USER MOD reduce.3.24.130724 H: found=0, std=0, add=576, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 577 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 443 LYS NZ :NH3+ -143:sc= 0 (180deg=-0.501) USER MOD Set 1.2: A 446 GLN : amide:sc= -2.19 X(o=-2.2,f=-2) USER MOD Set 2.1: A 420 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 423 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 421 LYS NZ :NH3+ -177:sc= 1.23 (180deg=0) USER MOD Set 3.2: A 439 THR OG1 : rot 140:sc= 1 USER MOD Single : A 413 ASN : amide:sc= -0.153 K(o=-0.15,f=0.91) USER MOD Single : A 416 MET CE :methyl -176:sc= 0 (180deg=-0.0271) USER MOD Single : A 424 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 427 GLN : amide:sc= -4.32 K(o=-4.3,f=-3.5!) USER MOD Single : A 429 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 431 MET CE :methyl -142:sc= -0.354 (180deg=-1.71!) USER MOD Single : A 433 SER OG : rot 180:sc= -0.613 USER MOD Single : A 435 GLN : amide:sc= 0.443 X(o=0.44,f=-0.045) USER MOD Single : A 437 LYS NZ :NH3+ 132:sc= -0.0307 (180deg=-0.741) USER MOD Single : A 445 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 447 HIS : no HD1:sc= -15.7! C(o=-16!,f=-14!) USER MOD Single : A 449 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 ASN : amide:sc= -6.24! C(o=-6.2!,f=-11!) USER MOD Single : A 456 SER OG : rot 180:sc= 0 USER MOD Single : A 461 LYS NZ :NH3+ -135:sc= -2.78 (180deg=-3.42!) USER MOD Single : A 462 THR OG1 : rot 180:sc= 0.132 USER MOD Single : A 466 CYS SG : rot -112:sc= 0.805 USER MOD Single : A 469 TYR OH : rot -103:sc= -2.91! USER MOD Single : A 470 TYR OH : rot 180:sc= 0 USER MOD Single : A 471 TYR OH : rot 180:sc= 0 USER MOD Single : A 473 THR OG1 : rot -107:sc= 0.792 USER MOD Single : A 474 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0402) USER MOD Single : A 475 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 476 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 478 ASN : amide:sc= -0.0484 K(o=-0.048,f=-1.1) USER MOD Single : A 479 TYR OH : rot 50:sc= -1.9! USER MOD Single : A 480 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0235) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 413 11.910 -5.882 20.857 1.00 10.00 N ATOM 2 CA ASN A 413 11.247 -6.536 19.735 1.00 10.00 C ATOM 3 C ASN A 413 10.839 -5.517 18.675 1.00 10.00 C ATOM 4 O ASN A 413 9.832 -5.690 17.988 1.00 10.00 O ATOM 5 CB ASN A 413 10.015 -7.303 20.220 1.00 10.00 C ATOM 6 CG ASN A 413 10.381 -8.498 21.079 1.00 10.00 C ATOM 7 OD1 ASN A 413 11.322 -8.443 21.871 1.00 10.00 O ATOM 8 ND2 ASN A 413 9.634 -9.585 20.928 1.00 10.00 N ATOM 0 HA ASN A 413 11.952 -7.237 19.288 1.00 10.00 H new ATOM 0 HB2 ASN A 413 9.373 -6.632 20.790 1.00 10.00 H new ATOM 0 HB3 ASN A 413 9.438 -7.641 19.359 1.00 10.00 H new ATOM 0 HD21 ASN A 413 9.830 -10.420 21.481 1.00 10.00 H new ATOM 0 HD22 ASN A 413 8.864 -9.586 20.259 1.00 10.00 H new ATOM 15 N GLY A 414 11.630 -4.456 18.546 1.00 10.00 N ATOM 16 CA GLY A 414 11.335 -3.427 17.568 1.00 10.00 C ATOM 17 C GLY A 414 12.181 -3.557 16.317 1.00 10.00 C ATOM 18 O GLY A 414 12.458 -2.564 15.642 1.00 10.00 O ATOM 0 H GLY A 414 12.469 -4.291 19.102 1.00 10.00 H new ATOM 0 HA2 GLY A 414 10.281 -3.479 17.297 1.00 10.00 H new ATOM 0 HA3 GLY A 414 11.501 -2.447 18.015 1.00 10.00 H new ATOM 22 N LEU A 415 12.591 -4.782 16.006 1.00 10.00 N ATOM 23 CA LEU A 415 13.410 -5.037 14.827 1.00 10.00 C ATOM 24 C LEU A 415 12.866 -6.219 14.031 1.00 10.00 C ATOM 25 O LEU A 415 12.747 -6.153 12.808 1.00 10.00 O ATOM 26 CB LEU A 415 14.860 -5.307 15.236 1.00 10.00 C ATOM 27 CG LEU A 415 15.035 -6.320 16.370 1.00 10.00 C ATOM 28 CD1 LEU A 415 15.310 -7.707 15.808 1.00 10.00 C ATOM 29 CD2 LEU A 415 16.158 -5.888 17.302 1.00 10.00 C ATOM 0 H LEU A 415 12.370 -5.613 16.554 1.00 10.00 H new ATOM 0 HA LEU A 415 13.377 -4.150 14.194 1.00 10.00 H new ATOM 0 HB2 LEU A 415 15.407 -5.663 14.363 1.00 10.00 H new ATOM 0 HB3 LEU A 415 15.318 -4.365 15.537 1.00 10.00 H new ATOM 0 HG LEU A 415 14.109 -6.359 16.943 1.00 10.00 H new ATOM 0 HD11 LEU A 415 15.432 -8.414 16.628 1.00 10.00 H new ATOM 0 HD12 LEU A 415 14.474 -8.018 15.182 1.00 10.00 H new ATOM 0 HD13 LEU A 415 16.222 -7.683 15.211 1.00 10.00 H new ATOM 0 HD21 LEU A 415 16.268 -6.620 18.102 1.00 10.00 H new ATOM 0 HD22 LEU A 415 17.090 -5.820 16.741 1.00 10.00 H new ATOM 0 HD23 LEU A 415 15.921 -4.914 17.731 1.00 10.00 H new ATOM 41 N MET A 416 12.536 -7.298 14.733 1.00 10.00 N ATOM 42 CA MET A 416 12.004 -8.494 14.091 1.00 10.00 C ATOM 43 C MET A 416 10.596 -8.246 13.559 1.00 10.00 C ATOM 44 O MET A 416 10.262 -8.652 12.446 1.00 10.00 O ATOM 45 CB MET A 416 11.990 -9.664 15.077 1.00 10.00 C ATOM 46 CG MET A 416 11.749 -11.012 14.418 1.00 10.00 C ATOM 47 SD MET A 416 11.271 -12.287 15.600 1.00 10.00 S ATOM 48 CE MET A 416 12.777 -12.442 16.557 1.00 10.00 C ATOM 0 H MET A 416 12.628 -7.369 15.746 1.00 10.00 H new ATOM 0 HA MET A 416 12.652 -8.743 13.251 1.00 10.00 H new ATOM 0 HB2 MET A 416 12.942 -9.693 15.607 1.00 10.00 H new ATOM 0 HB3 MET A 416 11.215 -9.490 15.823 1.00 10.00 H new ATOM 0 HG2 MET A 416 10.968 -10.909 13.665 1.00 10.00 H new ATOM 0 HG3 MET A 416 12.654 -11.325 13.898 1.00 10.00 H new ATOM 0 HE1 MET A 416 12.664 -13.245 17.285 1.00 10.00 H new ATOM 0 HE2 MET A 416 13.609 -12.670 15.891 1.00 10.00 H new ATOM 0 HE3 MET A 416 12.975 -11.505 17.078 1.00 10.00 H new ATOM 58 N ALA A 417 9.776 -7.577 14.361 1.00 10.00 N ATOM 59 CA ALA A 417 8.404 -7.274 13.971 1.00 10.00 C ATOM 60 C ALA A 417 8.037 -5.837 14.325 1.00 10.00 C ATOM 61 O ALA A 417 8.727 -5.183 15.107 1.00 10.00 O ATOM 62 CB ALA A 417 7.441 -8.246 14.636 1.00 10.00 C ATOM 0 H ALA A 417 10.037 -7.234 15.285 1.00 10.00 H new ATOM 0 HA ALA A 417 8.326 -7.385 12.889 1.00 10.00 H new ATOM 0 HB1 ALA A 417 6.420 -8.009 14.337 1.00 10.00 H new ATOM 0 HB2 ALA A 417 7.682 -9.264 14.329 1.00 10.00 H new ATOM 0 HB3 ALA A 417 7.530 -8.163 15.719 1.00 10.00 H new ATOM 68 N ASP A 418 6.944 -5.351 13.744 1.00 10.00 N ATOM 69 CA ASP A 418 6.483 -3.991 13.998 1.00 10.00 C ATOM 70 C ASP A 418 5.190 -3.703 13.235 1.00 10.00 C ATOM 71 O ASP A 418 4.155 -3.422 13.839 1.00 10.00 O ATOM 72 CB ASP A 418 7.564 -2.979 13.604 1.00 10.00 C ATOM 73 CG ASP A 418 8.055 -2.167 14.786 1.00 10.00 C ATOM 74 OD1 ASP A 418 8.729 -2.745 15.664 1.00 10.00 O ATOM 75 OD2 ASP A 418 7.764 -0.953 14.834 1.00 10.00 O ATOM 0 H ASP A 418 6.361 -5.879 13.094 1.00 10.00 H new ATOM 0 HA ASP A 418 6.281 -3.895 15.065 1.00 10.00 H new ATOM 0 HB2 ASP A 418 8.405 -3.507 13.155 1.00 10.00 H new ATOM 0 HB3 ASP A 418 7.168 -2.306 12.844 1.00 10.00 H new ATOM 80 N PRO A 419 5.233 -3.770 11.892 1.00 10.00 N ATOM 81 CA PRO A 419 4.059 -3.515 11.053 1.00 10.00 C ATOM 82 C PRO A 419 3.036 -4.643 11.132 1.00 10.00 C ATOM 83 O PRO A 419 3.323 -5.720 11.655 1.00 10.00 O ATOM 84 CB PRO A 419 4.644 -3.422 9.644 1.00 10.00 C ATOM 85 CG PRO A 419 5.880 -4.251 9.695 1.00 10.00 C ATOM 86 CD PRO A 419 6.427 -4.099 11.088 1.00 10.00 C ATOM 0 HA PRO A 419 3.521 -2.620 11.365 1.00 10.00 H new ATOM 0 HB2 PRO A 419 3.944 -3.799 8.898 1.00 10.00 H new ATOM 0 HB3 PRO A 419 4.870 -2.390 9.376 1.00 10.00 H new ATOM 0 HG2 PRO A 419 5.658 -5.295 9.475 1.00 10.00 H new ATOM 0 HG3 PRO A 419 6.605 -3.916 8.953 1.00 10.00 H new ATOM 0 HD2 PRO A 419 6.904 -5.016 11.434 1.00 10.00 H new ATOM 0 HD3 PRO A 419 7.177 -3.310 11.141 1.00 10.00 H new ATOM 94 N MET A 420 1.840 -4.389 10.611 1.00 10.00 N ATOM 95 CA MET A 420 0.774 -5.380 10.621 1.00 10.00 C ATOM 96 C MET A 420 0.200 -5.562 9.225 1.00 10.00 C ATOM 97 O MET A 420 0.614 -6.456 8.496 1.00 10.00 O ATOM 98 CB MET A 420 -0.326 -4.960 11.597 1.00 10.00 C ATOM 99 CG MET A 420 -1.485 -5.942 11.671 1.00 10.00 C ATOM 100 SD MET A 420 -2.962 -5.218 12.410 1.00 10.00 S ATOM 101 CE MET A 420 -4.206 -5.692 11.212 1.00 10.00 C ATOM 0 H MET A 420 1.586 -3.502 10.176 1.00 10.00 H new ATOM 0 HA MET A 420 1.190 -6.333 10.948 1.00 10.00 H new ATOM 0 HB2 MET A 420 0.106 -4.846 12.591 1.00 10.00 H new ATOM 0 HB3 MET A 420 -0.708 -3.983 11.302 1.00 10.00 H new ATOM 0 HG2 MET A 420 -1.721 -6.295 10.667 1.00 10.00 H new ATOM 0 HG3 MET A 420 -1.182 -6.813 12.252 1.00 10.00 H new ATOM 0 HE1 MET A 420 -5.179 -5.316 11.529 1.00 10.00 H new ATOM 0 HE2 MET A 420 -3.954 -5.270 10.239 1.00 10.00 H new ATOM 0 HE3 MET A 420 -4.244 -6.779 11.137 1.00 10.00 H new ATOM 111 N LYS A 421 -0.745 -4.708 8.851 1.00 10.00 N ATOM 112 CA LYS A 421 -1.361 -4.789 7.533 1.00 10.00 C ATOM 113 C LYS A 421 -0.296 -4.901 6.451 1.00 10.00 C ATOM 114 O LYS A 421 0.301 -3.904 6.046 1.00 10.00 O ATOM 115 CB LYS A 421 -2.245 -3.575 7.274 1.00 10.00 C ATOM 116 CG LYS A 421 -2.838 -3.561 5.877 1.00 10.00 C ATOM 117 CD LYS A 421 -4.189 -4.253 5.825 1.00 10.00 C ATOM 118 CE LYS A 421 -5.178 -3.645 6.808 1.00 10.00 C ATOM 119 NZ LYS A 421 -6.528 -3.473 6.202 1.00 10.00 N ATOM 0 H LYS A 421 -1.100 -3.954 9.439 1.00 10.00 H new ATOM 0 HA LYS A 421 -1.984 -5.683 7.506 1.00 10.00 H new ATOM 0 HB2 LYS A 421 -3.053 -3.558 8.006 1.00 10.00 H new ATOM 0 HB3 LYS A 421 -1.660 -2.668 7.424 1.00 10.00 H new ATOM 0 HG2 LYS A 421 -2.945 -2.530 5.539 1.00 10.00 H new ATOM 0 HG3 LYS A 421 -2.152 -4.053 5.187 1.00 10.00 H new ATOM 0 HD2 LYS A 421 -4.593 -4.184 4.815 1.00 10.00 H new ATOM 0 HD3 LYS A 421 -4.062 -5.313 6.046 1.00 10.00 H new ATOM 0 HE2 LYS A 421 -5.254 -4.283 7.688 1.00 10.00 H new ATOM 0 HE3 LYS A 421 -4.806 -2.678 7.146 1.00 10.00 H new ATOM 0 HZ1 LYS A 421 -7.159 -3.010 6.886 1.00 10.00 H new ATOM 0 HZ2 LYS A 421 -6.453 -2.885 5.347 1.00 10.00 H new ATOM 0 HZ3 LYS A 421 -6.916 -4.404 5.949 1.00 10.00 H new ATOM 133 N VAL A 422 -0.060 -6.127 6.000 1.00 10.00 N ATOM 134 CA VAL A 422 0.939 -6.386 4.977 1.00 10.00 C ATOM 135 C VAL A 422 1.007 -7.880 4.664 1.00 10.00 C ATOM 136 O VAL A 422 1.010 -8.292 3.507 1.00 10.00 O ATOM 137 CB VAL A 422 2.313 -5.859 5.434 1.00 10.00 C ATOM 138 CG1 VAL A 422 2.997 -6.826 6.391 1.00 10.00 C ATOM 139 CG2 VAL A 422 3.200 -5.559 4.238 1.00 10.00 C ATOM 0 H VAL A 422 -0.550 -6.959 6.330 1.00 10.00 H new ATOM 0 HA VAL A 422 0.654 -5.862 4.065 1.00 10.00 H new ATOM 0 HB VAL A 422 2.144 -4.929 5.977 1.00 10.00 H new ATOM 0 HG11 VAL A 422 3.963 -6.419 6.691 1.00 10.00 H new ATOM 0 HG12 VAL A 422 2.373 -6.967 7.274 1.00 10.00 H new ATOM 0 HG13 VAL A 422 3.145 -7.785 5.895 1.00 10.00 H new ATOM 0 HG21 VAL A 422 4.165 -5.188 4.584 1.00 10.00 H new ATOM 0 HG22 VAL A 422 3.348 -6.470 3.658 1.00 10.00 H new ATOM 0 HG23 VAL A 422 2.724 -4.804 3.613 1.00 10.00 H new ATOM 149 N TYR A 423 1.037 -8.671 5.725 1.00 10.00 N ATOM 150 CA TYR A 423 1.068 -10.129 5.650 1.00 10.00 C ATOM 151 C TYR A 423 0.160 -10.649 4.537 1.00 10.00 C ATOM 152 O TYR A 423 0.453 -11.665 3.906 1.00 10.00 O ATOM 153 CB TYR A 423 0.610 -10.699 7.000 1.00 10.00 C ATOM 154 CG TYR A 423 -0.678 -10.071 7.492 1.00 10.00 C ATOM 155 CD1 TYR A 423 -0.720 -8.724 7.802 1.00 10.00 C ATOM 156 CD2 TYR A 423 -1.847 -10.807 7.626 1.00 10.00 C ATOM 157 CE1 TYR A 423 -1.867 -8.115 8.228 1.00 10.00 C ATOM 158 CE2 TYR A 423 -3.017 -10.206 8.062 1.00 10.00 C ATOM 159 CZ TYR A 423 -3.022 -8.856 8.360 1.00 10.00 C ATOM 160 OH TYR A 423 -4.181 -8.251 8.788 1.00 10.00 O ATOM 0 H TYR A 423 1.041 -8.315 6.681 1.00 10.00 H new ATOM 0 HA TYR A 423 2.086 -10.448 5.425 1.00 10.00 H new ATOM 0 HB2 TYR A 423 0.472 -11.776 6.907 1.00 10.00 H new ATOM 0 HB3 TYR A 423 1.393 -10.541 7.741 1.00 10.00 H new ATOM 0 HD1 TYR A 423 0.180 -8.136 7.705 1.00 10.00 H new ATOM 0 HD2 TYR A 423 -1.845 -11.860 7.388 1.00 10.00 H new ATOM 0 HE1 TYR A 423 -1.869 -7.060 8.460 1.00 10.00 H new ATOM 0 HE2 TYR A 423 -3.920 -10.789 8.168 1.00 10.00 H new ATOM 0 HH TYR A 423 -4.902 -8.914 8.825 1.00 10.00 H new ATOM 170 N LYS A 424 -0.945 -9.944 4.303 1.00 10.00 N ATOM 171 CA LYS A 424 -1.896 -10.335 3.268 1.00 10.00 C ATOM 172 C LYS A 424 -1.590 -9.628 1.951 1.00 10.00 C ATOM 173 O LYS A 424 -1.921 -10.124 0.875 1.00 10.00 O ATOM 174 CB LYS A 424 -3.325 -10.015 3.711 1.00 10.00 C ATOM 175 CG LYS A 424 -3.989 -11.141 4.486 1.00 10.00 C ATOM 176 CD LYS A 424 -5.489 -11.178 4.240 1.00 10.00 C ATOM 177 CE LYS A 424 -6.247 -10.413 5.313 1.00 10.00 C ATOM 178 NZ LYS A 424 -7.718 -10.610 5.201 1.00 10.00 N ATOM 0 H LYS A 424 -1.202 -9.101 4.816 1.00 10.00 H new ATOM 0 HA LYS A 424 -1.803 -11.410 3.113 1.00 10.00 H new ATOM 0 HB2 LYS A 424 -3.312 -9.118 4.330 1.00 10.00 H new ATOM 0 HB3 LYS A 424 -3.927 -9.787 2.831 1.00 10.00 H new ATOM 0 HG2 LYS A 424 -3.548 -12.094 4.195 1.00 10.00 H new ATOM 0 HG3 LYS A 424 -3.797 -11.013 5.551 1.00 10.00 H new ATOM 0 HD2 LYS A 424 -5.709 -10.750 3.262 1.00 10.00 H new ATOM 0 HD3 LYS A 424 -5.830 -12.213 4.219 1.00 10.00 H new ATOM 0 HE2 LYS A 424 -5.911 -10.739 6.297 1.00 10.00 H new ATOM 0 HE3 LYS A 424 -6.016 -9.351 5.233 1.00 10.00 H new ATOM 0 HZ1 LYS A 424 -8.198 -10.072 5.950 1.00 10.00 H new ATOM 0 HZ2 LYS A 424 -8.043 -10.275 4.272 1.00 10.00 H new ATOM 0 HZ3 LYS A 424 -7.942 -11.621 5.303 1.00 10.00 H new ATOM 192 N ASP A 425 -0.954 -8.466 2.049 1.00 10.00 N ATOM 193 CA ASP A 425 -0.598 -7.683 0.872 1.00 10.00 C ATOM 194 C ASP A 425 0.506 -8.360 0.058 1.00 10.00 C ATOM 195 O ASP A 425 0.806 -7.938 -1.057 1.00 10.00 O ATOM 196 CB ASP A 425 -0.152 -6.280 1.286 1.00 10.00 C ATOM 197 CG ASP A 425 -1.133 -5.616 2.234 1.00 10.00 C ATOM 198 OD1 ASP A 425 -2.274 -6.109 2.350 1.00 10.00 O ATOM 199 OD2 ASP A 425 -0.758 -4.603 2.862 1.00 10.00 O ATOM 0 H ASP A 425 -0.674 -8.045 2.935 1.00 10.00 H new ATOM 0 HA ASP A 425 -1.485 -7.611 0.242 1.00 10.00 H new ATOM 0 HB2 ASP A 425 0.826 -6.339 1.763 1.00 10.00 H new ATOM 0 HB3 ASP A 425 -0.036 -5.661 0.396 1.00 10.00 H new ATOM 204 N ARG A 426 1.112 -9.408 0.610 1.00 10.00 N ATOM 205 CA ARG A 426 2.176 -10.121 -0.091 1.00 10.00 C ATOM 206 C ARG A 426 1.723 -10.530 -1.491 1.00 10.00 C ATOM 207 O ARG A 426 2.537 -10.671 -2.403 1.00 10.00 O ATOM 208 CB ARG A 426 2.613 -11.352 0.709 1.00 10.00 C ATOM 209 CG ARG A 426 3.994 -11.215 1.328 1.00 10.00 C ATOM 210 CD ARG A 426 5.071 -11.081 0.263 1.00 10.00 C ATOM 211 NE ARG A 426 5.121 -12.248 -0.615 1.00 10.00 N ATOM 212 CZ ARG A 426 5.627 -13.426 -0.253 1.00 10.00 C ATOM 213 NH1 ARG A 426 6.126 -13.596 0.964 1.00 10.00 N ATOM 214 NH2 ARG A 426 5.632 -14.436 -1.112 1.00 10.00 N ATOM 0 H ARG A 426 0.887 -9.780 1.533 1.00 10.00 H new ATOM 0 HA ARG A 426 3.029 -9.449 -0.190 1.00 10.00 H new ATOM 0 HB2 ARG A 426 1.886 -11.538 1.500 1.00 10.00 H new ATOM 0 HB3 ARG A 426 2.602 -12.223 0.054 1.00 10.00 H new ATOM 0 HG2 ARG A 426 4.016 -10.343 1.981 1.00 10.00 H new ATOM 0 HG3 ARG A 426 4.203 -12.085 1.951 1.00 10.00 H new ATOM 0 HD2 ARG A 426 4.883 -10.187 -0.332 1.00 10.00 H new ATOM 0 HD3 ARG A 426 6.040 -10.946 0.743 1.00 10.00 H new ATOM 0 HE ARG A 426 4.747 -12.155 -1.559 1.00 10.00 H new ATOM 0 HH11 ARG A 426 6.124 -12.822 1.629 1.00 10.00 H new ATOM 0 HH12 ARG A 426 6.512 -14.500 1.235 1.00 10.00 H new ATOM 0 HH21 ARG A 426 5.249 -14.311 -2.049 1.00 10.00 H new ATOM 0 HH22 ARG A 426 6.019 -15.338 -0.836 1.00 10.00 H new ATOM 228 N GLN A 427 0.414 -10.698 -1.656 1.00 10.00 N ATOM 229 CA GLN A 427 -0.155 -11.066 -2.947 1.00 10.00 C ATOM 230 C GLN A 427 -0.793 -9.845 -3.597 1.00 10.00 C ATOM 231 O GLN A 427 -1.771 -9.948 -4.337 1.00 10.00 O ATOM 232 CB GLN A 427 -1.190 -12.183 -2.782 1.00 10.00 C ATOM 233 CG GLN A 427 -0.808 -13.222 -1.737 1.00 10.00 C ATOM 234 CD GLN A 427 -1.092 -12.760 -0.319 1.00 10.00 C ATOM 235 OE1 GLN A 427 -2.229 -12.437 0.025 1.00 10.00 O ATOM 236 NE2 GLN A 427 -0.054 -12.724 0.511 1.00 10.00 N ATOM 0 H GLN A 427 -0.273 -10.585 -0.910 1.00 10.00 H new ATOM 0 HA GLN A 427 0.644 -11.435 -3.590 1.00 10.00 H new ATOM 0 HB2 GLN A 427 -2.148 -11.741 -2.509 1.00 10.00 H new ATOM 0 HB3 GLN A 427 -1.331 -12.680 -3.742 1.00 10.00 H new ATOM 0 HG2 GLN A 427 -1.356 -14.144 -1.931 1.00 10.00 H new ATOM 0 HG3 GLN A 427 0.252 -13.455 -1.833 1.00 10.00 H new ATOM 0 HE21 GLN A 427 0.871 -13.001 0.183 1.00 10.00 H new ATOM 0 HE22 GLN A 427 -0.183 -12.420 1.476 1.00 10.00 H new ATOM 245 N VAL A 428 -0.212 -8.689 -3.306 1.00 10.00 N ATOM 246 CA VAL A 428 -0.682 -7.419 -3.838 1.00 10.00 C ATOM 247 C VAL A 428 0.394 -6.783 -4.706 1.00 10.00 C ATOM 248 O VAL A 428 0.088 -6.094 -5.679 1.00 10.00 O ATOM 249 CB VAL A 428 -1.071 -6.455 -2.705 1.00 10.00 C ATOM 250 CG1 VAL A 428 -1.325 -5.056 -3.240 1.00 10.00 C ATOM 251 CG2 VAL A 428 -2.289 -6.976 -1.959 1.00 10.00 C ATOM 0 H VAL A 428 0.599 -8.606 -2.694 1.00 10.00 H new ATOM 0 HA VAL A 428 -1.567 -7.615 -4.444 1.00 10.00 H new ATOM 0 HB VAL A 428 -0.236 -6.398 -2.007 1.00 10.00 H new ATOM 0 HG11 VAL A 428 -1.598 -4.396 -2.417 1.00 10.00 H new ATOM 0 HG12 VAL A 428 -0.422 -4.681 -3.722 1.00 10.00 H new ATOM 0 HG13 VAL A 428 -2.137 -5.086 -3.966 1.00 10.00 H new ATOM 0 HG21 VAL A 428 -2.551 -6.282 -1.160 1.00 10.00 H new ATOM 0 HG22 VAL A 428 -3.127 -7.067 -2.650 1.00 10.00 H new ATOM 0 HG23 VAL A 428 -2.063 -7.953 -1.531 1.00 10.00 H new ATOM 261 N MET A 429 1.655 -7.032 -4.359 1.00 10.00 N ATOM 262 CA MET A 429 2.776 -6.495 -5.128 1.00 10.00 C ATOM 263 C MET A 429 2.538 -6.695 -6.623 1.00 10.00 C ATOM 264 O MET A 429 3.021 -5.923 -7.451 1.00 10.00 O ATOM 265 CB MET A 429 4.082 -7.183 -4.722 1.00 10.00 C ATOM 266 CG MET A 429 4.438 -7.013 -3.256 1.00 10.00 C ATOM 267 SD MET A 429 5.709 -8.172 -2.712 1.00 10.00 S ATOM 268 CE MET A 429 7.148 -7.514 -3.550 1.00 10.00 C ATOM 0 H MET A 429 1.926 -7.599 -3.555 1.00 10.00 H new ATOM 0 HA MET A 429 2.854 -5.429 -4.917 1.00 10.00 H new ATOM 0 HB2 MET A 429 4.005 -8.247 -4.946 1.00 10.00 H new ATOM 0 HB3 MET A 429 4.894 -6.787 -5.331 1.00 10.00 H new ATOM 0 HG2 MET A 429 4.784 -5.994 -3.086 1.00 10.00 H new ATOM 0 HG3 MET A 429 3.542 -7.151 -2.650 1.00 10.00 H new ATOM 0 HE1 MET A 429 8.019 -8.125 -3.312 1.00 10.00 H new ATOM 0 HE2 MET A 429 6.979 -7.526 -4.627 1.00 10.00 H new ATOM 0 HE3 MET A 429 7.323 -6.489 -3.222 1.00 10.00 H new ATOM 278 N ASN A 430 1.788 -7.745 -6.954 1.00 10.00 N ATOM 279 CA ASN A 430 1.476 -8.064 -8.340 1.00 10.00 C ATOM 280 C ASN A 430 -0.032 -8.120 -8.568 1.00 10.00 C ATOM 281 O ASN A 430 -0.501 -8.767 -9.505 1.00 10.00 O ATOM 282 CB ASN A 430 2.106 -9.406 -8.713 1.00 10.00 C ATOM 283 CG ASN A 430 3.542 -9.264 -9.175 1.00 10.00 C ATOM 284 OD1 ASN A 430 4.463 -9.175 -8.362 1.00 10.00 O ATOM 285 ND2 ASN A 430 3.743 -9.242 -10.488 1.00 10.00 N ATOM 0 H ASN A 430 1.385 -8.390 -6.275 1.00 10.00 H new ATOM 0 HA ASN A 430 1.886 -7.276 -8.972 1.00 10.00 H new ATOM 0 HB2 ASN A 430 2.069 -10.073 -7.852 1.00 10.00 H new ATOM 0 HB3 ASN A 430 1.518 -9.873 -9.503 1.00 10.00 H new ATOM 0 HD21 ASN A 430 4.689 -9.149 -10.858 1.00 10.00 H new ATOM 0 HD22 ASN A 430 2.951 -9.319 -11.126 1.00 10.00 H new ATOM 292 N MET A 431 -0.788 -7.437 -7.712 1.00 10.00 N ATOM 293 CA MET A 431 -2.244 -7.409 -7.824 1.00 10.00 C ATOM 294 C MET A 431 -2.882 -6.781 -6.592 1.00 10.00 C ATOM 295 O MET A 431 -3.291 -7.483 -5.668 1.00 10.00 O ATOM 296 CB MET A 431 -2.803 -8.819 -8.010 1.00 10.00 C ATOM 297 CG MET A 431 -3.207 -9.133 -9.441 1.00 10.00 C ATOM 298 SD MET A 431 -2.848 -10.838 -9.906 1.00 10.00 S ATOM 299 CE MET A 431 -1.890 -10.586 -11.399 1.00 10.00 C ATOM 0 H MET A 431 -0.416 -6.895 -6.932 1.00 10.00 H new ATOM 0 HA MET A 431 -2.487 -6.804 -8.697 1.00 10.00 H new ATOM 0 HB2 MET A 431 -2.055 -9.542 -7.686 1.00 10.00 H new ATOM 0 HB3 MET A 431 -3.670 -8.945 -7.361 1.00 10.00 H new ATOM 0 HG2 MET A 431 -4.274 -8.944 -9.563 1.00 10.00 H new ATOM 0 HG3 MET A 431 -2.684 -8.458 -10.118 1.00 10.00 H new ATOM 0 HE1 MET A 431 -2.145 -11.354 -12.129 1.00 10.00 H new ATOM 0 HE2 MET A 431 -2.114 -9.603 -11.813 1.00 10.00 H new ATOM 0 HE3 MET A 431 -0.827 -10.647 -11.164 1.00 10.00 H new ATOM 309 N TRP A 432 -2.998 -5.463 -6.600 1.00 10.00 N ATOM 310 CA TRP A 432 -3.622 -4.755 -5.492 1.00 10.00 C ATOM 311 C TRP A 432 -5.132 -4.805 -5.670 1.00 10.00 C ATOM 312 O TRP A 432 -5.703 -4.073 -6.477 1.00 10.00 O ATOM 313 CB TRP A 432 -3.131 -3.307 -5.416 1.00 10.00 C ATOM 314 CG TRP A 432 -1.671 -3.123 -5.731 1.00 10.00 C ATOM 315 CD1 TRP A 432 -1.049 -3.384 -6.913 1.00 10.00 C ATOM 316 CD2 TRP A 432 -0.646 -2.629 -4.852 1.00 10.00 C ATOM 317 NE1 TRP A 432 0.276 -3.046 -6.837 1.00 10.00 N ATOM 318 CE2 TRP A 432 0.550 -2.592 -5.584 1.00 10.00 C ATOM 319 CE3 TRP A 432 -0.627 -2.202 -3.527 1.00 10.00 C ATOM 320 CZ2 TRP A 432 1.749 -2.146 -5.038 1.00 10.00 C ATOM 321 CZ3 TRP A 432 0.564 -1.766 -2.978 1.00 10.00 C ATOM 322 CH2 TRP A 432 1.737 -1.736 -3.735 1.00 10.00 C ATOM 0 H TRP A 432 -2.670 -4.863 -7.357 1.00 10.00 H new ATOM 0 HA TRP A 432 -3.347 -5.238 -4.554 1.00 10.00 H new ATOM 0 HB2 TRP A 432 -3.717 -2.702 -6.107 1.00 10.00 H new ATOM 0 HB3 TRP A 432 -3.324 -2.924 -4.414 1.00 10.00 H new ATOM 0 HD1 TRP A 432 -1.531 -3.798 -7.786 1.00 10.00 H new ATOM 0 HE1 TRP A 432 0.950 -3.122 -7.599 1.00 10.00 H new ATOM 0 HE3 TRP A 432 -1.531 -2.211 -2.936 1.00 10.00 H new ATOM 0 HZ2 TRP A 432 2.657 -2.125 -5.623 1.00 10.00 H new ATOM 0 HZ3 TRP A 432 0.588 -1.443 -1.948 1.00 10.00 H new ATOM 0 HH2 TRP A 432 2.651 -1.382 -3.282 1.00 10.00 H new ATOM 333 N SER A 433 -5.759 -5.706 -4.930 1.00 10.00 N ATOM 334 CA SER A 433 -7.204 -5.905 -5.015 1.00 10.00 C ATOM 335 C SER A 433 -7.973 -4.715 -4.459 1.00 10.00 C ATOM 336 O SER A 433 -7.481 -3.995 -3.595 1.00 10.00 O ATOM 337 CB SER A 433 -7.606 -7.176 -4.267 1.00 10.00 C ATOM 338 OG SER A 433 -6.636 -8.195 -4.433 1.00 10.00 O ATOM 0 H SER A 433 -5.290 -6.315 -4.260 1.00 10.00 H new ATOM 0 HA SER A 433 -7.459 -6.005 -6.070 1.00 10.00 H new ATOM 0 HB2 SER A 433 -7.727 -6.954 -3.207 1.00 10.00 H new ATOM 0 HB3 SER A 433 -8.572 -7.526 -4.632 1.00 10.00 H new ATOM 0 HG SER A 433 -6.916 -8.996 -3.943 1.00 10.00 H new ATOM 344 N GLU A 434 -9.193 -4.524 -4.956 1.00 10.00 N ATOM 345 CA GLU A 434 -10.041 -3.429 -4.499 1.00 10.00 C ATOM 346 C GLU A 434 -10.092 -3.399 -2.975 1.00 10.00 C ATOM 347 O GLU A 434 -10.254 -2.341 -2.367 1.00 10.00 O ATOM 348 CB GLU A 434 -11.453 -3.575 -5.068 1.00 10.00 C ATOM 349 CG GLU A 434 -12.147 -2.247 -5.322 1.00 10.00 C ATOM 350 CD GLU A 434 -13.608 -2.413 -5.688 1.00 10.00 C ATOM 351 OE1 GLU A 434 -13.891 -2.806 -6.839 1.00 10.00 O ATOM 352 OE2 GLU A 434 -14.471 -2.149 -4.824 1.00 10.00 O ATOM 0 H GLU A 434 -9.615 -5.113 -5.674 1.00 10.00 H new ATOM 0 HA GLU A 434 -9.615 -2.491 -4.855 1.00 10.00 H new ATOM 0 HB2 GLU A 434 -11.403 -4.134 -6.002 1.00 10.00 H new ATOM 0 HB3 GLU A 434 -12.055 -4.164 -4.376 1.00 10.00 H new ATOM 0 HG2 GLU A 434 -12.068 -1.624 -4.431 1.00 10.00 H new ATOM 0 HG3 GLU A 434 -11.633 -1.720 -6.126 1.00 10.00 H new ATOM 359 N GLN A 435 -9.940 -4.573 -2.367 1.00 10.00 N ATOM 360 CA GLN A 435 -9.953 -4.688 -0.917 1.00 10.00 C ATOM 361 C GLN A 435 -8.572 -4.386 -0.350 1.00 10.00 C ATOM 362 O GLN A 435 -8.449 -3.790 0.719 1.00 10.00 O ATOM 363 CB GLN A 435 -10.404 -6.088 -0.494 1.00 10.00 C ATOM 364 CG GLN A 435 -11.349 -6.088 0.697 1.00 10.00 C ATOM 365 CD GLN A 435 -12.808 -6.068 0.283 1.00 10.00 C ATOM 366 OE1 GLN A 435 -13.528 -7.050 0.458 1.00 10.00 O ATOM 367 NE2 GLN A 435 -13.250 -4.944 -0.269 1.00 10.00 N ATOM 0 H GLN A 435 -9.807 -5.456 -2.859 1.00 10.00 H new ATOM 0 HA GLN A 435 -10.661 -3.961 -0.520 1.00 10.00 H new ATOM 0 HB2 GLN A 435 -10.896 -6.573 -1.337 1.00 10.00 H new ATOM 0 HB3 GLN A 435 -9.526 -6.686 -0.250 1.00 10.00 H new ATOM 0 HG2 GLN A 435 -11.160 -6.972 1.306 1.00 10.00 H new ATOM 0 HG3 GLN A 435 -11.140 -5.220 1.322 1.00 10.00 H new ATOM 0 HE21 GLN A 435 -12.617 -4.154 -0.395 1.00 10.00 H new ATOM 0 HE22 GLN A 435 -14.223 -4.870 -0.567 1.00 10.00 H new ATOM 376 N GLU A 436 -7.534 -4.785 -1.081 1.00 10.00 N ATOM 377 CA GLU A 436 -6.173 -4.534 -0.654 1.00 10.00 C ATOM 378 C GLU A 436 -5.852 -3.065 -0.865 1.00 10.00 C ATOM 379 O GLU A 436 -5.529 -2.350 0.082 1.00 10.00 O ATOM 380 CB GLU A 436 -5.204 -5.447 -1.412 1.00 10.00 C ATOM 381 CG GLU A 436 -5.733 -6.860 -1.624 1.00 10.00 C ATOM 382 CD GLU A 436 -4.926 -7.902 -0.874 1.00 10.00 C ATOM 383 OE1 GLU A 436 -4.712 -7.724 0.344 1.00 10.00 O ATOM 384 OE2 GLU A 436 -4.508 -8.896 -1.504 1.00 10.00 O ATOM 0 H GLU A 436 -7.616 -5.282 -1.968 1.00 10.00 H new ATOM 0 HA GLU A 436 -6.064 -4.760 0.407 1.00 10.00 H new ATOM 0 HB2 GLU A 436 -4.983 -5.002 -2.382 1.00 10.00 H new ATOM 0 HB3 GLU A 436 -4.263 -5.499 -0.864 1.00 10.00 H new ATOM 0 HG2 GLU A 436 -6.772 -6.908 -1.299 1.00 10.00 H new ATOM 0 HG3 GLU A 436 -5.721 -7.093 -2.689 1.00 10.00 H new ATOM 391 N LYS A 437 -6.003 -2.601 -2.101 1.00 10.00 N ATOM 392 CA LYS A 437 -5.790 -1.194 -2.417 1.00 10.00 C ATOM 393 C LYS A 437 -6.647 -0.342 -1.492 1.00 10.00 C ATOM 394 O LYS A 437 -6.374 0.833 -1.278 1.00 10.00 O ATOM 395 CB LYS A 437 -6.152 -0.914 -3.877 1.00 10.00 C ATOM 396 CG LYS A 437 -5.198 0.048 -4.567 1.00 10.00 C ATOM 397 CD LYS A 437 -5.893 0.819 -5.679 1.00 10.00 C ATOM 398 CE LYS A 437 -5.966 0.005 -6.961 1.00 10.00 C ATOM 399 NZ LYS A 437 -7.089 -0.972 -6.935 1.00 10.00 N ATOM 0 H LYS A 437 -6.271 -3.178 -2.898 1.00 10.00 H new ATOM 0 HA LYS A 437 -4.738 -0.947 -2.273 1.00 10.00 H new ATOM 0 HB2 LYS A 437 -6.166 -1.855 -4.426 1.00 10.00 H new ATOM 0 HB3 LYS A 437 -7.161 -0.505 -3.920 1.00 10.00 H new ATOM 0 HG2 LYS A 437 -4.793 0.748 -3.836 1.00 10.00 H new ATOM 0 HG3 LYS A 437 -4.355 -0.507 -4.979 1.00 10.00 H new ATOM 0 HD2 LYS A 437 -6.900 1.090 -5.361 1.00 10.00 H new ATOM 0 HD3 LYS A 437 -5.357 1.749 -5.868 1.00 10.00 H new ATOM 0 HE2 LYS A 437 -6.089 0.676 -7.811 1.00 10.00 H new ATOM 0 HE3 LYS A 437 -5.026 -0.526 -7.108 1.00 10.00 H new ATOM 0 HZ1 LYS A 437 -7.628 -0.905 -7.822 1.00 10.00 H new ATOM 0 HZ2 LYS A 437 -6.709 -1.935 -6.832 1.00 10.00 H new ATOM 0 HZ3 LYS A 437 -7.716 -0.759 -6.133 1.00 10.00 H new ATOM 413 N GLU A 438 -7.679 -0.960 -0.931 1.00 10.00 N ATOM 414 CA GLU A 438 -8.571 -0.275 -0.017 1.00 10.00 C ATOM 415 C GLU A 438 -7.823 0.197 1.220 1.00 10.00 C ATOM 416 O GLU A 438 -8.265 1.120 1.897 1.00 10.00 O ATOM 417 CB GLU A 438 -9.717 -1.197 0.391 1.00 10.00 C ATOM 418 CG GLU A 438 -11.092 -0.566 0.242 1.00 10.00 C ATOM 419 CD GLU A 438 -12.209 -1.489 0.690 1.00 10.00 C ATOM 420 OE1 GLU A 438 -12.717 -2.259 -0.153 1.00 10.00 O ATOM 421 OE2 GLU A 438 -12.576 -1.442 1.883 1.00 10.00 O ATOM 0 H GLU A 438 -7.916 -1.938 -1.097 1.00 10.00 H new ATOM 0 HA GLU A 438 -8.977 0.597 -0.529 1.00 10.00 H new ATOM 0 HB2 GLU A 438 -9.675 -2.103 -0.214 1.00 10.00 H new ATOM 0 HB3 GLU A 438 -9.576 -1.499 1.429 1.00 10.00 H new ATOM 0 HG2 GLU A 438 -11.130 0.354 0.825 1.00 10.00 H new ATOM 0 HG3 GLU A 438 -11.250 -0.290 -0.801 1.00 10.00 H new ATOM 428 N THR A 439 -6.697 -0.442 1.523 1.00 10.00 N ATOM 429 CA THR A 439 -5.921 -0.061 2.696 1.00 10.00 C ATOM 430 C THR A 439 -4.807 0.922 2.340 1.00 10.00 C ATOM 431 O THR A 439 -4.631 1.937 3.013 1.00 10.00 O ATOM 432 CB THR A 439 -5.335 -1.297 3.375 1.00 10.00 C ATOM 433 OG1 THR A 439 -6.360 -2.212 3.721 1.00 10.00 O ATOM 434 CG2 THR A 439 -4.565 -0.972 4.635 1.00 10.00 C ATOM 0 H THR A 439 -6.307 -1.214 0.982 1.00 10.00 H new ATOM 0 HA THR A 439 -6.599 0.438 3.389 1.00 10.00 H new ATOM 0 HB THR A 439 -4.649 -1.732 2.648 1.00 10.00 H new ATOM 0 HG1 THR A 439 -6.057 -3.126 3.541 1.00 10.00 H new ATOM 0 HG21 THR A 439 -4.174 -1.892 5.070 1.00 10.00 H new ATOM 0 HG22 THR A 439 -3.738 -0.304 4.394 1.00 10.00 H new ATOM 0 HG23 THR A 439 -5.227 -0.485 5.351 1.00 10.00 H new ATOM 442 N PHE A 440 -4.056 0.622 1.286 1.00 10.00 N ATOM 443 CA PHE A 440 -2.966 1.487 0.862 1.00 10.00 C ATOM 444 C PHE A 440 -3.508 2.706 0.124 1.00 10.00 C ATOM 445 O PHE A 440 -2.915 3.784 0.170 1.00 10.00 O ATOM 446 CB PHE A 440 -1.991 0.721 -0.037 1.00 10.00 C ATOM 447 CG PHE A 440 -2.358 -0.707 -0.262 1.00 10.00 C ATOM 448 CD1 PHE A 440 -2.270 -1.648 0.750 1.00 10.00 C ATOM 449 CD2 PHE A 440 -2.798 -1.102 -1.497 1.00 10.00 C ATOM 450 CE1 PHE A 440 -2.619 -2.958 0.511 1.00 10.00 C ATOM 451 CE2 PHE A 440 -3.148 -2.402 -1.740 1.00 10.00 C ATOM 452 CZ PHE A 440 -3.058 -3.325 -0.743 1.00 10.00 C ATOM 0 H PHE A 440 -4.183 -0.212 0.712 1.00 10.00 H new ATOM 0 HA PHE A 440 -2.432 1.824 1.751 1.00 10.00 H new ATOM 0 HB2 PHE A 440 -1.931 1.225 -1.002 1.00 10.00 H new ATOM 0 HB3 PHE A 440 -0.996 0.763 0.407 1.00 10.00 H new ATOM 0 HD1 PHE A 440 -1.926 -1.353 1.730 1.00 10.00 H new ATOM 0 HD2 PHE A 440 -2.870 -0.375 -2.293 1.00 10.00 H new ATOM 0 HE1 PHE A 440 -2.549 -3.692 1.300 1.00 10.00 H new ATOM 0 HE2 PHE A 440 -3.495 -2.695 -2.720 1.00 10.00 H new ATOM 0 HZ PHE A 440 -3.332 -4.352 -0.936 1.00 10.00 H new ATOM 462 N ARG A 441 -4.641 2.533 -0.553 1.00 10.00 N ATOM 463 CA ARG A 441 -5.252 3.630 -1.289 1.00 10.00 C ATOM 464 C ARG A 441 -6.057 4.523 -0.349 1.00 10.00 C ATOM 465 O ARG A 441 -6.285 5.697 -0.641 1.00 10.00 O ATOM 466 CB ARG A 441 -6.155 3.107 -2.408 1.00 10.00 C ATOM 467 CG ARG A 441 -6.419 4.126 -3.503 1.00 10.00 C ATOM 468 CD ARG A 441 -7.721 3.836 -4.233 1.00 10.00 C ATOM 469 NE ARG A 441 -8.829 4.633 -3.712 1.00 10.00 N ATOM 470 CZ ARG A 441 -10.093 4.493 -4.107 1.00 10.00 C ATOM 471 NH1 ARG A 441 -10.412 3.589 -5.026 1.00 10.00 N ATOM 472 NH2 ARG A 441 -11.040 5.259 -3.583 1.00 10.00 N ATOM 0 H ARG A 441 -5.149 1.650 -0.606 1.00 10.00 H new ATOM 0 HA ARG A 441 -4.450 4.216 -1.737 1.00 10.00 H new ATOM 0 HB2 ARG A 441 -5.697 2.222 -2.850 1.00 10.00 H new ATOM 0 HB3 ARG A 441 -7.106 2.793 -1.979 1.00 10.00 H new ATOM 0 HG2 ARG A 441 -6.459 5.125 -3.069 1.00 10.00 H new ATOM 0 HG3 ARG A 441 -5.593 4.120 -4.214 1.00 10.00 H new ATOM 0 HD2 ARG A 441 -7.594 4.042 -5.296 1.00 10.00 H new ATOM 0 HD3 ARG A 441 -7.961 2.777 -4.140 1.00 10.00 H new ATOM 0 HE ARG A 441 -8.622 5.338 -3.004 1.00 10.00 H new ATOM 0 HH11 ARG A 441 -9.687 2.998 -5.433 1.00 10.00 H new ATOM 0 HH12 ARG A 441 -11.382 3.486 -5.325 1.00 10.00 H new ATOM 0 HH21 ARG A 441 -10.800 5.955 -2.877 1.00 10.00 H new ATOM 0 HH22 ARG A 441 -12.008 5.152 -3.886 1.00 10.00 H new ATOM 486 N GLU A 442 -6.489 3.960 0.782 1.00 10.00 N ATOM 487 CA GLU A 442 -7.269 4.716 1.754 1.00 10.00 C ATOM 488 C GLU A 442 -6.365 5.474 2.716 1.00 10.00 C ATOM 489 O GLU A 442 -6.677 6.594 3.118 1.00 10.00 O ATOM 490 CB GLU A 442 -8.198 3.790 2.538 1.00 10.00 C ATOM 491 CG GLU A 442 -9.516 3.512 1.832 1.00 10.00 C ATOM 492 CD GLU A 442 -10.528 2.835 2.735 1.00 10.00 C ATOM 493 OE1 GLU A 442 -10.465 3.048 3.964 1.00 10.00 O ATOM 494 OE2 GLU A 442 -11.385 2.091 2.211 1.00 10.00 O ATOM 0 H GLU A 442 -6.312 2.990 1.043 1.00 10.00 H new ATOM 0 HA GLU A 442 -7.870 5.439 1.202 1.00 10.00 H new ATOM 0 HB2 GLU A 442 -7.686 2.845 2.720 1.00 10.00 H new ATOM 0 HB3 GLU A 442 -8.403 4.234 3.512 1.00 10.00 H new ATOM 0 HG2 GLU A 442 -9.932 4.450 1.465 1.00 10.00 H new ATOM 0 HG3 GLU A 442 -9.332 2.882 0.962 1.00 10.00 H new ATOM 501 N LYS A 443 -5.236 4.870 3.077 1.00 10.00 N ATOM 502 CA LYS A 443 -4.302 5.516 3.981 1.00 10.00 C ATOM 503 C LYS A 443 -3.693 6.725 3.296 1.00 10.00 C ATOM 504 O LYS A 443 -3.573 7.794 3.887 1.00 10.00 O ATOM 505 CB LYS A 443 -3.207 4.542 4.417 1.00 10.00 C ATOM 506 CG LYS A 443 -3.487 3.871 5.752 1.00 10.00 C ATOM 507 CD LYS A 443 -4.532 2.777 5.617 1.00 10.00 C ATOM 508 CE LYS A 443 -5.124 2.402 6.967 1.00 10.00 C ATOM 509 NZ LYS A 443 -6.422 1.686 6.825 1.00 10.00 N ATOM 0 H LYS A 443 -4.952 3.944 2.759 1.00 10.00 H new ATOM 0 HA LYS A 443 -4.838 5.839 4.873 1.00 10.00 H new ATOM 0 HB2 LYS A 443 -3.089 3.775 3.652 1.00 10.00 H new ATOM 0 HB3 LYS A 443 -2.260 5.078 4.480 1.00 10.00 H new ATOM 0 HG2 LYS A 443 -2.564 3.447 6.148 1.00 10.00 H new ATOM 0 HG3 LYS A 443 -3.829 4.616 6.470 1.00 10.00 H new ATOM 0 HD2 LYS A 443 -5.327 3.112 4.950 1.00 10.00 H new ATOM 0 HD3 LYS A 443 -4.081 1.897 5.159 1.00 10.00 H new ATOM 0 HE2 LYS A 443 -4.419 1.772 7.510 1.00 10.00 H new ATOM 0 HE3 LYS A 443 -5.270 3.303 7.562 1.00 10.00 H new ATOM 0 HZ1 LYS A 443 -7.065 1.978 7.589 1.00 10.00 H new ATOM 0 HZ2 LYS A 443 -6.848 1.919 5.905 1.00 10.00 H new ATOM 0 HZ3 LYS A 443 -6.261 0.660 6.882 1.00 10.00 H new ATOM 523 N PHE A 444 -3.339 6.558 2.028 1.00 10.00 N ATOM 524 CA PHE A 444 -2.774 7.645 1.255 1.00 10.00 C ATOM 525 C PHE A 444 -3.790 8.769 1.184 1.00 10.00 C ATOM 526 O PHE A 444 -3.438 9.940 1.034 1.00 10.00 O ATOM 527 CB PHE A 444 -2.369 7.149 -0.132 1.00 10.00 C ATOM 528 CG PHE A 444 -1.640 8.169 -0.957 1.00 10.00 C ATOM 529 CD1 PHE A 444 -2.280 9.317 -1.397 1.00 10.00 C ATOM 530 CD2 PHE A 444 -0.311 7.975 -1.294 1.00 10.00 C ATOM 531 CE1 PHE A 444 -1.606 10.254 -2.156 1.00 10.00 C ATOM 532 CE2 PHE A 444 0.369 8.907 -2.054 1.00 10.00 C ATOM 533 CZ PHE A 444 -0.279 10.049 -2.486 1.00 10.00 C ATOM 0 H PHE A 444 -3.435 5.680 1.518 1.00 10.00 H new ATOM 0 HA PHE A 444 -1.871 8.024 1.733 1.00 10.00 H new ATOM 0 HB2 PHE A 444 -1.737 6.268 -0.021 1.00 10.00 H new ATOM 0 HB3 PHE A 444 -3.264 6.834 -0.669 1.00 10.00 H new ATOM 0 HD1 PHE A 444 -3.317 9.481 -1.144 1.00 10.00 H new ATOM 0 HD2 PHE A 444 0.200 7.085 -0.959 1.00 10.00 H new ATOM 0 HE1 PHE A 444 -2.115 11.146 -2.491 1.00 10.00 H new ATOM 0 HE2 PHE A 444 1.405 8.744 -2.310 1.00 10.00 H new ATOM 0 HZ PHE A 444 0.250 10.780 -3.080 1.00 10.00 H new ATOM 543 N MET A 445 -5.057 8.401 1.358 1.00 10.00 N ATOM 544 CA MET A 445 -6.126 9.373 1.382 1.00 10.00 C ATOM 545 C MET A 445 -6.135 10.032 2.757 1.00 10.00 C ATOM 546 O MET A 445 -6.389 11.229 2.893 1.00 10.00 O ATOM 547 CB MET A 445 -7.475 8.708 1.093 1.00 10.00 C ATOM 548 CG MET A 445 -7.971 8.932 -0.326 1.00 10.00 C ATOM 549 SD MET A 445 -9.150 10.291 -0.443 1.00 10.00 S ATOM 550 CE MET A 445 -9.656 10.155 -2.156 1.00 10.00 C ATOM 0 H MET A 445 -5.360 7.435 1.484 1.00 10.00 H new ATOM 0 HA MET A 445 -5.963 10.123 0.608 1.00 10.00 H new ATOM 0 HB2 MET A 445 -7.389 7.637 1.274 1.00 10.00 H new ATOM 0 HB3 MET A 445 -8.217 9.091 1.793 1.00 10.00 H new ATOM 0 HG2 MET A 445 -7.120 9.137 -0.976 1.00 10.00 H new ATOM 0 HG3 MET A 445 -8.439 8.018 -0.692 1.00 10.00 H new ATOM 0 HE1 MET A 445 -10.387 10.931 -2.382 1.00 10.00 H new ATOM 0 HE2 MET A 445 -8.787 10.275 -2.803 1.00 10.00 H new ATOM 0 HE3 MET A 445 -10.102 9.175 -2.327 1.00 10.00 H new ATOM 560 N GLN A 446 -5.811 9.225 3.769 1.00 10.00 N ATOM 561 CA GLN A 446 -5.726 9.689 5.147 1.00 10.00 C ATOM 562 C GLN A 446 -4.539 10.621 5.292 1.00 10.00 C ATOM 563 O GLN A 446 -4.580 11.616 6.015 1.00 10.00 O ATOM 564 CB GLN A 446 -5.525 8.500 6.091 1.00 10.00 C ATOM 565 CG GLN A 446 -6.719 7.561 6.160 1.00 10.00 C ATOM 566 CD GLN A 446 -6.369 6.215 6.762 1.00 10.00 C ATOM 567 OE1 GLN A 446 -5.578 6.128 7.701 1.00 10.00 O ATOM 568 NE2 GLN A 446 -6.957 5.154 6.222 1.00 10.00 N ATOM 0 H GLN A 446 -5.601 8.234 3.652 1.00 10.00 H new ATOM 0 HA GLN A 446 -6.651 10.208 5.400 1.00 10.00 H new ATOM 0 HB2 GLN A 446 -4.650 7.936 5.768 1.00 10.00 H new ATOM 0 HB3 GLN A 446 -5.312 8.875 7.092 1.00 10.00 H new ATOM 0 HG2 GLN A 446 -7.508 8.025 6.752 1.00 10.00 H new ATOM 0 HG3 GLN A 446 -7.118 7.413 5.157 1.00 10.00 H new ATOM 0 HE21 GLN A 446 -7.607 5.272 5.444 1.00 10.00 H new ATOM 0 HE22 GLN A 446 -6.759 4.221 6.585 1.00 10.00 H new ATOM 577 N HIS A 447 -3.472 10.253 4.601 1.00 10.00 N ATOM 578 CA HIS A 447 -2.227 10.993 4.626 1.00 10.00 C ATOM 579 C HIS A 447 -1.932 11.573 3.244 1.00 10.00 C ATOM 580 O HIS A 447 -1.073 11.074 2.519 1.00 10.00 O ATOM 581 CB HIS A 447 -1.113 10.048 5.085 1.00 10.00 C ATOM 582 CG HIS A 447 -1.598 9.021 6.074 1.00 10.00 C ATOM 583 ND1 HIS A 447 -1.862 9.324 7.395 1.00 10.00 N ATOM 584 CD2 HIS A 447 -1.911 7.704 5.926 1.00 10.00 C ATOM 585 CE1 HIS A 447 -2.313 8.245 8.010 1.00 10.00 C ATOM 586 NE2 HIS A 447 -2.352 7.254 7.144 1.00 10.00 N ATOM 0 H HIS A 447 -3.448 9.426 4.004 1.00 10.00 H new ATOM 0 HA HIS A 447 -2.295 11.829 5.322 1.00 10.00 H new ATOM 0 HB2 HIS A 447 -0.691 9.541 4.217 1.00 10.00 H new ATOM 0 HB3 HIS A 447 -0.310 10.631 5.536 1.00 10.00 H new ATOM 0 HD2 HIS A 447 -1.828 7.123 5.019 1.00 10.00 H new ATOM 0 HE1 HIS A 447 -2.601 8.186 9.049 1.00 10.00 H new ATOM 0 HE2 HIS A 447 -2.661 6.303 7.347 1.00 10.00 H new ATOM 595 N PRO A 448 -2.667 12.633 2.857 1.00 10.00 N ATOM 596 CA PRO A 448 -2.522 13.291 1.558 1.00 10.00 C ATOM 597 C PRO A 448 -1.072 13.425 1.102 1.00 10.00 C ATOM 598 O PRO A 448 -0.257 14.072 1.757 1.00 10.00 O ATOM 599 CB PRO A 448 -3.147 14.680 1.779 1.00 10.00 C ATOM 600 CG PRO A 448 -3.632 14.704 3.197 1.00 10.00 C ATOM 601 CD PRO A 448 -3.717 13.275 3.650 1.00 10.00 C ATOM 0 HA PRO A 448 -3.001 12.709 0.770 1.00 10.00 H new ATOM 0 HB2 PRO A 448 -2.414 15.468 1.606 1.00 10.00 H new ATOM 0 HB3 PRO A 448 -3.969 14.851 1.084 1.00 10.00 H new ATOM 0 HG2 PRO A 448 -2.949 15.270 3.830 1.00 10.00 H new ATOM 0 HG3 PRO A 448 -4.605 15.190 3.265 1.00 10.00 H new ATOM 0 HD2 PRO A 448 -3.536 13.176 4.720 1.00 10.00 H new ATOM 0 HD3 PRO A 448 -4.698 12.843 3.451 1.00 10.00 H new ATOM 609 N LYS A 449 -0.771 12.816 -0.044 1.00 10.00 N ATOM 610 CA LYS A 449 0.568 12.864 -0.627 1.00 10.00 C ATOM 611 C LYS A 449 1.654 12.578 0.407 1.00 10.00 C ATOM 612 O LYS A 449 2.044 13.461 1.172 1.00 10.00 O ATOM 613 CB LYS A 449 0.813 14.230 -1.269 1.00 10.00 C ATOM 614 CG LYS A 449 2.102 14.305 -2.070 1.00 10.00 C ATOM 615 CD LYS A 449 2.091 15.478 -3.036 1.00 10.00 C ATOM 616 CE LYS A 449 1.255 15.176 -4.269 1.00 10.00 C ATOM 617 NZ LYS A 449 2.095 14.735 -5.416 1.00 10.00 N ATOM 0 H LYS A 449 -1.444 12.279 -0.591 1.00 10.00 H new ATOM 0 HA LYS A 449 0.620 12.085 -1.387 1.00 10.00 H new ATOM 0 HB2 LYS A 449 -0.025 14.470 -1.923 1.00 10.00 H new ATOM 0 HB3 LYS A 449 0.836 14.990 -0.488 1.00 10.00 H new ATOM 0 HG2 LYS A 449 2.949 14.400 -1.390 1.00 10.00 H new ATOM 0 HG3 LYS A 449 2.241 13.377 -2.625 1.00 10.00 H new ATOM 0 HD2 LYS A 449 1.695 16.361 -2.534 1.00 10.00 H new ATOM 0 HD3 LYS A 449 3.112 15.713 -3.336 1.00 10.00 H new ATOM 0 HE2 LYS A 449 0.527 14.400 -4.033 1.00 10.00 H new ATOM 0 HE3 LYS A 449 0.692 16.065 -4.552 1.00 10.00 H new ATOM 0 HZ1 LYS A 449 1.487 14.539 -6.237 1.00 10.00 H new ATOM 0 HZ2 LYS A 449 2.773 15.486 -5.659 1.00 10.00 H new ATOM 0 HZ3 LYS A 449 2.613 13.872 -5.155 1.00 10.00 H new ATOM 631 N ASN A 450 2.151 11.347 0.412 1.00 10.00 N ATOM 632 CA ASN A 450 3.206 10.958 1.339 1.00 10.00 C ATOM 633 C ASN A 450 3.873 9.657 0.902 1.00 10.00 C ATOM 634 O ASN A 450 5.077 9.625 0.649 1.00 10.00 O ATOM 635 CB ASN A 450 2.656 10.828 2.765 1.00 10.00 C ATOM 636 CG ASN A 450 1.572 9.775 2.883 1.00 10.00 C ATOM 637 OD1 ASN A 450 0.773 9.586 1.966 1.00 10.00 O ATOM 638 ND2 ASN A 450 1.545 9.075 4.011 1.00 10.00 N ATOM 0 H ASN A 450 1.841 10.603 -0.214 1.00 10.00 H new ATOM 0 HA ASN A 450 3.962 11.743 1.331 1.00 10.00 H new ATOM 0 HB2 ASN A 450 3.472 10.580 3.443 1.00 10.00 H new ATOM 0 HB3 ASN A 450 2.257 11.791 3.085 1.00 10.00 H new ATOM 0 HD21 ASN A 450 0.843 8.347 4.143 1.00 10.00 H new ATOM 0 HD22 ASN A 450 2.227 9.265 4.746 1.00 10.00 H new ATOM 645 N PHE A 451 3.090 8.588 0.819 1.00 10.00 N ATOM 646 CA PHE A 451 3.606 7.282 0.417 1.00 10.00 C ATOM 647 C PHE A 451 4.557 6.702 1.467 1.00 10.00 C ATOM 648 O PHE A 451 4.876 5.514 1.429 1.00 10.00 O ATOM 649 CB PHE A 451 4.304 7.385 -0.945 1.00 10.00 C ATOM 650 CG PHE A 451 3.708 6.503 -2.011 1.00 10.00 C ATOM 651 CD1 PHE A 451 2.368 6.157 -1.979 1.00 10.00 C ATOM 652 CD2 PHE A 451 4.491 6.028 -3.051 1.00 10.00 C ATOM 653 CE1 PHE A 451 1.818 5.355 -2.957 1.00 10.00 C ATOM 654 CE2 PHE A 451 3.947 5.223 -4.035 1.00 10.00 C ATOM 655 CZ PHE A 451 2.608 4.886 -3.988 1.00 10.00 C ATOM 0 H PHE A 451 2.091 8.599 1.025 1.00 10.00 H new ATOM 0 HA PHE A 451 2.760 6.600 0.331 1.00 10.00 H new ATOM 0 HB2 PHE A 451 4.266 8.421 -1.283 1.00 10.00 H new ATOM 0 HB3 PHE A 451 5.356 7.128 -0.822 1.00 10.00 H new ATOM 0 HD1 PHE A 451 1.744 6.521 -1.176 1.00 10.00 H new ATOM 0 HD2 PHE A 451 5.538 6.289 -3.094 1.00 10.00 H new ATOM 0 HE1 PHE A 451 0.771 5.094 -2.917 1.00 10.00 H new ATOM 0 HE2 PHE A 451 4.568 4.858 -4.840 1.00 10.00 H new ATOM 0 HZ PHE A 451 2.180 4.258 -4.755 1.00 10.00 H new ATOM 665 N GLY A 452 4.996 7.533 2.411 1.00 10.00 N ATOM 666 CA GLY A 452 5.885 7.066 3.453 1.00 10.00 C ATOM 667 C GLY A 452 5.147 6.262 4.502 1.00 10.00 C ATOM 668 O GLY A 452 5.590 5.180 4.887 1.00 10.00 O ATOM 0 H GLY A 452 4.749 8.521 2.469 1.00 10.00 H new ATOM 0 HA2 GLY A 452 6.672 6.454 3.012 1.00 10.00 H new ATOM 0 HA3 GLY A 452 6.372 7.919 3.925 1.00 10.00 H new ATOM 672 N LEU A 453 4.009 6.785 4.959 1.00 10.00 N ATOM 673 CA LEU A 453 3.208 6.092 5.959 1.00 10.00 C ATOM 674 C LEU A 453 2.691 4.781 5.401 1.00 10.00 C ATOM 675 O LEU A 453 2.912 3.717 5.980 1.00 10.00 O ATOM 676 CB LEU A 453 2.032 6.950 6.421 1.00 10.00 C ATOM 677 CG LEU A 453 1.035 6.228 7.331 1.00 10.00 C ATOM 678 CD1 LEU A 453 0.373 7.212 8.278 1.00 10.00 C ATOM 679 CD2 LEU A 453 -0.005 5.480 6.501 1.00 10.00 C ATOM 0 H LEU A 453 3.626 7.680 4.653 1.00 10.00 H new ATOM 0 HA LEU A 453 3.849 5.895 6.818 1.00 10.00 H new ATOM 0 HB2 LEU A 453 2.420 7.821 6.948 1.00 10.00 H new ATOM 0 HB3 LEU A 453 1.501 7.319 5.543 1.00 10.00 H new ATOM 0 HG LEU A 453 1.577 5.495 7.929 1.00 10.00 H new ATOM 0 HD11 LEU A 453 -0.333 6.682 8.918 1.00 10.00 H new ATOM 0 HD12 LEU A 453 1.133 7.691 8.895 1.00 10.00 H new ATOM 0 HD13 LEU A 453 -0.158 7.970 7.702 1.00 10.00 H new ATOM 0 HD21 LEU A 453 -0.705 4.973 7.165 1.00 10.00 H new ATOM 0 HD22 LEU A 453 -0.548 6.188 5.874 1.00 10.00 H new ATOM 0 HD23 LEU A 453 0.494 4.744 5.870 1.00 10.00 H new ATOM 691 N ILE A 454 2.011 4.856 4.264 1.00 10.00 N ATOM 692 CA ILE A 454 1.481 3.665 3.629 1.00 10.00 C ATOM 693 C ILE A 454 2.593 2.654 3.427 1.00 10.00 C ATOM 694 O ILE A 454 2.493 1.511 3.863 1.00 10.00 O ATOM 695 CB ILE A 454 0.804 4.012 2.293 1.00 10.00 C ATOM 696 CG1 ILE A 454 -0.582 4.552 2.583 1.00 10.00 C ATOM 697 CG2 ILE A 454 0.735 2.808 1.361 1.00 10.00 C ATOM 698 CD1 ILE A 454 -0.615 6.061 2.630 1.00 10.00 C ATOM 0 H ILE A 454 1.816 5.726 3.768 1.00 10.00 H new ATOM 0 HA ILE A 454 0.723 3.227 4.279 1.00 10.00 H new ATOM 0 HB ILE A 454 1.399 4.767 1.779 1.00 10.00 H new ATOM 0 HG12 ILE A 454 -1.273 4.200 1.817 1.00 10.00 H new ATOM 0 HG13 ILE A 454 -0.932 4.154 3.536 1.00 10.00 H new ATOM 0 HG21 ILE A 454 0.250 3.097 0.429 1.00 10.00 H new ATOM 0 HG22 ILE A 454 1.744 2.453 1.150 1.00 10.00 H new ATOM 0 HG23 ILE A 454 0.162 2.012 1.837 1.00 10.00 H new ATOM 0 HD11 ILE A 454 -1.630 6.396 2.841 1.00 10.00 H new ATOM 0 HD12 ILE A 454 0.054 6.415 3.414 1.00 10.00 H new ATOM 0 HD13 ILE A 454 -0.293 6.462 1.669 1.00 10.00 H new ATOM 710 N ALA A 455 3.673 3.107 2.809 1.00 10.00 N ATOM 711 CA ALA A 455 4.836 2.262 2.583 1.00 10.00 C ATOM 712 C ALA A 455 5.466 1.842 3.910 1.00 10.00 C ATOM 713 O ALA A 455 6.434 1.081 3.933 1.00 10.00 O ATOM 714 CB ALA A 455 5.855 2.992 1.723 1.00 10.00 C ATOM 0 H ALA A 455 3.768 4.058 2.454 1.00 10.00 H new ATOM 0 HA ALA A 455 4.512 1.363 2.059 1.00 10.00 H new ATOM 0 HB1 ALA A 455 6.721 2.350 1.561 1.00 10.00 H new ATOM 0 HB2 ALA A 455 5.406 3.245 0.763 1.00 10.00 H new ATOM 0 HB3 ALA A 455 6.170 3.905 2.228 1.00 10.00 H new ATOM 720 N SER A 456 4.916 2.347 5.017 1.00 10.00 N ATOM 721 CA SER A 456 5.431 2.024 6.340 1.00 10.00 C ATOM 722 C SER A 456 4.604 0.926 7.001 1.00 10.00 C ATOM 723 O SER A 456 5.150 0.066 7.693 1.00 10.00 O ATOM 724 CB SER A 456 5.447 3.274 7.226 1.00 10.00 C ATOM 725 OG SER A 456 6.774 3.658 7.541 1.00 10.00 O ATOM 0 H SER A 456 4.116 2.980 5.019 1.00 10.00 H new ATOM 0 HA SER A 456 6.451 1.658 6.221 1.00 10.00 H new ATOM 0 HB2 SER A 456 4.940 4.092 6.715 1.00 10.00 H new ATOM 0 HB3 SER A 456 4.893 3.080 8.145 1.00 10.00 H new ATOM 0 HG SER A 456 6.758 4.459 8.106 1.00 10.00 H new ATOM 731 N PHE A 457 3.289 0.953 6.793 1.00 10.00 N ATOM 732 CA PHE A 457 2.420 -0.057 7.388 1.00 10.00 C ATOM 733 C PHE A 457 2.399 -1.332 6.539 1.00 10.00 C ATOM 734 O PHE A 457 2.082 -2.412 7.037 1.00 10.00 O ATOM 735 CB PHE A 457 1.003 0.501 7.597 1.00 10.00 C ATOM 736 CG PHE A 457 0.117 0.424 6.387 1.00 10.00 C ATOM 737 CD1 PHE A 457 -0.417 -0.790 5.984 1.00 10.00 C ATOM 738 CD2 PHE A 457 -0.181 1.563 5.653 1.00 10.00 C ATOM 739 CE1 PHE A 457 -1.228 -0.868 4.871 1.00 10.00 C ATOM 740 CE2 PHE A 457 -0.992 1.489 4.540 1.00 10.00 C ATOM 741 CZ PHE A 457 -1.514 0.275 4.148 1.00 10.00 C ATOM 0 H PHE A 457 2.809 1.652 6.226 1.00 10.00 H new ATOM 0 HA PHE A 457 2.823 -0.321 8.366 1.00 10.00 H new ATOM 0 HB2 PHE A 457 0.529 -0.043 8.414 1.00 10.00 H new ATOM 0 HB3 PHE A 457 1.079 1.542 7.910 1.00 10.00 H new ATOM 0 HD1 PHE A 457 -0.196 -1.684 6.547 1.00 10.00 H new ATOM 0 HD2 PHE A 457 0.226 2.516 5.956 1.00 10.00 H new ATOM 0 HE1 PHE A 457 -1.638 -1.819 4.565 1.00 10.00 H new ATOM 0 HE2 PHE A 457 -1.218 2.382 3.976 1.00 10.00 H new ATOM 0 HZ PHE A 457 -2.147 0.217 3.275 1.00 10.00 H new ATOM 751 N LEU A 458 2.757 -1.203 5.260 1.00 10.00 N ATOM 752 CA LEU A 458 2.796 -2.350 4.355 1.00 10.00 C ATOM 753 C LEU A 458 4.176 -2.469 3.706 1.00 10.00 C ATOM 754 O LEU A 458 4.306 -2.464 2.484 1.00 10.00 O ATOM 755 CB LEU A 458 1.707 -2.236 3.281 1.00 10.00 C ATOM 756 CG LEU A 458 1.495 -0.833 2.707 1.00 10.00 C ATOM 757 CD1 LEU A 458 2.791 -0.288 2.129 1.00 10.00 C ATOM 758 CD2 LEU A 458 0.402 -0.848 1.644 1.00 10.00 C ATOM 0 H LEU A 458 3.023 -0.317 4.830 1.00 10.00 H new ATOM 0 HA LEU A 458 2.605 -3.251 4.938 1.00 10.00 H new ATOM 0 HB2 LEU A 458 1.956 -2.911 2.462 1.00 10.00 H new ATOM 0 HB3 LEU A 458 0.765 -2.583 3.705 1.00 10.00 H new ATOM 0 HG LEU A 458 1.178 -0.177 3.518 1.00 10.00 H new ATOM 0 HD11 LEU A 458 2.618 0.710 1.726 1.00 10.00 H new ATOM 0 HD12 LEU A 458 3.546 -0.237 2.913 1.00 10.00 H new ATOM 0 HD13 LEU A 458 3.139 -0.946 1.332 1.00 10.00 H new ATOM 0 HD21 LEU A 458 0.266 0.158 1.248 1.00 10.00 H new ATOM 0 HD22 LEU A 458 0.690 -1.520 0.836 1.00 10.00 H new ATOM 0 HD23 LEU A 458 -0.532 -1.193 2.087 1.00 10.00 H new ATOM 770 N GLU A 459 5.201 -2.561 4.550 1.00 10.00 N ATOM 771 CA GLU A 459 6.597 -2.664 4.110 1.00 10.00 C ATOM 772 C GLU A 459 6.756 -3.439 2.800 1.00 10.00 C ATOM 773 O GLU A 459 7.503 -3.020 1.915 1.00 10.00 O ATOM 774 CB GLU A 459 7.439 -3.328 5.201 1.00 10.00 C ATOM 775 CG GLU A 459 7.444 -2.563 6.515 1.00 10.00 C ATOM 776 CD GLU A 459 8.775 -2.651 7.235 1.00 10.00 C ATOM 777 OE1 GLU A 459 9.754 -2.047 6.748 1.00 10.00 O ATOM 778 OE2 GLU A 459 8.840 -3.323 8.286 1.00 10.00 O ATOM 0 H GLU A 459 5.090 -2.567 5.564 1.00 10.00 H new ATOM 0 HA GLU A 459 6.944 -1.647 3.927 1.00 10.00 H new ATOM 0 HB2 GLU A 459 7.061 -4.335 5.378 1.00 10.00 H new ATOM 0 HB3 GLU A 459 8.464 -3.430 4.846 1.00 10.00 H new ATOM 0 HG2 GLU A 459 7.207 -1.516 6.323 1.00 10.00 H new ATOM 0 HG3 GLU A 459 6.659 -2.954 7.162 1.00 10.00 H new ATOM 785 N ARG A 460 6.062 -4.569 2.679 1.00 10.00 N ATOM 786 CA ARG A 460 6.145 -5.392 1.472 1.00 10.00 C ATOM 787 C ARG A 460 6.024 -4.535 0.215 1.00 10.00 C ATOM 788 O ARG A 460 6.590 -4.857 -0.829 1.00 10.00 O ATOM 789 CB ARG A 460 5.057 -6.468 1.480 1.00 10.00 C ATOM 790 CG ARG A 460 5.517 -7.799 2.056 1.00 10.00 C ATOM 791 CD ARG A 460 6.133 -7.629 3.435 1.00 10.00 C ATOM 792 NE ARG A 460 7.579 -7.427 3.369 1.00 10.00 N ATOM 793 CZ ARG A 460 8.455 -8.409 3.166 1.00 10.00 C ATOM 794 NH1 ARG A 460 8.038 -9.659 3.013 1.00 10.00 N ATOM 795 NH2 ARG A 460 9.753 -8.139 3.119 1.00 10.00 N ATOM 0 H ARG A 460 5.438 -4.935 3.398 1.00 10.00 H new ATOM 0 HA ARG A 460 7.121 -5.877 1.465 1.00 10.00 H new ATOM 0 HB2 ARG A 460 4.206 -6.107 2.057 1.00 10.00 H new ATOM 0 HB3 ARG A 460 4.707 -6.625 0.460 1.00 10.00 H new ATOM 0 HG2 ARG A 460 4.670 -8.482 2.117 1.00 10.00 H new ATOM 0 HG3 ARG A 460 6.246 -8.254 1.385 1.00 10.00 H new ATOM 0 HD2 ARG A 460 5.671 -6.778 3.936 1.00 10.00 H new ATOM 0 HD3 ARG A 460 5.917 -8.510 4.039 1.00 10.00 H new ATOM 0 HE ARG A 460 7.938 -6.479 3.485 1.00 10.00 H new ATOM 0 HH11 ARG A 460 7.041 -9.872 3.051 1.00 10.00 H new ATOM 0 HH12 ARG A 460 8.714 -10.407 2.858 1.00 10.00 H new ATOM 0 HH21 ARG A 460 10.079 -7.180 3.238 1.00 10.00 H new ATOM 0 HH22 ARG A 460 10.425 -8.891 2.964 1.00 10.00 H new ATOM 809 N LYS A 461 5.290 -3.435 0.332 1.00 10.00 N ATOM 810 CA LYS A 461 5.097 -2.516 -0.782 1.00 10.00 C ATOM 811 C LYS A 461 5.590 -1.120 -0.409 1.00 10.00 C ATOM 812 O LYS A 461 4.802 -0.183 -0.279 1.00 10.00 O ATOM 813 CB LYS A 461 3.622 -2.460 -1.205 1.00 10.00 C ATOM 814 CG LYS A 461 2.641 -2.992 -0.162 1.00 10.00 C ATOM 815 CD LYS A 461 2.658 -4.514 -0.059 1.00 10.00 C ATOM 816 CE LYS A 461 2.739 -5.183 -1.422 1.00 10.00 C ATOM 817 NZ LYS A 461 1.758 -4.610 -2.387 1.00 10.00 N ATOM 0 H LYS A 461 4.817 -3.157 1.192 1.00 10.00 H new ATOM 0 HA LYS A 461 5.679 -2.885 -1.627 1.00 10.00 H new ATOM 0 HB2 LYS A 461 3.363 -1.427 -1.435 1.00 10.00 H new ATOM 0 HB3 LYS A 461 3.499 -3.032 -2.125 1.00 10.00 H new ATOM 0 HG2 LYS A 461 2.883 -2.564 0.810 1.00 10.00 H new ATOM 0 HG3 LYS A 461 1.634 -2.660 -0.414 1.00 10.00 H new ATOM 0 HD2 LYS A 461 3.508 -4.826 0.547 1.00 10.00 H new ATOM 0 HD3 LYS A 461 1.759 -4.851 0.456 1.00 10.00 H new ATOM 0 HE2 LYS A 461 3.747 -5.071 -1.821 1.00 10.00 H new ATOM 0 HE3 LYS A 461 2.557 -6.252 -1.312 1.00 10.00 H new ATOM 0 HZ1 LYS A 461 1.284 -5.381 -2.899 1.00 10.00 H new ATOM 0 HZ2 LYS A 461 1.050 -4.050 -1.871 1.00 10.00 H new ATOM 0 HZ3 LYS A 461 2.255 -3.999 -3.066 1.00 10.00 H new ATOM 831 N THR A 462 6.902 -0.994 -0.233 1.00 10.00 N ATOM 832 CA THR A 462 7.511 0.283 0.132 1.00 10.00 C ATOM 833 C THR A 462 7.105 1.384 -0.842 1.00 10.00 C ATOM 834 O THR A 462 6.311 1.157 -1.754 1.00 10.00 O ATOM 835 CB THR A 462 9.034 0.152 0.164 1.00 10.00 C ATOM 836 OG1 THR A 462 9.419 -1.197 0.365 1.00 10.00 O ATOM 837 CG2 THR A 462 9.684 0.980 1.252 1.00 10.00 C ATOM 0 H THR A 462 7.566 -1.762 -0.337 1.00 10.00 H new ATOM 0 HA THR A 462 7.153 0.555 1.125 1.00 10.00 H new ATOM 0 HB THR A 462 9.374 0.520 -0.804 1.00 10.00 H new ATOM 0 HG1 THR A 462 10.397 -1.259 0.381 1.00 10.00 H new ATOM 0 HG21 THR A 462 10.765 0.841 1.219 1.00 10.00 H new ATOM 0 HG22 THR A 462 9.449 2.033 1.097 1.00 10.00 H new ATOM 0 HG23 THR A 462 9.307 0.663 2.225 1.00 10.00 H new ATOM 845 N VAL A 463 7.656 2.579 -0.645 1.00 10.00 N ATOM 846 CA VAL A 463 7.351 3.714 -1.510 1.00 10.00 C ATOM 847 C VAL A 463 7.679 3.392 -2.967 1.00 10.00 C ATOM 848 O VAL A 463 6.896 3.688 -3.869 1.00 10.00 O ATOM 849 CB VAL A 463 8.125 4.978 -1.072 1.00 10.00 C ATOM 850 CG1 VAL A 463 7.835 6.151 -1.999 1.00 10.00 C ATOM 851 CG2 VAL A 463 7.786 5.338 0.368 1.00 10.00 C ATOM 0 H VAL A 463 8.315 2.786 0.105 1.00 10.00 H new ATOM 0 HA VAL A 463 6.283 3.911 -1.420 1.00 10.00 H new ATOM 0 HB VAL A 463 9.191 4.758 -1.135 1.00 10.00 H new ATOM 0 HG11 VAL A 463 8.394 7.025 -1.665 1.00 10.00 H new ATOM 0 HG12 VAL A 463 8.135 5.895 -3.015 1.00 10.00 H new ATOM 0 HG13 VAL A 463 6.768 6.374 -1.981 1.00 10.00 H new ATOM 0 HG21 VAL A 463 8.340 6.230 0.660 1.00 10.00 H new ATOM 0 HG22 VAL A 463 6.717 5.531 0.453 1.00 10.00 H new ATOM 0 HG23 VAL A 463 8.059 4.511 1.024 1.00 10.00 H new ATOM 861 N ALA A 464 8.837 2.781 -3.188 1.00 10.00 N ATOM 862 CA ALA A 464 9.261 2.415 -4.534 1.00 10.00 C ATOM 863 C ALA A 464 8.493 1.197 -5.035 1.00 10.00 C ATOM 864 O ALA A 464 8.295 1.027 -6.238 1.00 10.00 O ATOM 865 CB ALA A 464 10.758 2.146 -4.563 1.00 10.00 C ATOM 0 H ALA A 464 9.498 2.529 -2.454 1.00 10.00 H new ATOM 0 HA ALA A 464 9.042 3.251 -5.198 1.00 10.00 H new ATOM 0 HB1 ALA A 464 11.059 1.874 -5.575 1.00 10.00 H new ATOM 0 HB2 ALA A 464 11.295 3.043 -4.253 1.00 10.00 H new ATOM 0 HB3 ALA A 464 10.994 1.328 -3.882 1.00 10.00 H new ATOM 871 N GLU A 465 8.059 0.354 -4.103 1.00 10.00 N ATOM 872 CA GLU A 465 7.309 -0.848 -4.450 1.00 10.00 C ATOM 873 C GLU A 465 5.808 -0.562 -4.527 1.00 10.00 C ATOM 874 O GLU A 465 5.034 -1.400 -4.987 1.00 10.00 O ATOM 875 CB GLU A 465 7.574 -1.951 -3.424 1.00 10.00 C ATOM 876 CG GLU A 465 6.955 -3.288 -3.794 1.00 10.00 C ATOM 877 CD GLU A 465 7.407 -3.784 -5.154 1.00 10.00 C ATOM 878 OE1 GLU A 465 8.632 -3.837 -5.388 1.00 10.00 O ATOM 879 OE2 GLU A 465 6.537 -4.121 -5.984 1.00 10.00 O ATOM 0 H GLU A 465 8.214 0.481 -3.103 1.00 10.00 H new ATOM 0 HA GLU A 465 7.645 -1.180 -5.432 1.00 10.00 H new ATOM 0 HB2 GLU A 465 8.651 -2.078 -3.309 1.00 10.00 H new ATOM 0 HB3 GLU A 465 7.185 -1.636 -2.456 1.00 10.00 H new ATOM 0 HG2 GLU A 465 7.216 -4.027 -3.037 1.00 10.00 H new ATOM 0 HG3 GLU A 465 5.869 -3.195 -3.788 1.00 10.00 H new ATOM 886 N CYS A 466 5.403 0.625 -4.078 1.00 10.00 N ATOM 887 CA CYS A 466 3.998 1.008 -4.104 1.00 10.00 C ATOM 888 C CYS A 466 3.645 1.678 -5.426 1.00 10.00 C ATOM 889 O CYS A 466 2.488 1.673 -5.845 1.00 10.00 O ATOM 890 CB CYS A 466 3.673 1.940 -2.935 1.00 10.00 C ATOM 891 SG CYS A 466 1.904 2.118 -2.604 1.00 10.00 S ATOM 0 H CYS A 466 6.028 1.334 -3.694 1.00 10.00 H new ATOM 0 HA CYS A 466 3.399 0.103 -4.005 1.00 10.00 H new ATOM 0 HB2 CYS A 466 4.164 1.564 -2.037 1.00 10.00 H new ATOM 0 HB3 CYS A 466 4.094 2.924 -3.141 1.00 10.00 H new ATOM 0 HG CYS A 466 1.530 3.331 -2.883 1.00 10.00 H new ATOM 897 N VAL A 467 4.651 2.241 -6.093 1.00 10.00 N ATOM 898 CA VAL A 467 4.437 2.893 -7.379 1.00 10.00 C ATOM 899 C VAL A 467 3.718 1.948 -8.337 1.00 10.00 C ATOM 900 O VAL A 467 3.059 2.380 -9.280 1.00 10.00 O ATOM 901 CB VAL A 467 5.769 3.347 -8.014 1.00 10.00 C ATOM 902 CG1 VAL A 467 5.539 3.922 -9.406 1.00 10.00 C ATOM 903 CG2 VAL A 467 6.464 4.363 -7.121 1.00 10.00 C ATOM 0 H VAL A 467 5.617 2.258 -5.765 1.00 10.00 H new ATOM 0 HA VAL A 467 3.822 3.775 -7.200 1.00 10.00 H new ATOM 0 HB VAL A 467 6.415 2.475 -8.112 1.00 10.00 H new ATOM 0 HG11 VAL A 467 6.492 4.235 -9.833 1.00 10.00 H new ATOM 0 HG12 VAL A 467 5.088 3.162 -10.044 1.00 10.00 H new ATOM 0 HG13 VAL A 467 4.872 4.782 -9.339 1.00 10.00 H new ATOM 0 HG21 VAL A 467 7.401 4.673 -7.583 1.00 10.00 H new ATOM 0 HG22 VAL A 467 5.820 5.232 -6.989 1.00 10.00 H new ATOM 0 HG23 VAL A 467 6.670 3.913 -6.150 1.00 10.00 H new ATOM 913 N LEU A 468 3.847 0.650 -8.081 1.00 10.00 N ATOM 914 CA LEU A 468 3.209 -0.358 -8.910 1.00 10.00 C ATOM 915 C LEU A 468 1.696 -0.379 -8.692 1.00 10.00 C ATOM 916 O LEU A 468 0.976 -1.101 -9.378 1.00 10.00 O ATOM 917 CB LEU A 468 3.806 -1.735 -8.612 1.00 10.00 C ATOM 918 CG LEU A 468 4.596 -2.362 -9.762 1.00 10.00 C ATOM 919 CD1 LEU A 468 5.907 -1.620 -9.975 1.00 10.00 C ATOM 920 CD2 LEU A 468 4.854 -3.835 -9.489 1.00 10.00 C ATOM 0 H LEU A 468 4.390 0.274 -7.303 1.00 10.00 H new ATOM 0 HA LEU A 468 3.393 -0.105 -9.954 1.00 10.00 H new ATOM 0 HB2 LEU A 468 4.462 -1.650 -7.745 1.00 10.00 H new ATOM 0 HB3 LEU A 468 2.998 -2.412 -8.335 1.00 10.00 H new ATOM 0 HG LEU A 468 4.003 -2.280 -10.673 1.00 10.00 H new ATOM 0 HD11 LEU A 468 6.456 -2.080 -10.797 1.00 10.00 H new ATOM 0 HD12 LEU A 468 5.700 -0.577 -10.215 1.00 10.00 H new ATOM 0 HD13 LEU A 468 6.506 -1.671 -9.066 1.00 10.00 H new ATOM 0 HD21 LEU A 468 5.417 -4.265 -10.317 1.00 10.00 H new ATOM 0 HD22 LEU A 468 5.427 -3.939 -8.568 1.00 10.00 H new ATOM 0 HD23 LEU A 468 3.903 -4.358 -9.386 1.00 10.00 H new ATOM 932 N TYR A 469 1.219 0.414 -7.733 1.00 10.00 N ATOM 933 CA TYR A 469 -0.207 0.483 -7.436 1.00 10.00 C ATOM 934 C TYR A 469 -0.766 1.874 -7.739 1.00 10.00 C ATOM 935 O TYR A 469 -1.979 2.068 -7.756 1.00 10.00 O ATOM 936 CB TYR A 469 -0.458 0.073 -5.970 1.00 10.00 C ATOM 937 CG TYR A 469 -1.065 1.116 -5.047 1.00 10.00 C ATOM 938 CD1 TYR A 469 -0.640 2.438 -5.074 1.00 10.00 C ATOM 939 CD2 TYR A 469 -2.055 0.765 -4.128 1.00 10.00 C ATOM 940 CE1 TYR A 469 -1.180 3.381 -4.226 1.00 10.00 C ATOM 941 CE2 TYR A 469 -2.599 1.710 -3.279 1.00 10.00 C ATOM 942 CZ TYR A 469 -2.157 3.015 -3.334 1.00 10.00 C ATOM 943 OH TYR A 469 -2.688 3.956 -2.487 1.00 10.00 O ATOM 0 H TYR A 469 1.801 1.016 -7.150 1.00 10.00 H new ATOM 0 HA TYR A 469 -0.736 -0.219 -8.081 1.00 10.00 H new ATOM 0 HB2 TYR A 469 -1.113 -0.798 -5.971 1.00 10.00 H new ATOM 0 HB3 TYR A 469 0.493 -0.244 -5.541 1.00 10.00 H new ATOM 0 HD1 TYR A 469 0.129 2.733 -5.773 1.00 10.00 H new ATOM 0 HD2 TYR A 469 -2.400 -0.257 -4.080 1.00 10.00 H new ATOM 0 HE1 TYR A 469 -0.836 4.404 -4.263 1.00 10.00 H new ATOM 0 HE2 TYR A 469 -3.368 1.427 -2.575 1.00 10.00 H new ATOM 0 HH TYR A 469 -2.307 3.842 -1.591 1.00 10.00 H new ATOM 953 N TYR A 470 0.126 2.842 -7.958 1.00 10.00 N ATOM 954 CA TYR A 470 -0.288 4.211 -8.232 1.00 10.00 C ATOM 955 C TYR A 470 -0.494 4.442 -9.726 1.00 10.00 C ATOM 956 O TYR A 470 -1.294 5.289 -10.120 1.00 10.00 O ATOM 957 CB TYR A 470 0.737 5.201 -7.652 1.00 10.00 C ATOM 958 CG TYR A 470 1.489 6.020 -8.683 1.00 10.00 C ATOM 959 CD1 TYR A 470 2.294 5.405 -9.630 1.00 10.00 C ATOM 960 CD2 TYR A 470 1.392 7.406 -8.703 1.00 10.00 C ATOM 961 CE1 TYR A 470 2.983 6.144 -10.571 1.00 10.00 C ATOM 962 CE2 TYR A 470 2.078 8.154 -9.640 1.00 10.00 C ATOM 963 CZ TYR A 470 2.872 7.518 -10.572 1.00 10.00 C ATOM 964 OH TYR A 470 3.558 8.259 -11.507 1.00 10.00 O ATOM 0 H TYR A 470 1.136 2.700 -7.950 1.00 10.00 H new ATOM 0 HA TYR A 470 -1.248 4.382 -7.745 1.00 10.00 H new ATOM 0 HB2 TYR A 470 0.220 5.882 -6.976 1.00 10.00 H new ATOM 0 HB3 TYR A 470 1.459 4.645 -7.054 1.00 10.00 H new ATOM 0 HD1 TYR A 470 2.384 4.329 -9.631 1.00 10.00 H new ATOM 0 HD2 TYR A 470 0.771 7.906 -7.975 1.00 10.00 H new ATOM 0 HE1 TYR A 470 3.605 5.649 -11.302 1.00 10.00 H new ATOM 0 HE2 TYR A 470 1.993 9.231 -9.643 1.00 10.00 H new ATOM 0 HH TYR A 470 3.371 9.211 -11.371 1.00 10.00 H new ATOM 974 N TYR A 471 0.223 3.693 -10.558 1.00 10.00 N ATOM 975 CA TYR A 471 0.084 3.848 -12.000 1.00 10.00 C ATOM 976 C TYR A 471 -1.144 3.093 -12.515 1.00 10.00 C ATOM 977 O TYR A 471 -1.488 3.185 -13.693 1.00 10.00 O ATOM 978 CB TYR A 471 1.361 3.400 -12.727 1.00 10.00 C ATOM 979 CG TYR A 471 1.488 1.904 -12.925 1.00 10.00 C ATOM 980 CD1 TYR A 471 0.745 1.249 -13.899 1.00 10.00 C ATOM 981 CD2 TYR A 471 2.357 1.152 -12.145 1.00 10.00 C ATOM 982 CE1 TYR A 471 0.862 -0.115 -14.088 1.00 10.00 C ATOM 983 CE2 TYR A 471 2.481 -0.213 -12.331 1.00 10.00 C ATOM 984 CZ TYR A 471 1.731 -0.841 -13.302 1.00 10.00 C ATOM 985 OH TYR A 471 1.852 -2.199 -13.489 1.00 10.00 O ATOM 0 H TYR A 471 0.895 2.984 -10.264 1.00 10.00 H new ATOM 0 HA TYR A 471 -0.064 4.907 -12.214 1.00 10.00 H new ATOM 0 HB2 TYR A 471 1.396 3.886 -13.702 1.00 10.00 H new ATOM 0 HB3 TYR A 471 2.225 3.752 -12.164 1.00 10.00 H new ATOM 0 HD1 TYR A 471 0.065 1.815 -14.519 1.00 10.00 H new ATOM 0 HD2 TYR A 471 2.945 1.640 -11.382 1.00 10.00 H new ATOM 0 HE1 TYR A 471 0.275 -0.610 -14.848 1.00 10.00 H new ATOM 0 HE2 TYR A 471 3.163 -0.784 -11.718 1.00 10.00 H new ATOM 0 HH TYR A 471 2.506 -2.559 -12.855 1.00 10.00 H new ATOM 995 N LEU A 472 -1.815 2.370 -11.620 1.00 10.00 N ATOM 996 CA LEU A 472 -3.019 1.630 -11.984 1.00 10.00 C ATOM 997 C LEU A 472 -4.253 2.431 -11.589 1.00 10.00 C ATOM 998 O LEU A 472 -5.255 2.448 -12.305 1.00 10.00 O ATOM 999 CB LEU A 472 -3.055 0.248 -11.314 1.00 10.00 C ATOM 1000 CG LEU A 472 -1.844 -0.103 -10.447 1.00 10.00 C ATOM 1001 CD1 LEU A 472 -2.056 -1.441 -9.756 1.00 10.00 C ATOM 1002 CD2 LEU A 472 -0.576 -0.127 -11.289 1.00 10.00 C ATOM 0 H LEU A 472 -1.545 2.282 -10.640 1.00 10.00 H new ATOM 0 HA LEU A 472 -3.009 1.478 -13.063 1.00 10.00 H new ATOM 0 HB2 LEU A 472 -3.951 0.188 -10.696 1.00 10.00 H new ATOM 0 HB3 LEU A 472 -3.153 -0.510 -12.092 1.00 10.00 H new ATOM 0 HG LEU A 472 -1.731 0.664 -9.681 1.00 10.00 H new ATOM 0 HD11 LEU A 472 -1.186 -1.676 -9.143 1.00 10.00 H new ATOM 0 HD12 LEU A 472 -2.942 -1.387 -9.123 1.00 10.00 H new ATOM 0 HD13 LEU A 472 -2.193 -2.220 -10.506 1.00 10.00 H new ATOM 0 HD21 LEU A 472 0.276 -0.378 -10.657 1.00 10.00 H new ATOM 0 HD22 LEU A 472 -0.676 -0.874 -12.077 1.00 10.00 H new ATOM 0 HD23 LEU A 472 -0.418 0.854 -11.737 1.00 10.00 H new ATOM 1014 N THR A 473 -4.165 3.104 -10.444 1.00 10.00 N ATOM 1015 CA THR A 473 -5.268 3.921 -9.952 1.00 10.00 C ATOM 1016 C THR A 473 -5.415 5.190 -10.782 1.00 10.00 C ATOM 1017 O THR A 473 -6.493 5.780 -10.841 1.00 10.00 O ATOM 1018 CB THR A 473 -5.080 4.263 -8.465 1.00 10.00 C ATOM 1019 OG1 THR A 473 -5.880 5.373 -8.103 1.00 10.00 O ATOM 1020 CG2 THR A 473 -3.651 4.583 -8.079 1.00 10.00 C ATOM 0 H THR A 473 -3.342 3.099 -9.841 1.00 10.00 H new ATOM 0 HA THR A 473 -6.185 3.340 -10.052 1.00 10.00 H new ATOM 0 HB THR A 473 -5.379 3.360 -7.932 1.00 10.00 H new ATOM 0 HG1 THR A 473 -5.310 6.160 -7.976 1.00 10.00 H new ATOM 0 HG21 THR A 473 -3.604 4.813 -7.015 1.00 10.00 H new ATOM 0 HG22 THR A 473 -3.015 3.724 -8.293 1.00 10.00 H new ATOM 0 HG23 THR A 473 -3.303 5.443 -8.652 1.00 10.00 H new ATOM 1028 N LYS A 474 -4.327 5.609 -11.423 1.00 10.00 N ATOM 1029 CA LYS A 474 -4.349 6.809 -12.246 1.00 10.00 C ATOM 1030 C LYS A 474 -4.505 6.457 -13.725 1.00 10.00 C ATOM 1031 O LYS A 474 -4.607 7.344 -14.572 1.00 10.00 O ATOM 1032 CB LYS A 474 -3.073 7.625 -12.035 1.00 10.00 C ATOM 1033 CG LYS A 474 -1.815 6.907 -12.485 1.00 10.00 C ATOM 1034 CD LYS A 474 -0.565 7.562 -11.922 1.00 10.00 C ATOM 1035 CE LYS A 474 0.119 8.440 -12.957 1.00 10.00 C ATOM 1036 NZ LYS A 474 -0.544 9.767 -13.087 1.00 10.00 N ATOM 0 H LYS A 474 -3.424 5.136 -11.387 1.00 10.00 H new ATOM 0 HA LYS A 474 -5.208 7.408 -11.942 1.00 10.00 H new ATOM 0 HB2 LYS A 474 -3.159 8.566 -12.578 1.00 10.00 H new ATOM 0 HB3 LYS A 474 -2.981 7.874 -10.978 1.00 10.00 H new ATOM 0 HG2 LYS A 474 -1.856 5.866 -12.166 1.00 10.00 H new ATOM 0 HG3 LYS A 474 -1.766 6.905 -13.574 1.00 10.00 H new ATOM 0 HD2 LYS A 474 -0.828 8.162 -11.051 1.00 10.00 H new ATOM 0 HD3 LYS A 474 0.128 6.793 -11.581 1.00 10.00 H new ATOM 0 HE2 LYS A 474 1.163 8.582 -12.679 1.00 10.00 H new ATOM 0 HE3 LYS A 474 0.112 7.935 -13.923 1.00 10.00 H new ATOM 0 HZ1 LYS A 474 0.002 10.365 -13.739 1.00 10.00 H new ATOM 0 HZ2 LYS A 474 -1.507 9.639 -13.458 1.00 10.00 H new ATOM 0 HZ3 LYS A 474 -0.591 10.225 -12.154 1.00 10.00 H new ATOM 1050 N LYS A 475 -4.533 5.159 -14.034 1.00 10.00 N ATOM 1051 CA LYS A 475 -4.688 4.706 -15.412 1.00 10.00 C ATOM 1052 C LYS A 475 -5.926 5.333 -16.041 1.00 10.00 C ATOM 1053 O LYS A 475 -5.911 5.741 -17.202 1.00 10.00 O ATOM 1054 CB LYS A 475 -4.789 3.181 -15.464 1.00 10.00 C ATOM 1055 CG LYS A 475 -4.114 2.566 -16.678 1.00 10.00 C ATOM 1056 CD LYS A 475 -4.238 1.051 -16.678 1.00 10.00 C ATOM 1057 CE LYS A 475 -3.143 0.402 -17.510 1.00 10.00 C ATOM 1058 NZ LYS A 475 -2.008 -0.064 -16.667 1.00 10.00 N ATOM 0 H LYS A 475 -4.450 4.408 -13.349 1.00 10.00 H new ATOM 0 HA LYS A 475 -3.810 5.019 -15.978 1.00 10.00 H new ATOM 0 HB2 LYS A 475 -4.342 2.765 -14.561 1.00 10.00 H new ATOM 0 HB3 LYS A 475 -5.841 2.895 -15.460 1.00 10.00 H new ATOM 0 HG2 LYS A 475 -4.561 2.968 -17.587 1.00 10.00 H new ATOM 0 HG3 LYS A 475 -3.061 2.846 -16.690 1.00 10.00 H new ATOM 0 HD2 LYS A 475 -4.186 0.681 -15.654 1.00 10.00 H new ATOM 0 HD3 LYS A 475 -5.213 0.765 -17.072 1.00 10.00 H new ATOM 0 HE2 LYS A 475 -3.557 -0.443 -18.060 1.00 10.00 H new ATOM 0 HE3 LYS A 475 -2.778 1.115 -18.249 1.00 10.00 H new ATOM 0 HZ1 LYS A 475 -1.283 -0.500 -17.271 1.00 10.00 H new ATOM 0 HZ2 LYS A 475 -1.596 0.746 -16.161 1.00 10.00 H new ATOM 0 HZ3 LYS A 475 -2.351 -0.764 -15.978 1.00 10.00 H new ATOM 1072 N ASN A 476 -6.990 5.420 -15.253 1.00 10.00 N ATOM 1073 CA ASN A 476 -8.239 6.013 -15.713 1.00 10.00 C ATOM 1074 C ASN A 476 -8.164 7.538 -15.643 1.00 10.00 C ATOM 1075 O ASN A 476 -8.940 8.238 -16.294 1.00 10.00 O ATOM 1076 CB ASN A 476 -9.411 5.507 -14.870 1.00 10.00 C ATOM 1077 CG ASN A 476 -10.096 4.307 -15.494 1.00 10.00 C ATOM 1078 OD1 ASN A 476 -9.631 3.175 -15.363 1.00 10.00 O ATOM 1079 ND2 ASN A 476 -11.208 4.550 -16.178 1.00 10.00 N ATOM 0 H ASN A 476 -7.013 5.086 -14.289 1.00 10.00 H new ATOM 0 HA ASN A 476 -8.398 5.718 -16.750 1.00 10.00 H new ATOM 0 HB2 ASN A 476 -9.052 5.241 -13.876 1.00 10.00 H new ATOM 0 HB3 ASN A 476 -10.137 6.310 -14.742 1.00 10.00 H new ATOM 0 HD21 ASN A 476 -11.713 3.782 -16.621 1.00 10.00 H new ATOM 0 HD22 ASN A 476 -11.557 5.505 -16.261 1.00 10.00 H new ATOM 1086 N GLU A 477 -7.219 8.042 -14.848 1.00 10.00 N ATOM 1087 CA GLU A 477 -7.027 9.479 -14.683 1.00 10.00 C ATOM 1088 C GLU A 477 -8.091 10.070 -13.765 1.00 10.00 C ATOM 1089 O GLU A 477 -8.876 10.924 -14.176 1.00 10.00 O ATOM 1090 CB GLU A 477 -7.050 10.191 -16.041 1.00 10.00 C ATOM 1091 CG GLU A 477 -6.289 9.451 -17.129 1.00 10.00 C ATOM 1092 CD GLU A 477 -5.820 10.369 -18.239 1.00 10.00 C ATOM 1093 OE1 GLU A 477 -5.464 11.528 -17.940 1.00 10.00 O ATOM 1094 OE2 GLU A 477 -5.809 9.930 -19.408 1.00 10.00 O ATOM 0 H GLU A 477 -6.572 7.470 -14.306 1.00 10.00 H new ATOM 0 HA GLU A 477 -6.050 9.633 -14.224 1.00 10.00 H new ATOM 0 HB2 GLU A 477 -8.085 10.320 -16.357 1.00 10.00 H new ATOM 0 HB3 GLU A 477 -6.625 11.188 -15.926 1.00 10.00 H new ATOM 0 HG2 GLU A 477 -5.427 8.950 -16.688 1.00 10.00 H new ATOM 0 HG3 GLU A 477 -6.928 8.675 -17.550 1.00 10.00 H new ATOM 1101 N ASN A 478 -8.110 9.615 -12.514 1.00 10.00 N ATOM 1102 CA ASN A 478 -9.079 10.112 -11.545 1.00 10.00 C ATOM 1103 C ASN A 478 -8.395 10.634 -10.290 1.00 10.00 C ATOM 1104 O ASN A 478 -9.008 10.727 -9.226 1.00 10.00 O ATOM 1105 CB ASN A 478 -10.090 9.023 -11.185 1.00 10.00 C ATOM 1106 CG ASN A 478 -11.496 9.566 -11.032 1.00 10.00 C ATOM 1107 OD1 ASN A 478 -11.695 10.771 -10.871 1.00 10.00 O ATOM 1108 ND2 ASN A 478 -12.483 8.678 -11.081 1.00 10.00 N ATOM 0 H ASN A 478 -7.470 8.908 -12.151 1.00 10.00 H new ATOM 0 HA ASN A 478 -9.610 10.944 -12.008 1.00 10.00 H new ATOM 0 HB2 ASN A 478 -10.083 8.255 -11.958 1.00 10.00 H new ATOM 0 HB3 ASN A 478 -9.786 8.542 -10.255 1.00 10.00 H new ATOM 0 HD21 ASN A 478 -13.451 8.985 -10.984 1.00 10.00 H new ATOM 0 HD22 ASN A 478 -12.273 7.689 -11.216 1.00 10.00 H new ATOM 1115 N TYR A 479 -7.129 10.987 -10.432 1.00 10.00 N ATOM 1116 CA TYR A 479 -6.348 11.521 -9.324 1.00 10.00 C ATOM 1117 C TYR A 479 -4.930 11.866 -9.772 1.00 10.00 C ATOM 1118 O TYR A 479 -4.212 11.018 -10.302 1.00 10.00 O ATOM 1119 CB TYR A 479 -6.322 10.525 -8.158 1.00 10.00 C ATOM 1120 CG TYR A 479 -5.180 9.534 -8.210 1.00 10.00 C ATOM 1121 CD1 TYR A 479 -5.311 8.324 -8.879 1.00 10.00 C ATOM 1122 CD2 TYR A 479 -3.973 9.808 -7.582 1.00 10.00 C ATOM 1123 CE1 TYR A 479 -4.276 7.418 -8.918 1.00 10.00 C ATOM 1124 CE2 TYR A 479 -2.930 8.905 -7.616 1.00 10.00 C ATOM 1125 CZ TYR A 479 -3.086 7.711 -8.284 1.00 10.00 C ATOM 1126 OH TYR A 479 -2.050 6.807 -8.321 1.00 10.00 O ATOM 0 H TYR A 479 -6.615 10.913 -11.310 1.00 10.00 H new ATOM 0 HA TYR A 479 -6.825 12.440 -8.982 1.00 10.00 H new ATOM 0 HB2 TYR A 479 -6.263 11.081 -7.222 1.00 10.00 H new ATOM 0 HB3 TYR A 479 -7.264 9.976 -8.144 1.00 10.00 H new ATOM 0 HD1 TYR A 479 -6.240 8.090 -9.377 1.00 10.00 H new ATOM 0 HD2 TYR A 479 -3.848 10.744 -7.058 1.00 10.00 H new ATOM 0 HE1 TYR A 479 -4.395 6.481 -9.443 1.00 10.00 H new ATOM 0 HE2 TYR A 479 -1.997 9.133 -7.122 1.00 10.00 H new ATOM 0 HH TYR A 479 -1.899 6.520 -9.246 1.00 10.00 H new ATOM 1136 N LYS A 480 -4.534 13.116 -9.556 1.00 10.00 N ATOM 1137 CA LYS A 480 -3.204 13.575 -9.938 1.00 10.00 C ATOM 1138 C LYS A 480 -2.465 14.162 -8.740 1.00 10.00 C ATOM 1139 O LYS A 480 -1.352 13.681 -8.439 1.00 10.00 O ATOM 1140 CB LYS A 480 -3.301 14.618 -11.052 1.00 10.00 C ATOM 1141 CG LYS A 480 -2.022 14.769 -11.860 1.00 10.00 C ATOM 1142 CD LYS A 480 -1.206 15.965 -11.395 1.00 10.00 C ATOM 1143 CE LYS A 480 -0.620 16.730 -12.571 1.00 10.00 C ATOM 1144 NZ LYS A 480 0.297 15.885 -13.382 1.00 10.00 N ATOM 1145 OXT LYS A 480 -3.006 15.096 -8.112 1.00 10.00 O ATOM 0 H LYS A 480 -5.116 13.830 -9.118 1.00 10.00 H new ATOM 0 HA LYS A 480 -2.642 12.715 -10.303 1.00 10.00 H new ATOM 0 HB2 LYS A 480 -4.115 14.345 -11.724 1.00 10.00 H new ATOM 0 HB3 LYS A 480 -3.560 15.582 -10.614 1.00 10.00 H new ATOM 0 HG2 LYS A 480 -1.424 13.862 -11.769 1.00 10.00 H new ATOM 0 HG3 LYS A 480 -2.269 14.884 -12.915 1.00 10.00 H new ATOM 0 HD2 LYS A 480 -1.837 16.630 -10.805 1.00 10.00 H new ATOM 0 HD3 LYS A 480 -0.401 15.626 -10.742 1.00 10.00 H new ATOM 0 HE2 LYS A 480 -1.428 17.098 -13.203 1.00 10.00 H new ATOM 0 HE3 LYS A 480 -0.080 17.602 -12.203 1.00 10.00 H new ATOM 0 HZ1 LYS A 480 0.778 16.476 -14.090 1.00 10.00 H new ATOM 0 HZ2 LYS A 480 1.004 15.444 -12.760 1.00 10.00 H new ATOM 0 HZ3 LYS A 480 -0.250 15.143 -13.864 1.00 10.00 H new TER 1159 LYS A 480