54.34 H new ATOM 0 HB2 ARG A 482 18.343 -1.665 4.125 1.00 13.35 H new ATOM 0 HB3 ARG A 482 17.583 -2.406 2.732 1.00 13.35 H new ATOM 0 HG2 ARG A 482 16.324 -0.131 4.298 1.00 22.25 H new ATOM 0 HG3 ARG A 482 17.403 0.118 2.939 1.00 22.25 H new ATOM 0 HD2 ARG A 482 15.705 -1.141 1.474 1.00 34.22 H new ATOM 0 HD3 ARG A 482 14.611 -1.132 2.843 1.00 34.22 H new ATOM 0 HE ARG A 482 15.385 1.172 1.170 1.00 74.31 H new ATOM 0 HH11 ARG A 482 13.856 0.157 4.232 1.00 54.11 H new ATOM 0 HH12 ARG A 482 13.010 1.695 4.429 1.00 54.11 H new ATOM 0 HH21 ARG A 482 14.293 3.122 1.462 1.00 43.44 H new ATOM 0 HH22 ARG A 482 13.256 3.362 2.872 1.00 43.44 H new ATOM 1404 N SER A 483 16.770 -2.183 6.957 1.00 52.35 N ATOM 1405 CA SER A 483 16.244 -1.780 8.294 1.00 20.40 C ATOM 1406 C SER A 483 15.189 -0.637 8.233 1.00 61.25 C ATOM 1407 O SER A 483 15.450 0.410 7.633 1.00 13.01 O ATOM 1408 CB SER A 483 17.452 -1.366 9.171 1.00 33.34 C ATOM 1409 OG SER A 483 18.371 -2.439 9.284 1.00 73.45 O ATOM 0 H SER A 483 17.784 -2.292 6.942 1.00 52.35 H new ATOM 0 HA SER A 483 15.715 -2.631 8.723 1.00 20.40 H new ATOM 0 HB2 SER A 483 17.947 -0.499 8.733 1.00 33.34 H new ATOM 0 HB3 SER A 483 17.106 -1.069 10.161 1.00 33.34 H new ATOM 0 HG SER A 483 19.130 -2.163 9.839 1.00 73.45 H new ATOM 1415 N LYS A 484 13.979 -0.868 8.837 1.00 51.21 N ATOM 1416 CA LYS A 484 12.883 0.115 8.834 1.00 64.11 C ATOM 1417 C LYS A 484 13.274 1.358 9.658 1.00 20.13 C ATOM 1418 O LYS A 484 13.515 1.256 10.863 1.00 61.32 O ATOM 1419 CB LYS A 484 11.594 -0.486 9.439 1.00 45.40 C ATOM 1420 CG LYS A 484 10.927 -1.599 8.617 1.00 22.32 C ATOM 1421 CD LYS A 484 9.468 -1.789 9.033 1.00 23.24 C ATOM 1422 CE LYS A 484 8.800 -2.998 8.371 1.00 35.43 C ATOM 1423 NZ LYS A 484 9.264 -4.293 8.940 1.00 34.01 N ATOM 0 H LYS A 484 13.755 -1.733 9.328 1.00 51.21 H new ATOM 0 HA LYS A 484 12.700 0.395 7.797 1.00 64.11 H new ATOM 0 HB2 LYS A 484 11.829 -0.881 10.427 1.00 45.40 H new ATOM 0 HB3 LYS A 484 10.872 0.318 9.580 1.00 45.40 H new ATOM 0 HG2 LYS A 484 10.977 -1.352 7.556 1.00 22.32 H new ATOM 0 HG3 LYS A 484 11.472 -2.533 8.753 1.00 22.32 H new ATOM 0 HD2 LYS A 484 9.418 -1.903 10.116 1.00 23.24 H new ATOM 0 HD3 LYS A 484 8.906 -0.890 8.781 1.00 23.24 H new ATOM 0 HE2 LYS A 484 7.719 -2.920 8.489 1.00 35.43 H new ATOM 0 HE3 LYS A 484 9.006 -2.981 7.301 1.00 35.43 H new ATOM 0 HZ1 LYS A 484 8.781 -5.077 8.457 1.00 34.01 H new ATOM 0 HZ2 LYS A 484 10.291 -4.383 8.805 1.00 34.01 H new ATOM 0 HZ3 LYS A 484 9.044 -4.324 9.956 1.00 34.01 H new ATOM 1437 N ASN A 485 13.333 2.525 9.006 1.00 24.30 N ATOM 1438 CA ASN A 485 13.811 3.773 9.639 1.00 11.24 C ATOM 1439 C ASN A 485 13.188 4.989 8.942 1.00 55.20 C ATOM 1440 O ASN A 485 13.687 5.387 7.884 1.00 63.02 O ATOM 1441 CB ASN A 485 15.375 3.832 9.543 1.00 64.12 C ATOM 1442 CG ASN A 485 15.964 5.065 10.218 1.00 0.53 C ATOM 1443 OD1 ASN A 485 15.517 5.482 11.287 1.00 13.42 O ATOM 1444 ND2 ASN A 485 16.957 5.672 9.579 1.00 30.31 N ATOM 0 H ASN A 485 13.054 2.637 8.031 1.00 24.30 H new ATOM 0 HA ASN A 485 13.513 3.788 10.687 1.00 11.24 H new ATOM 0 HB2 ASN A 485 15.796 2.937 10.001 1.00 64.12 H new ATOM 0 HB3 ASN A 485 15.670 3.822 8.494 1.00 64.12 H new ATOM 0 HD21 ASN A 485 17.377 6.514 9.972 1.00 30.31 H new ATOM 0 HD22 ASN A 485 17.300 5.296 8.695 1.00 30.31 H new ATOM 1451 N ASP A 486 12.030 5.509 9.484 1.00 14.53 N ATOM 1452 CA ASP A 486 11.444 6.853 9.059 1.00 11.42 C ATOM 1453 C ASP A 486 10.839 6.812 7.647 1.00 74.43 C ATOM 1454 O ASP A 486 11.548 6.779 6.637 1.00 74.42 O ATOM 1455 CB ASP A 486 12.443 8.073 9.173 1.00 14.55 C ATOM 1456 CG ASP A 486 12.611 8.528 10.611 1.00 4.21 C ATOM 1457 OD1 ASP A 486 11.659 9.128 11.157 1.00 14.53 O ATOM 1458 OD2 ASP A 486 13.688 8.281 11.196 1.00 22.10 O ATOM 0 H ASP A 486 11.487 5.033 10.204 1.00 14.53 H new ATOM 0 HA ASP A 486 10.649 7.026 9.785 1.00 11.42 H new ATOM 0 HB2 ASP A 486 13.413 7.788 8.766 1.00 14.55 H new ATOM 0 HB3 ASP A 486 12.075 8.903 8.569 1.00 14.55 H new ATOM 1463 N SER A 487 9.513 6.861 7.588 1.00 11.33 N ATOM 1464 CA SER A 487 8.797 6.814 6.315 1.00 60.13 C ATOM 1465 C SER A 487 8.687 8.211 5.677 1.00 63.42 C ATOM 1466 O SER A 487 8.481 8.338 4.469 1.00 42.21 O ATOM 1467 CB SER A 487 7.409 6.180 6.526 1.00 53.44 C ATOM 1468 OG SER A 487 6.704 6.821 7.582 1.00 73.42 O ATOM 0 H SER A 487 8.910 6.933 8.407 1.00 11.33 H new ATOM 0 HA SER A 487 9.363 6.195 5.619 1.00 60.13 H new ATOM 0 HB2 SER A 487 6.831 6.250 5.605 1.00 53.44 H new ATOM 0 HB3 SER A 487 7.522 5.120 6.752 1.00 53.44 H new ATOM 0 HG SER A 487 5.826 6.399 7.692 1.00 73.42 H new ATOM 1474 N LYS A 488 8.830 9.251 6.495 1.00 50.40 N ATOM 1475 CA LYS A 488 8.877 10.616 5.988 1.00 52.32 C ATOM 1476 C LYS A 488 10.340 11.041 5.796 1.00 22.11 C ATOM 1477 O LYS A 488 11.207 10.629 6.571 1.00 2.41 O ATOM 1478 CB LYS A 488 8.127 11.602 6.915 1.00 63.43 C ATOM 1479 CG LYS A 488 8.492 11.521 8.401 1.00 64.42 C ATOM 1480 CD LYS A 488 7.949 12.715 9.185 1.00 73.45 C ATOM 1481 CE LYS A 488 8.780 13.975 8.953 1.00 42.50 C ATOM 1482 NZ LYS A 488 8.222 15.160 9.662 1.00 31.14 N ATOM 0 H LYS A 488 8.915 9.173 7.508 1.00 50.40 H new ATOM 0 HA LYS A 488 8.367 10.643 5.025 1.00 52.32 H new ATOM 0 HB2 LYS A 488 8.318 12.617 6.567 1.00 63.43 H new ATOM 0 HB3 LYS A 488 7.056 11.426 6.812 1.00 63.43 H new ATOM 0 HG2 LYS A 488 8.094 10.598 8.823 1.00 64.42 H new ATOM 0 HG3 LYS A 488 9.576 11.479 8.507 1.00 64.42 H new ATOM 0 HD2 LYS A 488 6.916 12.902 8.892 1.00 73.45 H new ATOM 0 HD3 LYS A 488 7.940 12.477 10.249 1.00 73.45 H new ATOM 0 HE2 LYS A 488 9.802 13.801 9.290 1.00 42.50 H new ATOM 0 HE3 LYS A 488 8.828 14.184 7.884 1.00 42.50 H new ATOM 0 HZ1 LYS A 488 8.820 15.990 9.474 1.00 31.14 H new ATOM 0 HZ2 LYS A 488 7.256 15.345 9.323 1.00 31.14 H new ATOM 0 HZ3 LYS A 488 8.200 14.974 10.685 1.00 31.14 H new ATOM 1496 N PRO A 489 10.644 11.855 4.748 1.00 12.30 N ATOM 1497 CA PRO A 489 12.027 12.308 4.464 1.00 21.43 C ATOM 1498 C PRO A 489 12.621 13.276 5.508 1.00 42.25 C ATOM 1499 O PRO A 489 13.838 13.482 5.509 1.00 61.21 O ATOM 1500 CB PRO A 489 11.916 12.999 3.100 1.00 12.23 C ATOM 1501 CG PRO A 489 10.473 13.326 2.906 1.00 11.34 C ATOM 1502 CD PRO A 489 9.682 12.351 3.738 1.00 62.02 C ATOM 0 HA PRO A 489 12.709 11.458 4.488 1.00 21.43 H new ATOM 0 HB2 PRO A 489 12.525 13.902 3.072 1.00 12.23 H new ATOM 0 HB3 PRO A 489 12.276 12.347 2.304 1.00 12.23 H new ATOM 0 HG2 PRO A 489 10.266 14.351 3.213 1.00 11.34 H new ATOM 0 HG3 PRO A 489 10.198 13.247 1.854 1.00 11.34 H new ATOM 0 HD2 PRO A 489 8.827 12.835 4.209 1.00 62.02 H new ATOM 0 HD3 PRO A 489 9.291 11.536 3.129 1.00 62.02 H new ATOM 1510 N TYR A 490 11.745 13.842 6.379 1.00 74.25 N ATOM 1511 CA TYR A 490 12.123 14.751 7.490 1.00 61.51 C ATOM 1512 C TYR A 490 12.616 16.114 6.963 1.00 41.41 C ATOM 1513 O TYR A 490 11.760 17.015 6.831 1.00 23.34 O ATOM 1514 CB TYR A 490 13.129 14.077 8.463 1.00 42.51 C ATOM 1515 CG TYR A 490 13.483 14.886 9.697 1.00 35.52 C ATOM 1516 CD1 TYR A 490 12.503 15.278 10.603 1.00 41.22 C ATOM 1517 CD2 TYR A 490 14.799 15.245 9.958 1.00 2.30 C ATOM 1518 CE1 TYR A 490 12.827 16.010 11.732 1.00 43.52 C ATOM 1519 CE2 TYR A 490 15.130 15.974 11.079 1.00 12.14 C ATOM 1520 CZ TYR A 490 14.144 16.355 11.962 1.00 65.42 C ATOM 1521 OH TYR A 490 14.477 17.078 13.086 1.00 0.32 O ATOM 1522 OXT TYR A 490 13.823 16.276 6.685 1.00 37.80 O ATOM 0 H TYR A 490 10.740 13.676 6.327 1.00 74.25 H new ATOM 0 HA TYR A 490 11.226 14.956 8.074 1.00 61.51 H new ATOM 0 HB2 TYR A 490 12.714 13.121 8.783 1.00 42.51 H new ATOM 0 HB3 TYR A 490 14.047 13.859 7.916 1.00 42.51 H new ATOM 0 HD1 TYR A 490 11.473 15.007 10.423 1.00 41.22 H new ATOM 0 HD2 TYR A 490 15.577 14.947 9.270 1.00 2.30 H new ATOM 0 HE1 TYR A 490 12.056 16.309 12.427 1.00 43.52 H new ATOM 0 HE2 TYR A 490 16.159 16.246 11.265 1.00 12.14 H new ATOM 0 HH TYR A 490 15.444 17.237 13.098 1.00 0.32 H new TER 1532 TYR A 490